NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
631590 |
6e26   |
30492 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6e26
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 1403
_Distance_constraint_stats_list.Viol_count 439
_Distance_constraint_stats_list.Viol_total 816.020
_Distance_constraint_stats_list.Viol_max 0.465
_Distance_constraint_stats_list.Viol_rms 0.0155
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0015
_Distance_constraint_stats_list.Viol_average_violations_only 0.0929
_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 3 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 TRP 0.224 0.063 20 0 "[ . 1 . 2]"
1 12 SER 0.169 0.073 19 0 "[ . 1 . 2]"
1 13 VAL 1.234 0.465 18 0 "[ . 1 . 2]"
1 14 LEU 2.589 0.402 19 0 "[ . 1 . 2]"
1 15 GLU 1.499 0.404 19 0 "[ . 1 . 2]"
1 16 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 PHE 4.491 0.465 18 0 "[ . 1 . 2]"
1 18 ARG 1.810 0.304 20 0 "[ . 1 . 2]"
1 19 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 THR 1.003 0.152 15 0 "[ . 1 . 2]"
1 21 LEU 4.164 0.408 19 0 "[ . 1 . 2]"
1 22 THR 1.113 0.304 20 0 "[ . 1 . 2]"
1 23 SER 0.151 0.096 20 0 "[ . 1 . 2]"
1 24 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 ILE 4.322 0.328 19 0 "[ . 1 . 2]"
1 26 ASP 1.912 0.224 6 0 "[ . 1 . 2]"
1 27 PRO 1.770 0.200 16 0 "[ . 1 . 2]"
1 28 SER 0.604 0.200 16 0 "[ . 1 . 2]"
1 29 ARG 0.517 0.342 14 0 "[ . 1 . 2]"
1 30 ILE 4.553 0.248 5 0 "[ . 1 . 2]"
1 31 THR 3.610 0.262 14 0 "[ . 1 . 2]"
1 32 PRO 2.377 0.262 14 0 "[ . 1 . 2]"
1 33 TYR 4.448 0.248 5 0 "[ . 1 . 2]"
1 34 LEU 2.352 0.216 17 0 "[ . 1 . 2]"
1 35 ARG 1.017 0.134 15 0 "[ . 1 . 2]"
1 36 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 LYS 0.041 0.041 19 0 "[ . 1 . 2]"
1 39 VAL 0.348 0.277 5 0 "[ . 1 . 2]"
1 40 LEU 0.828 0.113 20 0 "[ . 1 . 2]"
1 41 ASN 0.086 0.086 3 0 "[ . 1 . 2]"
1 42 PRO 0.086 0.086 3 0 "[ . 1 . 2]"
1 43 ASP 0.012 0.007 16 0 "[ . 1 . 2]"
1 44 ASP 0.796 0.166 15 0 "[ . 1 . 2]"
1 45 GLU 0.423 0.170 5 0 "[ . 1 . 2]"
1 46 GLU 0.012 0.007 16 0 "[ . 1 . 2]"
1 47 GLN 0.741 0.142 19 0 "[ . 1 . 2]"
1 48 VAL 0.765 0.134 7 0 "[ . 1 . 2]"
1 49 LEU 0.987 0.225 19 0 "[ . 1 . 2]"
1 50 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 ASP 1.136 0.363 7 0 "[ . 1 . 2]"
1 52 PRO 0.669 0.326 18 0 "[ . 1 . 2]"
1 53 ASN 1.203 0.326 18 0 "[ . 1 . 2]"
1 54 LEU 1.847 0.363 7 0 "[ . 1 . 2]"
1 55 VAL 0.055 0.044 20 0 "[ . 1 . 2]"
1 56 ILE 0.333 0.077 14 0 "[ . 1 . 2]"
1 57 ARG 0.147 0.076 15 0 "[ . 1 . 2]"
1 58 LYS 0.061 0.039 6 0 "[ . 1 . 2]"
1 59 ARG 0.280 0.077 14 0 "[ . 1 . 2]"
1 60 LYS 0.178 0.166 15 0 "[ . 1 . 2]"
1 61 VAL 1.662 0.224 6 0 "[ . 1 . 2]"
1 62 GLY 0.063 0.063 6 0 "[ . 1 . 2]"
1 63 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 LEU 0.199 0.062 3 0 "[ . 1 . 2]"
1 65 LEU 0.139 0.123 7 0 "[ . 1 . 2]"
1 66 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ILE 0.611 0.166 15 0 "[ . 1 . 2]"
1 68 LEU 0.629 0.114 8 0 "[ . 1 . 2]"
1 69 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 ARG 0.062 0.062 6 0 "[ . 1 . 2]"
1 71 THR 0.981 0.114 8 0 "[ . 1 . 2]"
1 72 GLY 0.619 0.095 17 0 "[ . 1 . 2]"
1 73 HIS 1.100 0.236 6 0 "[ . 1 . 2]"
1 74 LYS 0.277 0.277 5 0 "[ . 1 . 2]"
1 75 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 TYR 1.163 0.236 6 0 "[ . 1 . 2]"
1 77 VAL 0.028 0.028 15 0 "[ . 1 . 2]"
1 78 ALA 0.112 0.082 19 0 "[ . 1 . 2]"
1 79 PHE 3.180 0.233 20 0 "[ . 1 . 2]"
1 80 LEU 0.209 0.066 20 0 "[ . 1 . 2]"
1 81 GLU 0.000 0.000 11 0 "[ . 1 . 2]"
1 82 SER 0.045 0.034 5 0 "[ . 1 . 2]"
1 83 LEU 5.218 0.402 19 0 "[ . 1 . 2]"
1 84 GLU 0.000 0.000 11 0 "[ . 1 . 2]"
1 85 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 TYR 0.183 0.049 18 0 "[ . 1 . 2]"
1 87 TYR 0.663 0.103 7 0 "[ . 1 . 2]"
1 88 PRO 0.574 0.232 17 0 "[ . 1 . 2]"
1 89 GLN 0.074 0.074 17 0 "[ . 1 . 2]"
1 90 LEU 1.942 0.152 15 0 "[ . 1 . 2]"
1 91 TYR 0.403 0.087 12 0 "[ . 1 . 2]"
1 92 LYS 0.890 0.232 17 0 "[ . 1 . 2]"
1 93 LYS 0.013 0.013 13 0 "[ . 1 . 2]"
1 94 VAL 1.620 0.147 13 0 "[ . 1 . 2]"
1 95 THR 0.473 0.147 13 0 "[ . 1 . 2]"
1 96 GLY 0.106 0.096 18 0 "[ . 1 . 2]"
1 97 LYS 0.096 0.096 18 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 40 LEU HA 1 41 ASN H 3.300 . 3.300 2.202 2.133 2.327 . 0 0 "[ . 1 . 2]" 1
2 1 40 LEU MD1 1 41 ASN H 4.411 . 4.411 2.657 1.917 3.272 . 0 0 "[ . 1 . 2]" 1
3 1 11 TRP HE1 1 72 GLY H 4.829 . 4.829 4.425 3.751 4.792 . 0 0 "[ . 1 . 2]" 1
4 1 35 ARG H 1 36 GLN H 3.817 . 3.817 2.719 2.594 2.931 . 0 0 "[ . 1 . 2]" 1
5 1 89 GLN H 1 90 LEU H 4.213 . 4.213 2.750 2.636 2.933 . 0 0 "[ . 1 . 2]" 1
6 1 74 LYS H 1 75 GLY H 4.169 . 4.169 2.439 2.294 2.570 . 0 0 "[ . 1 . 2]" 1
7 1 79 PHE H 1 80 LEU H 3.993 . 3.993 2.680 2.566 2.778 . 0 0 "[ . 1 . 2]" 1
8 1 20 THR H 1 21 LEU H 4.125 . 4.125 2.631 2.419 2.917 . 0 0 "[ . 1 . 2]" 1
9 1 22 THR H 1 23 SER H 3.861 . 3.861 2.672 2.568 2.820 . 0 0 "[ . 1 . 2]" 1
10 1 80 LEU H 1 81 GLU H 3.971 . 3.971 2.785 2.709 2.867 . 0 0 "[ . 1 . 2]" 1
11 1 67 ILE H 1 68 LEU H 3.872 . 3.872 2.723 2.583 2.835 . 0 0 "[ . 1 . 2]" 1
12 1 65 LEU H 1 66 ASP H 3.784 . 3.784 2.687 2.541 2.795 . 0 0 "[ . 1 . 2]" 1
13 1 91 TYR H 1 92 LYS H 4.037 . 4.037 2.844 2.605 2.962 . 0 0 "[ . 1 . 2]" 1
14 1 4 TYR H 1 5 GLU H 5.137 . 5.137 3.825 2.330 4.600 . 0 0 "[ . 1 . 2]" 1
15 1 28 SER H 1 29 ARG H 4.114 . 4.114 2.679 2.513 2.870 . 0 0 "[ . 1 . 2]" 1
16 1 36 GLN H 1 37 CYS H 3.674 . 3.674 2.756 2.653 2.911 . 0 0 "[ . 1 . 2]" 1
17 1 76 TYR H 1 77 VAL H 3.971 . 3.971 2.803 2.653 2.968 . 0 0 "[ . 1 . 2]" 1
18 1 66 ASP H 1 67 ILE H 3.795 . 3.795 2.739 2.617 2.893 . 0 0 "[ . 1 . 2]" 1
19 1 77 VAL H 1 78 ALA H 3.938 . 3.938 2.804 2.683 2.950 . 0 0 "[ . 1 . 2]" 1
20 1 16 GLY H 1 17 PHE H 4.246 . 4.246 2.761 2.688 2.910 . 0 0 "[ . 1 . 2]" 1
21 1 53 ASN H 1 54 LEU H 4.433 . 4.433 2.441 1.683 3.966 . 0 0 "[ . 1 . 2]" 1
22 1 59 ARG H 1 60 LYS H 4.213 . 4.213 2.627 2.422 2.826 . 0 0 "[ . 1 . 2]" 1
23 1 60 LYS H 1 61 VAL H 4.059 . 4.059 2.753 2.684 2.836 . 0 0 "[ . 1 . 2]" 1
24 1 14 LEU H 1 15 GLU H 3.729 . 3.729 2.688 2.489 2.824 . 0 0 "[ . 1 . 2]" 1
25 1 17 PHE H 1 18 ARG H 3.564 . 3.564 2.538 2.322 2.850 . 0 0 "[ . 1 . 2]" 1
26 1 83 LEU H 1 84 GLU H 3.817 . 3.817 2.666 2.608 2.748 . 0 0 "[ . 1 . 2]" 1
27 1 38 LYS H 1 40 LEU H 4.950 . 4.950 4.142 3.910 4.522 . 0 0 "[ . 1 . 2]" 1
28 1 37 CYS H 1 38 LYS H 3.696 . 3.696 2.581 2.474 2.659 . 0 0 "[ . 1 . 2]" 1
29 1 34 LEU H 1 35 ARG H 3.883 . 3.883 2.744 2.600 2.900 . 0 0 "[ . 1 . 2]" 1
30 1 33 TYR H 1 34 LEU H 3.762 . 3.762 2.634 2.486 2.822 . 0 0 "[ . 1 . 2]" 1
31 1 63 VAL H 1 64 LEU H 3.773 . 3.773 2.694 2.602 2.766 . 0 0 "[ . 1 . 2]" 1
32 1 64 LEU H 1 65 LEU H 3.883 . 3.883 2.748 2.616 2.888 . 0 0 "[ . 1 . 2]" 1
33 1 11 TRP HE1 1 76 TYR H 4.477 . 4.477 3.187 2.613 4.119 . 0 0 "[ . 1 . 2]" 1
34 1 48 VAL H 1 49 LEU H 3.773 . 3.773 2.619 2.370 2.817 . 0 0 "[ . 1 . 2]" 1
35 1 49 LEU H 1 50 SER H 3.883 . 3.883 2.643 2.546 2.798 . 0 0 "[ . 1 . 2]" 1
36 1 68 LEU H 1 69 GLN H 3.905 . 3.905 2.607 2.471 2.761 . 0 0 "[ . 1 . 2]" 1
37 1 92 LYS H 1 93 LYS H 3.564 . 3.564 2.736 2.580 2.879 . 0 0 "[ . 1 . 2]" 1
38 1 62 GLY H 1 63 VAL H 3.795 . 3.795 2.808 2.712 2.944 . 0 0 "[ . 1 . 2]" 1
39 1 61 VAL H 1 62 GLY H 3.905 . 3.905 2.714 2.579 2.987 . 0 0 "[ . 1 . 2]" 1
40 1 69 GLN H 1 70 ARG H 3.817 . 3.817 2.716 2.530 2.950 . 0 0 "[ . 1 . 2]" 1
41 1 94 VAL H 1 96 GLY H 4.840 . 4.840 3.970 3.777 4.293 . 0 0 "[ . 1 . 2]" 1
42 1 94 VAL H 1 95 THR H 3.751 . 3.751 2.586 2.456 2.706 . 0 0 "[ . 1 . 2]" 1
43 1 43 ASP H 1 44 ASP H 3.817 . 3.817 2.744 2.614 2.860 . 0 0 "[ . 1 . 2]" 1
44 1 71 THR H 1 72 GLY H 3.608 . 3.608 2.768 2.577 2.861 . 0 0 "[ . 1 . 2]" 1
45 1 90 LEU H 1 91 TYR H 3.553 . 3.553 2.650 2.493 2.819 . 0 0 "[ . 1 . 2]" 1
46 1 10 CYS H 1 11 TRP H 4.147 . 4.147 2.652 2.436 2.854 . 0 0 "[ . 1 . 2]" 1
47 1 11 TRP H 1 12 SER H 4.180 . 4.180 2.666 2.541 2.766 . 0 0 "[ . 1 . 2]" 1
48 1 86 TYR H 1 87 TYR H 3.597 . 3.597 2.545 2.331 2.880 . 0 0 "[ . 1 . 2]" 1
49 1 46 GLU H 1 47 GLN H 3.839 . 3.839 2.752 2.650 2.840 . 0 0 "[ . 1 . 2]" 1
50 1 47 GLN H 1 48 VAL H 3.663 . 3.663 2.882 2.726 3.014 . 0 0 "[ . 1 . 2]" 1
51 1 55 VAL H 1 56 ILE H 3.971 . 3.971 2.628 2.439 2.768 . 0 0 "[ . 1 . 2]" 1
52 1 82 SER H 1 83 LEU H 4.004 . 4.004 2.723 2.615 2.806 . 0 0 "[ . 1 . 2]" 1
53 1 12 SER H 1 13 VAL H 4.059 . 4.059 2.708 2.556 2.852 . 0 0 "[ . 1 . 2]" 1
54 1 78 ALA H 1 79 PHE H 3.861 . 3.861 2.748 2.664 2.879 . 0 0 "[ . 1 . 2]" 1
55 1 11 TRP H 1 11 TRP HD1 4.389 . 4.389 3.113 2.631 3.580 . 0 0 "[ . 1 . 2]" 1
56 1 39 VAL H 1 40 LEU H 3.333 . 3.333 2.337 2.035 2.563 . 0 0 "[ . 1 . 2]" 1
57 1 38 LYS H 1 39 VAL H 3.850 . 3.850 2.805 2.694 2.947 . 0 0 "[ . 1 . 2]" 1
58 1 75 GLY H 1 76 TYR H 3.806 . 3.806 2.836 2.686 3.022 . 0 0 "[ . 1 . 2]" 1
59 1 23 SER H 1 24 VAL H 3.641 . 3.641 2.555 2.243 2.732 . 0 0 "[ . 1 . 2]" 1
60 1 58 LYS H 1 59 ARG H 4.532 . 4.532 2.807 2.614 2.962 . 0 0 "[ . 1 . 2]" 1
61 1 17 PHE H 1 17 PHE QD 4.433 . 4.433 2.743 2.383 3.183 . 0 0 "[ . 1 . 2]" 1
62 1 93 LYS H 1 94 VAL H 3.751 . 3.751 2.793 2.582 2.900 . 0 0 "[ . 1 . 2]" 1
63 1 95 THR H 1 96 GLY H 3.608 . 3.608 2.349 2.014 2.560 . 0 0 "[ . 1 . 2]" 1
64 1 24 VAL H 1 25 ILE H 3.553 . 3.553 2.476 2.295 2.657 . 0 0 "[ . 1 . 2]" 1
65 1 86 TYR H 1 86 TYR QD 4.202 . 4.202 2.496 2.098 3.002 . 0 0 "[ . 1 . 2]" 1
66 1 70 ARG H 1 71 THR H 3.729 . 3.729 2.726 2.634 2.833 . 0 0 "[ . 1 . 2]" 1
67 1 84 GLU H 1 85 LEU H 4.048 . 4.048 2.698 2.598 2.800 . 0 0 "[ . 1 . 2]" 1
68 1 87 TYR H 1 87 TYR QD 4.653 . 4.653 3.209 2.774 3.552 . 0 0 "[ . 1 . 2]" 1
69 1 85 LEU H 1 86 TYR H 3.773 . 3.773 2.527 2.345 2.661 . 0 0 "[ . 1 . 2]" 1
70 1 11 TRP HZ2 1 76 TYR H 4.917 . 4.917 3.158 2.595 3.592 . 0 0 "[ . 1 . 2]" 1
71 1 33 TYR H 1 33 TYR QD 4.752 . 4.752 4.257 4.191 4.300 . 0 0 "[ . 1 . 2]" 1
72 1 33 TYR QD 1 34 LEU H 4.642 . 4.642 3.698 3.289 4.181 . 0 0 "[ . 1 . 2]" 1
73 1 33 TYR QD 1 82 SER H 5.049 . 5.049 4.272 3.703 5.043 . 0 0 "[ . 1 . 2]" 1
74 1 29 ARG H 1 30 ILE H 3.707 . 3.707 2.596 2.403 2.837 . 0 0 "[ . 1 . 2]" 1
75 1 30 ILE H 1 31 THR H 3.509 . 3.509 2.380 2.133 2.834 . 0 0 "[ . 1 . 2]" 1
76 1 84 GLU H 1 91 TYR QD 4.972 . 4.972 3.902 3.553 4.173 . 0 0 "[ . 1 . 2]" 1
77 1 91 TYR QD 1 92 LYS H 4.609 . 4.609 3.260 2.883 4.291 . 0 0 "[ . 1 . 2]" 1
78 1 33 TYR QE 1 82 SER H 4.752 . 4.752 3.135 2.798 3.734 . 0 0 "[ . 1 . 2]" 1
79 1 76 TYR QD 1 77 VAL H 4.466 . 4.466 3.525 2.846 3.823 . 0 0 "[ . 1 . 2]" 1
80 1 71 THR H 1 71 THR HG1 5.027 . 5.027 4.511 4.335 4.649 . 0 0 "[ . 1 . 2]" 1
81 1 14 LEU HA 1 17 PHE H 4.741 . 4.741 3.418 3.117 3.763 . 0 0 "[ . 1 . 2]" 1
82 1 73 HIS HA 1 76 TYR H 4.851 . 4.851 4.433 3.715 4.723 . 0 0 "[ . 1 . 2]" 1
83 1 78 ALA HA 1 81 GLU H 4.477 . 4.477 3.554 3.355 3.923 . 0 0 "[ . 1 . 2]" 1
84 1 78 ALA HA 1 82 SER H 5.225 . 5.225 4.067 3.905 4.224 . 0 0 "[ . 1 . 2]" 1
85 1 35 ARG HA 1 40 LEU H 4.268 . 4.268 3.097 2.473 4.342 0.074 20 0 "[ . 1 . 2]" 1
86 1 43 ASP HA 1 46 GLU H 4.444 . 4.444 3.789 3.310 4.451 0.007 16 0 "[ . 1 . 2]" 1
87 1 44 ASP HA 1 47 GLN H 4.477 . 4.477 3.545 3.163 4.167 . 0 0 "[ . 1 . 2]" 1
88 1 35 ARG HA 1 39 VAL H 4.587 . 4.587 3.892 3.374 4.658 0.071 20 0 "[ . 1 . 2]" 1
89 1 54 LEU HA 1 55 VAL H 3.850 . 3.850 2.465 2.211 2.822 . 0 0 "[ . 1 . 2]" 1
90 1 35 ARG HA 1 38 LYS H 4.444 . 4.444 3.302 2.847 3.621 . 0 0 "[ . 1 . 2]" 1
91 1 12 SER HA 1 15 GLU H 4.620 . 4.620 3.399 3.053 3.966 . 0 0 "[ . 1 . 2]" 1
92 1 11 TRP HA 1 14 LEU H 4.499 . 4.499 3.276 2.948 3.542 . 0 0 "[ . 1 . 2]" 1
93 1 20 THR H 1 20 THR HB 3.894 . 3.894 2.578 2.443 2.682 . 0 0 "[ . 1 . 2]" 1
94 1 20 THR HB 1 21 LEU H 3.927 . 3.927 2.600 2.166 2.781 . 0 0 "[ . 1 . 2]" 1
95 1 56 ILE HA 1 59 ARG H 5.049 . 5.049 3.369 3.120 3.838 . 0 0 "[ . 1 . 2]" 1
96 1 59 ARG HA 1 62 GLY H 4.510 . 4.510 3.547 3.206 3.987 . 0 0 "[ . 1 . 2]" 1
97 1 32 PRO HA 1 35 ARG H 4.576 . 4.576 3.714 3.208 4.055 . 0 0 "[ . 1 . 2]" 1
98 1 15 GLU HA 1 18 ARG H 4.730 . 4.730 3.372 3.004 3.796 . 0 0 "[ . 1 . 2]" 1
99 1 42 PRO HA 1 45 GLU H 4.312 . 4.312 3.531 3.292 3.848 . 0 0 "[ . 1 . 2]" 1
100 1 89 GLN HA 1 92 LYS H 4.719 . 4.719 3.683 3.487 3.982 . 0 0 "[ . 1 . 2]" 1
101 1 88 PRO HA 1 91 TYR H 4.499 . 4.499 3.744 3.427 4.146 . 0 0 "[ . 1 . 2]" 1
102 1 90 LEU HA 1 93 LYS H 4.147 . 4.147 3.311 2.931 3.650 . 0 0 "[ . 1 . 2]" 1
103 1 83 LEU HA 1 87 TYR H 4.015 . 4.015 2.663 2.426 2.787 . 0 0 "[ . 1 . 2]" 1
104 1 60 LYS HA 1 63 VAL H 4.312 . 4.312 3.148 2.673 3.733 . 0 0 "[ . 1 . 2]" 1
105 1 66 ASP HA 1 69 GLN H 4.664 . 4.664 3.493 3.140 3.846 . 0 0 "[ . 1 . 2]" 1
106 1 74 LYS HA 1 77 VAL H 4.708 . 4.708 4.038 3.683 4.334 . 0 0 "[ . 1 . 2]" 1
107 1 12 SER QB 1 13 VAL H 4.257 . 4.257 2.817 2.386 3.572 . 0 0 "[ . 1 . 2]" 1
108 1 12 SER H 1 12 SER QB 3.509 . 3.509 2.354 2.262 2.572 . 0 0 "[ . 1 . 2]" 1
109 1 38 LYS HA 1 40 LEU H 4.400 . 4.400 3.701 3.284 4.206 . 0 0 "[ . 1 . 2]" 1
110 1 31 THR HA 1 34 LEU H 4.455 . 4.455 3.549 3.192 3.832 . 0 0 "[ . 1 . 2]" 1
111 1 20 THR HA 1 23 SER H 4.378 . 4.378 3.669 3.538 3.907 . 0 0 "[ . 1 . 2]" 1
112 1 93 LYS HA 1 95 THR H 5.115 . 5.115 4.458 4.170 5.128 0.013 13 0 "[ . 1 . 2]" 1
113 1 27 PRO HA 1 30 ILE H 4.389 . 4.389 3.584 3.167 4.171 . 0 0 "[ . 1 . 2]" 1
114 1 28 SER QB 1 29 ARG H 4.499 . 4.499 3.304 2.741 3.850 . 0 0 "[ . 1 . 2]" 1
115 1 28 SER H 1 28 SER QB 3.806 . 3.806 2.486 2.242 2.651 . 0 0 "[ . 1 . 2]" 1
116 1 96 GLY QA 1 97 LYS H 3.806 . 3.806 2.447 2.141 2.939 . 0 0 "[ . 1 . 2]" 1
117 1 82 SER H 1 82 SER HB2 4.334 . 4.334 3.263 2.473 3.698 . 0 0 "[ . 1 . 2]" 1
118 1 68 LEU HA 1 71 THR H 4.587 . 4.587 3.350 3.178 3.463 . 0 0 "[ . 1 . 2]" 1
119 1 21 LEU HA 1 24 VAL H 4.741 . 4.741 3.817 3.002 4.198 . 0 0 "[ . 1 . 2]" 1
120 1 21 LEU HA 1 25 ILE H 4.521 . 4.521 3.102 2.189 3.383 . 0 0 "[ . 1 . 2]" 1
121 1 64 LEU HA 1 67 ILE H 4.631 . 4.631 3.285 2.933 3.633 . 0 0 "[ . 1 . 2]" 1
122 1 81 GLU HA 1 84 GLU H 4.631 . 4.631 3.508 3.180 3.931 . 0 0 "[ . 1 . 2]" 1
123 1 42 PRO QD 1 43 ASP H 4.455 . 4.455 3.015 2.697 3.522 . 0 0 "[ . 1 . 2]" 1
124 1 18 ARG HA 1 21 LEU H 4.565 . 4.565 3.455 2.881 4.149 . 0 0 "[ . 1 . 2]" 1
125 1 63 VAL HA 1 66 ASP H 4.422 . 4.422 3.649 3.328 3.879 . 0 0 "[ . 1 . 2]" 1
126 1 82 SER H 1 82 SER HB3 4.334 . 4.334 2.649 2.545 3.612 . 0 0 "[ . 1 . 2]" 1
127 1 80 LEU HA 1 83 LEU H 4.257 . 4.257 3.622 3.212 4.277 0.020 20 0 "[ . 1 . 2]" 1
128 1 65 LEU HA 1 68 LEU H 4.477 . 4.477 3.563 3.197 4.221 . 0 0 "[ . 1 . 2]" 1
129 1 92 LYS HA 1 95 THR H 4.719 . 4.719 3.877 3.459 4.250 . 0 0 "[ . 1 . 2]" 1
130 1 33 TYR H 1 33 TYR HB3 3.751 . 3.751 2.644 2.452 2.794 . 0 0 "[ . 1 . 2]" 1
131 1 33 TYR HB3 1 34 LEU H 4.785 . 4.785 2.636 2.371 2.898 . 0 0 "[ . 1 . 2]" 1
132 1 61 VAL HA 1 64 LEU H 4.488 . 4.488 3.340 2.979 3.861 . 0 0 "[ . 1 . 2]" 1
133 1 79 PHE H 1 79 PHE HB3 3.729 . 3.729 2.714 2.616 3.095 . 0 0 "[ . 1 . 2]" 1
134 1 67 ILE HA 1 70 ARG H 4.895 . 4.895 3.592 3.112 3.932 . 0 0 "[ . 1 . 2]" 1
135 1 17 PHE HB3 1 21 LEU H 4.730 . 4.730 4.093 3.602 5.138 0.408 19 0 "[ . 1 . 2]" 1
136 1 87 TYR HB3 1 90 LEU H 4.587 . 4.587 3.373 2.988 3.781 . 0 0 "[ . 1 . 2]" 1
137 1 77 VAL HA 1 80 LEU H 4.499 . 4.499 3.664 3.379 3.876 . 0 0 "[ . 1 . 2]" 1
138 1 73 HIS HB2 1 74 LYS H 4.939 . 4.939 3.214 2.321 4.004 . 0 0 "[ . 1 . 2]" 1
139 1 11 TRP H 1 11 TRP HB3 4.301 . 4.301 3.609 3.564 3.646 . 0 0 "[ . 1 . 2]" 1
140 1 32 PRO HD2 1 33 TYR H 4.323 . 4.323 2.974 2.637 3.271 . 0 0 "[ . 1 . 2]" 1
141 1 31 THR H 1 32 PRO HD2 4.125 . 4.125 2.498 2.333 2.739 . 0 0 "[ . 1 . 2]" 1
142 1 79 PHE HB2 1 80 LEU H 4.015 . 4.015 3.786 3.630 3.913 . 0 0 "[ . 1 . 2]" 1
143 1 79 PHE H 1 79 PHE HB2 3.762 . 3.762 2.434 2.201 2.527 . 0 0 "[ . 1 . 2]" 1
144 1 33 TYR H 1 33 TYR HB2 3.751 . 3.751 2.541 2.379 2.666 . 0 0 "[ . 1 . 2]" 1
145 1 4 TYR H 1 4 TYR HB2 4.400 . 4.400 2.972 2.429 4.004 . 0 0 "[ . 1 . 2]" 1
146 1 33 TYR HB2 1 34 LEU H 4.785 . 4.785 3.856 3.640 4.060 . 0 0 "[ . 1 . 2]" 1
147 1 87 TYR H 1 88 PRO HD3 4.257 . 4.257 3.229 2.987 3.803 . 0 0 "[ . 1 . 2]" 1
148 1 25 ILE HA 1 26 ASP H 3.234 . 3.234 2.191 2.140 2.291 . 0 0 "[ . 1 . 2]" 1
149 1 91 TYR H 1 91 TYR HB3 3.740 . 3.740 2.426 2.333 2.693 . 0 0 "[ . 1 . 2]" 1
150 1 91 TYR HB3 1 92 LYS H 3.850 . 3.850 2.465 2.288 2.769 . 0 0 "[ . 1 . 2]" 1
151 1 4 TYR H 1 4 TYR HB3 4.400 . 4.400 3.290 2.384 3.897 . 0 0 "[ . 1 . 2]" 1
152 1 37 CYS H 1 37 CYS HB3 4.114 . 4.114 2.946 2.510 3.672 . 0 0 "[ . 1 . 2]" 1
153 1 66 ASP HB2 1 67 ILE H 4.565 . 4.565 3.910 3.761 4.070 . 0 0 "[ . 1 . 2]" 1
154 1 66 ASP H 1 66 ASP HB2 4.070 . 4.070 2.535 2.437 2.707 . 0 0 "[ . 1 . 2]" 1
155 1 44 ASP HB2 1 45 GLU H 4.147 . 4.147 2.898 2.372 3.836 . 0 0 "[ . 1 . 2]" 1
156 1 17 PHE H 1 17 PHE HB2 3.729 . 3.729 2.734 2.446 3.732 0.003 19 0 "[ . 1 . 2]" 1
157 1 76 TYR H 1 76 TYR HB3 3.751 . 3.751 2.536 2.281 2.691 . 0 0 "[ . 1 . 2]" 1
158 1 51 ASP H 1 51 ASP HB2 4.224 . 4.224 3.229 2.308 3.998 . 0 0 "[ . 1 . 2]" 1
159 1 8 ASP H 1 8 ASP HB2 4.356 . 4.356 2.797 2.346 3.638 . 0 0 "[ . 1 . 2]" 1
160 1 8 ASP H 1 8 ASP HB3 4.356 . 4.356 3.059 2.474 3.637 . 0 0 "[ . 1 . 2]" 1
161 1 37 CYS H 1 37 CYS HB2 4.114 . 4.114 2.626 2.433 3.633 . 0 0 "[ . 1 . 2]" 1
162 1 51 ASP H 1 51 ASP HB3 4.224 . 4.224 3.600 2.864 3.923 . 0 0 "[ . 1 . 2]" 1
163 1 43 ASP HB2 1 44 ASP H 4.961 . 4.961 2.537 2.177 3.811 . 0 0 "[ . 1 . 2]" 1
164 1 43 ASP HB3 1 44 ASP H 4.961 . 4.961 3.445 2.354 3.863 . 0 0 "[ . 1 . 2]" 1
165 1 86 TYR QB 1 87 TYR H 4.048 . 4.048 2.712 2.401 2.850 . 0 0 "[ . 1 . 2]" 1
166 1 81 GLU HB2 1 82 SER H 3.916 . 3.916 2.764 2.534 3.179 . 0 0 "[ . 1 . 2]" 1
167 1 86 TYR H 1 86 TYR QB 3.597 . 3.597 2.376 2.323 2.475 . 0 0 "[ . 1 . 2]" 1
168 1 41 ASN H 1 44 ASP HB3 5.258 . 5.258 4.168 3.159 4.969 . 0 0 "[ . 1 . 2]" 1
169 1 87 TYR HB2 1 90 LEU H 5.280 . 5.280 4.463 3.939 4.855 . 0 0 "[ . 1 . 2]" 1
170 1 89 GLN HG2 1 90 LEU H 5.698 . 5.698 4.000 2.446 5.058 . 0 0 "[ . 1 . 2]" 1
171 1 81 GLU H 1 81 GLU HB2 3.366 . 3.366 2.487 2.385 2.606 . 0 0 "[ . 1 . 2]" 1
172 1 44 ASP HB3 1 45 GLU H 4.147 . 4.147 3.725 2.578 3.989 . 0 0 "[ . 1 . 2]" 1
173 1 66 ASP HB3 1 67 ILE H 4.565 . 4.565 2.608 2.405 2.883 . 0 0 "[ . 1 . 2]" 1
174 1 84 GLU H 1 91 TYR HB2 4.796 . 4.796 3.876 3.584 4.583 . 0 0 "[ . 1 . 2]" 1
175 1 66 ASP H 1 66 ASP HB3 4.070 . 4.070 2.497 2.344 2.644 . 0 0 "[ . 1 . 2]" 1
176 1 91 TYR H 1 91 TYR HB2 3.740 . 3.740 2.639 2.530 2.705 . 0 0 "[ . 1 . 2]" 1
177 1 11 TRP HE1 1 69 GLN HA 4.752 . 4.752 2.973 2.182 4.050 . 0 0 "[ . 1 . 2]" 1
178 1 39 VAL HB 1 40 LEU H 4.543 . 4.543 4.143 3.928 4.422 . 0 0 "[ . 1 . 2]" 1
179 1 46 GLU H 1 46 GLU HG2 5.247 . 5.247 4.204 2.448 4.641 . 0 0 "[ . 1 . 2]" 1
180 1 39 VAL H 1 39 VAL HB 4.147 . 4.147 3.730 3.671 3.868 . 0 0 "[ . 1 . 2]" 1
181 1 9 GLU H 1 9 GLU HG2 5.676 . 5.676 3.897 2.037 4.669 . 0 0 "[ . 1 . 2]" 1
182 1 9 GLU H 1 9 GLU HG3 5.676 . 5.676 4.103 2.357 4.663 . 0 0 "[ . 1 . 2]" 1
183 1 13 VAL H 1 13 VAL HB 3.553 . 3.553 2.570 2.443 2.662 . 0 0 "[ . 1 . 2]" 1
184 1 13 VAL HB 1 14 LEU H 3.916 . 3.916 2.429 2.265 2.628 . 0 0 "[ . 1 . 2]" 1
185 1 64 LEU H 1 64 LEU HB3 3.729 . 3.729 2.805 2.461 3.520 . 0 0 "[ . 1 . 2]" 1
186 1 34 LEU H 1 34 LEU HG 3.476 . 3.476 2.398 2.235 2.524 . 0 0 "[ . 1 . 2]" 1
187 1 64 LEU HB3 1 65 LEU H 4.609 . 4.609 2.891 2.519 3.690 . 0 0 "[ . 1 . 2]" 1
188 1 89 GLN HB2 1 90 LEU H 4.576 . 4.576 3.220 2.333 3.960 . 0 0 "[ . 1 . 2]" 1
189 1 15 GLU H 1 15 GLU HB2 4.224 . 4.224 2.583 2.121 3.671 . 0 0 "[ . 1 . 2]" 1
190 1 30 ILE HB 1 31 THR H 5.709 . 5.709 4.419 4.345 4.497 . 0 0 "[ . 1 . 2]" 1
191 1 36 GLN H 1 36 GLN HB2 4.268 . 4.268 2.522 2.426 2.621 . 0 0 "[ . 1 . 2]" 1
192 1 55 VAL HB 1 56 ILE H 4.334 . 4.334 3.564 2.606 4.224 . 0 0 "[ . 1 . 2]" 1
193 1 45 GLU H 1 45 GLU HB2 4.213 . 4.213 2.575 2.388 2.720 . 0 0 "[ . 1 . 2]" 1
194 1 55 VAL H 1 55 VAL HB 4.213 . 4.213 2.908 2.502 3.696 . 0 0 "[ . 1 . 2]" 1
195 1 45 GLU HB2 1 46 GLU H 4.477 . 4.477 3.836 3.698 4.033 . 0 0 "[ . 1 . 2]" 1
196 1 18 ARG H 1 18 ARG HB2 4.059 . 4.059 2.673 2.252 3.672 . 0 0 "[ . 1 . 2]" 1
197 1 81 GLU H 1 81 GLU HG3 4.433 . 4.433 3.003 2.125 3.770 . 0 0 "[ . 1 . 2]" 1
198 1 47 GLN H 1 47 GLN QB 3.410 . 3.410 2.254 2.183 2.573 . 0 0 "[ . 1 . 2]" 1
199 1 48 VAL HB 1 49 LEU H 4.323 . 4.323 2.585 2.392 2.965 . 0 0 "[ . 1 . 2]" 1
200 1 47 GLN QB 1 48 VAL H 4.411 . 4.411 2.607 2.344 3.593 . 0 0 "[ . 1 . 2]" 1
201 1 48 VAL H 1 48 VAL HB 4.180 . 4.180 2.469 2.356 2.662 . 0 0 "[ . 1 . 2]" 1
202 1 89 GLN HB3 1 90 LEU H 4.576 . 4.576 3.433 2.383 4.056 . 0 0 "[ . 1 . 2]" 1
203 1 63 VAL H 1 63 VAL HB 3.498 . 3.498 2.561 2.483 2.635 . 0 0 "[ . 1 . 2]" 1
204 1 14 LEU HB2 1 15 GLU H 3.927 . 3.927 3.015 2.544 3.402 . 0 0 "[ . 1 . 2]" 1
205 1 15 GLU H 1 15 GLU HB3 4.224 . 4.224 2.779 2.417 3.640 . 0 0 "[ . 1 . 2]" 1
206 1 63 VAL HB 1 64 LEU H 3.938 . 3.938 2.698 2.522 2.860 . 0 0 "[ . 1 . 2]" 1
207 1 14 LEU H 1 14 LEU HB2 3.553 . 3.553 2.508 2.368 2.626 . 0 0 "[ . 1 . 2]" 1
208 1 19 VAL HB 1 20 THR H 4.774 . 4.774 3.561 2.439 4.155 . 0 0 "[ . 1 . 2]" 1
209 1 20 THR H 1 21 LEU HG 5.500 . 5.500 4.278 3.990 4.693 . 0 0 "[ . 1 . 2]" 1
210 1 45 GLU H 1 46 GLU QB 5.896 . 5.896 4.495 4.208 4.768 . 0 0 "[ . 1 . 2]" 1
211 1 46 GLU H 1 46 GLU QB 3.267 . 3.267 2.281 2.223 2.426 . 0 0 "[ . 1 . 2]" 1
212 1 46 GLU QB 1 47 GLN H 3.839 . 3.839 2.614 2.410 2.840 . 0 0 "[ . 1 . 2]" 1
213 1 21 LEU HB2 1 22 THR H 3.883 . 3.883 2.471 2.179 2.636 . 0 0 "[ . 1 . 2]" 1
214 1 21 LEU H 1 21 LEU HG 3.311 . 3.311 2.290 2.194 2.342 . 0 0 "[ . 1 . 2]" 1
215 1 61 VAL H 1 61 VAL HB 3.762 . 3.762 2.773 2.578 2.895 . 0 0 "[ . 1 . 2]" 1
216 1 61 VAL HB 1 62 GLY H 4.059 . 4.059 2.529 2.216 2.726 . 0 0 "[ . 1 . 2]" 1
217 1 11 TRP HE1 1 76 TYR HB2 5.170 . 5.170 2.321 1.834 3.218 . 0 0 "[ . 1 . 2]" 1
218 1 76 TYR H 1 76 TYR HB2 3.751 . 3.751 2.547 2.448 2.724 . 0 0 "[ . 1 . 2]" 1
219 1 59 ARG QB 1 60 LYS H 4.147 . 4.147 2.606 2.337 2.893 . 0 0 "[ . 1 . 2]" 1
220 1 59 ARG H 1 59 ARG QB 3.718 . 3.718 2.264 2.188 2.438 . 0 0 "[ . 1 . 2]" 1
221 1 74 LYS H 1 74 LYS HB2 4.026 . 4.026 2.568 2.241 3.678 . 0 0 "[ . 1 . 2]" 1
222 1 70 ARG H 1 70 ARG HB3 4.037 . 4.037 3.626 3.542 3.672 . 0 0 "[ . 1 . 2]" 1
223 1 27 PRO QB 1 28 SER H 4.653 . 4.653 3.161 2.704 3.435 . 0 0 "[ . 1 . 2]" 1
224 1 74 LYS HB2 1 75 GLY H 4.312 . 4.312 3.045 2.372 4.036 . 0 0 "[ . 1 . 2]" 1
225 1 83 LEU H 1 83 LEU HB2 3.938 . 3.938 2.576 2.496 2.693 . 0 0 "[ . 1 . 2]" 1
226 1 83 LEU HB2 1 84 GLU H 4.125 . 4.125 2.904 2.735 3.078 . 0 0 "[ . 1 . 2]" 1
227 1 56 ILE H 1 56 ILE HB 3.828 . 3.828 2.620 2.443 2.769 . 0 0 "[ . 1 . 2]" 1
228 1 14 LEU H 1 14 LEU HG 4.059 . 4.059 2.493 2.293 2.855 . 0 0 "[ . 1 . 2]" 1
229 1 77 VAL HB 1 78 ALA H 3.729 . 3.729 2.455 2.308 2.650 . 0 0 "[ . 1 . 2]" 1
230 1 77 VAL H 1 77 VAL HB 3.509 . 3.509 2.575 2.513 2.635 . 0 0 "[ . 1 . 2]" 1
231 1 88 PRO QG 1 89 GLN H 4.400 . 4.400 2.706 2.060 3.959 . 0 0 "[ . 1 . 2]" 1
232 1 18 ARG H 1 18 ARG HB3 4.059 . 4.059 2.637 2.390 2.832 . 0 0 "[ . 1 . 2]" 1
233 1 90 LEU H 1 90 LEU HB3 3.685 . 3.685 2.592 2.519 2.665 . 0 0 "[ . 1 . 2]" 1
234 1 90 LEU HB3 1 91 TYR H 4.180 . 4.180 2.615 2.412 2.916 . 0 0 "[ . 1 . 2]" 1
235 1 35 ARG HB2 1 36 GLN H 4.763 . 4.763 3.479 2.288 4.044 . 0 0 "[ . 1 . 2]" 1
236 1 29 ARG H 1 29 ARG QB 3.421 . 3.421 2.259 2.192 2.651 . 0 0 "[ . 1 . 2]" 1
237 1 70 ARG H 1 70 ARG HB2 4.037 . 4.037 2.481 2.254 2.682 . 0 0 "[ . 1 . 2]" 1
238 1 29 ARG QB 1 31 THR H 5.566 . 5.566 4.689 4.509 5.008 . 0 0 "[ . 1 . 2]" 1
239 1 70 ARG HB2 1 71 THR H 4.796 . 4.796 2.782 2.407 3.186 . 0 0 "[ . 1 . 2]" 1
240 1 29 ARG QB 1 30 ILE H 4.257 . 4.257 2.726 2.278 3.634 . 0 0 "[ . 1 . 2]" 1
241 1 97 LYS H 1 97 LYS HB2 4.246 . 4.246 3.226 2.334 4.068 . 0 0 "[ . 1 . 2]" 1
242 1 65 LEU HB2 1 66 ASP H 3.905 . 3.905 2.603 2.502 2.759 . 0 0 "[ . 1 . 2]" 1
243 1 74 LYS H 1 74 LYS HB3 4.026 . 4.026 3.274 2.476 3.679 . 0 0 "[ . 1 . 2]" 1
244 1 65 LEU H 1 65 LEU HB2 3.696 . 3.696 2.548 2.439 2.661 . 0 0 "[ . 1 . 2]" 1
245 1 74 LYS HB3 1 75 GLY H 4.312 . 4.312 3.342 2.493 4.187 . 0 0 "[ . 1 . 2]" 1
246 1 14 LEU HB3 1 15 GLU H 4.587 . 4.587 3.904 3.586 4.086 . 0 0 "[ . 1 . 2]" 1
247 1 67 ILE HB 1 69 GLN H 6.028 . 6.028 4.900 4.749 5.107 . 0 0 "[ . 1 . 2]" 1
248 1 68 LEU HG 1 69 GLN H 6.050 . 6.050 4.656 4.548 4.848 . 0 0 "[ . 1 . 2]" 1
249 1 92 LYS H 1 92 LYS QB 3.245 . 3.245 2.302 2.184 2.491 . 0 0 "[ . 1 . 2]" 1
250 1 92 LYS QB 1 93 LYS H 3.564 . 3.564 2.739 2.428 2.987 . 0 0 "[ . 1 . 2]" 1
251 1 93 LYS H 1 93 LYS HB3 4.037 . 4.037 3.022 2.403 3.662 . 0 0 "[ . 1 . 2]" 1
252 1 14 LEU H 1 14 LEU HB3 4.015 . 4.015 3.634 3.584 3.673 . 0 0 "[ . 1 . 2]" 1
253 1 67 ILE H 1 67 ILE HB 3.311 . 3.311 2.545 2.435 2.666 . 0 0 "[ . 1 . 2]" 1
254 1 67 ILE HB 1 68 LEU H 3.333 . 3.333 2.556 2.350 2.711 . 0 0 "[ . 1 . 2]" 1
255 1 58 LYS HB2 1 59 ARG H 4.631 . 4.631 3.405 2.371 3.953 . 0 0 "[ . 1 . 2]" 1
256 1 58 LYS HB3 1 59 ARG H 4.631 . 4.631 3.230 2.219 4.295 . 0 0 "[ . 1 . 2]" 1
257 1 24 VAL H 1 24 VAL HB 3.542 . 3.542 2.630 2.526 2.715 . 0 0 "[ . 1 . 2]" 1
258 1 24 VAL HB 1 25 ILE H 3.597 . 3.597 2.547 2.272 2.886 . 0 0 "[ . 1 . 2]" 1
259 1 81 GLU H 1 81 GLU HB3 4.147 . 4.147 3.613 3.588 3.629 . 0 0 "[ . 1 . 2]" 1
260 1 45 GLU HB3 1 46 GLU H 4.477 . 4.477 2.465 2.260 2.748 . 0 0 "[ . 1 . 2]" 1
261 1 81 GLU HB3 1 82 SER H 4.444 . 4.444 3.729 3.513 4.085 . 0 0 "[ . 1 . 2]" 1
262 1 49 LEU H 1 49 LEU HG 3.905 . 3.905 2.469 2.329 2.656 . 0 0 "[ . 1 . 2]" 1
263 1 49 LEU HB3 1 50 SER H 4.268 . 4.268 4.123 3.891 4.227 . 0 0 "[ . 1 . 2]" 1
264 1 35 ARG H 1 35 ARG HG2 4.334 . 4.334 2.877 2.275 3.659 . 0 0 "[ . 1 . 2]" 1
265 1 10 CYS HB2 1 11 TRP H 4.752 . 4.752 3.117 2.258 4.183 . 0 0 "[ . 1 . 2]" 1
266 1 65 LEU H 1 65 LEU HG 3.575 . 3.575 2.283 2.158 2.557 . 0 0 "[ . 1 . 2]" 1
267 1 94 VAL H 1 94 VAL HB 3.982 . 3.982 3.697 3.657 3.728 . 0 0 "[ . 1 . 2]" 1
268 1 94 VAL HB 1 95 THR H 4.290 . 4.290 4.081 3.610 4.265 . 0 0 "[ . 1 . 2]" 1
269 1 80 LEU H 1 80 LEU HB2 3.575 . 3.575 2.510 2.439 2.585 . 0 0 "[ . 1 . 2]" 1
270 1 80 LEU HB2 1 81 GLU H 4.125 . 4.125 2.568 2.220 2.992 . 0 0 "[ . 1 . 2]" 1
271 1 25 ILE HB 1 26 ASP H 4.730 . 4.730 4.247 3.850 4.451 . 0 0 "[ . 1 . 2]" 1
272 1 92 LYS H 1 92 LYS QD 5.313 . 5.313 4.110 2.316 4.768 . 0 0 "[ . 1 . 2]" 1
273 1 58 LYS QD 1 59 ARG H 5.390 . 5.390 4.441 1.843 5.252 . 0 0 "[ . 1 . 2]" 1
274 1 25 ILE H 1 25 ILE HB 3.454 . 3.454 2.594 2.401 2.681 . 0 0 "[ . 1 . 2]" 1
275 1 90 LEU H 1 90 LEU HB2 3.663 . 3.663 2.535 2.487 2.607 . 0 0 "[ . 1 . 2]" 1
276 1 90 LEU HB2 1 91 TYR H 4.180 . 4.180 3.865 3.745 4.027 . 0 0 "[ . 1 . 2]" 1
277 1 78 ALA H 1 78 ALA MB 3.278 . 3.278 2.245 2.216 2.267 . 0 0 "[ . 1 . 2]" 1
278 1 78 ALA MB 1 79 PHE H 3.806 . 3.806 2.634 2.362 2.884 . 0 0 "[ . 1 . 2]" 1
279 1 68 LEU H 1 68 LEU HB3 3.905 . 3.905 3.615 3.589 3.639 . 0 0 "[ . 1 . 2]" 1
280 1 54 LEU HB3 1 55 VAL H 4.961 . 4.961 2.802 2.021 4.458 . 0 0 "[ . 1 . 2]" 1
281 1 56 ILE H 1 56 ILE HG13 4.323 . 4.323 2.882 1.890 3.664 . 0 0 "[ . 1 . 2]" 1
282 1 69 GLN H 1 69 GLN HB3 3.663 . 3.663 2.526 2.363 2.621 . 0 0 "[ . 1 . 2]" 1
283 1 75 GLY H 1 78 ALA MB 5.797 . 5.797 4.664 4.237 4.930 . 0 0 "[ . 1 . 2]" 1
284 1 97 LYS H 1 97 LYS HB3 4.246 . 4.246 3.435 2.673 4.106 . 0 0 "[ . 1 . 2]" 1
285 1 49 LEU HB2 1 50 SER H 4.818 . 4.818 3.321 2.970 3.487 . 0 0 "[ . 1 . 2]" 1
286 1 93 LYS H 1 93 LYS HG2 5.192 . 5.192 3.904 2.335 4.643 . 0 0 "[ . 1 . 2]" 1
287 1 30 ILE HG13 1 31 THR H 4.730 . 4.730 3.627 3.368 4.085 . 0 0 "[ . 1 . 2]" 1
288 1 30 ILE H 1 30 ILE HG13 4.213 . 4.213 2.974 2.839 3.088 . 0 0 "[ . 1 . 2]" 1
289 1 84 GLU H 1 84 GLU HB3 3.641 . 3.641 2.608 2.456 2.781 . 0 0 "[ . 1 . 2]" 1
290 1 35 ARG H 1 35 ARG HG3 4.334 . 4.334 2.930 1.905 3.912 . 0 0 "[ . 1 . 2]" 1
291 1 64 LEU H 1 64 LEU HB2 3.729 . 3.729 2.398 2.165 2.581 . 0 0 "[ . 1 . 2]" 1
292 1 29 ARG H 1 29 ARG HG3 4.972 . 4.972 4.504 4.081 4.598 . 0 0 "[ . 1 . 2]" 1
293 1 64 LEU HB2 1 65 LEU H 4.609 . 4.609 3.797 2.909 4.084 . 0 0 "[ . 1 . 2]" 1
294 1 84 GLU HB3 1 85 LEU H 3.861 . 3.861 2.792 2.492 3.050 . 0 0 "[ . 1 . 2]" 1
295 1 40 LEU HB2 1 41 ASN H 5.049 . 5.049 4.306 4.050 4.494 . 0 0 "[ . 1 . 2]" 1
296 1 40 LEU H 1 40 LEU HB2 4.059 . 4.059 2.849 2.592 3.200 . 0 0 "[ . 1 . 2]" 1
297 1 80 LEU H 1 80 LEU HB3 4.290 . 4.290 3.638 3.604 3.656 . 0 0 "[ . 1 . 2]" 1
298 1 80 LEU HB3 1 81 GLU H 4.422 . 4.422 3.521 3.038 3.819 . 0 0 "[ . 1 . 2]" 1
299 1 92 LYS H 1 92 LYS HG3 5.005 . 5.005 3.631 2.087 4.576 . 0 0 "[ . 1 . 2]" 1
300 1 25 ILE H 1 25 ILE HG13 3.608 . 3.608 2.236 2.062 2.513 . 0 0 "[ . 1 . 2]" 1
301 1 71 THR H 1 71 THR MG 3.652 . 3.652 2.052 1.930 2.205 . 0 0 "[ . 1 . 2]" 1
302 1 69 GLN H 1 69 GLN HB2 3.663 . 3.663 2.560 2.370 2.702 . 0 0 "[ . 1 . 2]" 1
303 1 21 LEU H 1 21 LEU HB3 4.378 . 4.378 3.647 3.623 3.669 . 0 0 "[ . 1 . 2]" 1
304 1 93 LYS HG3 1 94 VAL H 5.456 . 5.456 4.557 3.511 5.355 . 0 0 "[ . 1 . 2]" 1
305 1 83 LEU H 1 83 LEU HG 3.652 . 3.652 2.400 2.261 2.517 . 0 0 "[ . 1 . 2]" 1
306 1 83 LEU HG 1 84 GLU H 5.368 . 5.368 4.485 4.360 4.591 . 0 0 "[ . 1 . 2]" 1
307 1 97 LYS H 1 97 LYS QG 3.916 . 3.916 2.578 1.889 3.574 . 0 0 "[ . 1 . 2]" 1
308 1 56 ILE H 1 56 ILE HG12 4.323 . 4.323 2.788 1.895 3.928 . 0 0 "[ . 1 . 2]" 1
309 1 34 LEU H 1 34 LEU HB3 4.389 . 4.389 3.618 3.601 3.639 . 0 0 "[ . 1 . 2]" 1
310 1 34 LEU HB3 1 35 ARG H 4.719 . 4.719 3.624 3.405 3.827 . 0 0 "[ . 1 . 2]" 1
311 1 22 THR MG 1 62 GLY H 4.411 . 4.411 2.525 2.205 3.287 . 0 0 "[ . 1 . 2]" 1
312 1 22 THR H 1 22 THR MG 3.674 . 3.674 2.272 2.148 2.349 . 0 0 "[ . 1 . 2]" 1
313 1 80 LEU H 1 80 LEU HG 4.026 . 4.026 2.471 2.298 2.663 . 0 0 "[ . 1 . 2]" 1
314 1 68 LEU H 1 68 LEU HB2 4.356 . 4.356 2.444 2.327 2.493 . 0 0 "[ . 1 . 2]" 1
315 1 20 THR MG 1 21 LEU H 4.422 . 4.422 3.549 2.885 3.797 . 0 0 "[ . 1 . 2]" 1
316 1 83 LEU H 1 83 LEU HB3 4.378 . 4.378 3.647 3.624 3.679 . 0 0 "[ . 1 . 2]" 1
317 1 65 LEU HB3 1 66 ASP H 4.521 . 4.521 3.662 3.561 3.765 . 0 0 "[ . 1 . 2]" 1
318 1 65 LEU H 1 65 LEU HB3 4.290 . 4.290 3.626 3.601 3.647 . 0 0 "[ . 1 . 2]" 1
319 1 31 THR H 1 31 THR MG 3.630 . 3.630 2.808 2.548 2.973 . 0 0 "[ . 1 . 2]" 1
320 1 30 ILE H 1 30 ILE HG12 3.773 . 3.773 2.109 1.897 2.323 . 0 0 "[ . 1 . 2]" 1
321 1 83 LEU HB3 1 84 GLU H 4.774 . 4.774 3.894 3.704 4.056 . 0 0 "[ . 1 . 2]" 1
322 1 83 LEU HB3 1 91 TYR H 4.708 . 4.708 3.817 3.446 4.420 . 0 0 "[ . 1 . 2]" 1
323 1 61 VAL H 1 61 VAL MG2 3.564 . 3.564 2.062 1.896 2.239 . 0 0 "[ . 1 . 2]" 1
324 1 61 VAL MG2 1 62 GLY H 4.796 . 4.796 3.687 3.509 3.893 . 0 0 "[ . 1 . 2]" 1
325 1 62 GLY H 1 63 VAL MG2 5.390 . 5.390 4.261 4.078 4.437 . 0 0 "[ . 1 . 2]" 1
326 1 63 VAL H 1 63 VAL MG2 3.421 . 3.421 2.106 2.020 2.243 . 0 0 "[ . 1 . 2]" 1
327 1 13 VAL H 1 13 VAL MG2 3.388 . 3.388 2.121 1.998 2.386 . 0 0 "[ . 1 . 2]" 1
328 1 63 VAL MG2 1 64 LEU H 4.752 . 4.752 3.894 3.762 4.009 . 0 0 "[ . 1 . 2]" 1
329 1 13 VAL MG1 1 14 LEU H 4.290 . 4.290 3.303 2.877 3.588 . 0 0 "[ . 1 . 2]" 1
330 1 13 VAL MG2 1 14 LEU H 4.829 . 4.829 3.788 3.694 3.877 . 0 0 "[ . 1 . 2]" 1
331 1 40 LEU H 1 40 LEU HB3 4.059 . 4.059 2.643 2.481 2.874 . 0 0 "[ . 1 . 2]" 1
332 1 12 SER H 1 13 VAL MG2 4.609 . 4.609 4.101 3.952 4.398 . 0 0 "[ . 1 . 2]" 1
333 1 18 ARG H 1 21 LEU MD1 4.708 . 4.708 4.200 3.858 5.001 0.293 20 0 "[ . 1 . 2]" 1
334 1 56 ILE H 1 56 ILE MG 4.675 . 4.675 3.831 3.800 3.887 . 0 0 "[ . 1 . 2]" 1
335 1 21 LEU H 1 21 LEU MD1 4.268 . 4.268 3.808 3.746 3.861 . 0 0 "[ . 1 . 2]" 1
336 1 34 LEU H 1 34 LEU MD1 4.565 . 4.565 3.710 3.585 3.821 . 0 0 "[ . 1 . 2]" 1
337 1 56 ILE MG 1 59 ARG H 4.477 . 4.477 4.046 3.018 4.516 0.039 1 0 "[ . 1 . 2]" 1
338 1 56 ILE MG 1 58 LYS H 5.192 . 5.192 5.013 4.630 5.231 0.039 6 0 "[ . 1 . 2]" 1
339 1 34 LEU MD2 1 79 PHE H 5.401 . 5.401 4.256 3.746 4.750 . 0 0 "[ . 1 . 2]" 1
340 1 24 VAL H 1 24 VAL MG2 3.696 . 3.696 2.288 2.043 2.584 . 0 0 "[ . 1 . 2]" 1
341 1 34 LEU MD2 1 82 SER H 5.907 . 5.907 4.788 4.182 5.664 . 0 0 "[ . 1 . 2]" 1
342 1 24 VAL MG2 1 25 ILE H 4.763 . 4.763 3.786 3.710 3.930 . 0 0 "[ . 1 . 2]" 1
343 1 30 ILE H 1 30 ILE MG 3.971 . 3.971 2.881 2.682 3.095 . 0 0 "[ . 1 . 2]" 1
344 1 14 LEU H 1 14 LEU MD1 4.774 . 4.774 3.884 3.721 4.111 . 0 0 "[ . 1 . 2]" 1
345 1 14 LEU H 1 14 LEU MD2 4.972 . 4.972 3.183 2.932 3.352 . 0 0 "[ . 1 . 2]" 1
346 1 48 VAL H 1 48 VAL MG2 3.597 . 3.597 2.254 1.937 2.403 . 0 0 "[ . 1 . 2]" 1
347 1 19 VAL MG1 1 20 THR H 5.060 . 5.060 2.937 2.028 4.199 . 0 0 "[ . 1 . 2]" 1
348 1 21 LEU H 1 21 LEU MD2 4.378 . 4.378 2.882 2.381 3.135 . 0 0 "[ . 1 . 2]" 1
349 1 85 LEU HB2 1 86 TYR H 3.894 . 3.894 2.535 2.340 2.846 . 0 0 "[ . 1 . 2]" 1
350 1 85 LEU H 1 85 LEU HB2 3.652 . 3.652 2.489 2.425 2.571 . 0 0 "[ . 1 . 2]" 1
351 1 85 LEU H 1 85 LEU HG 3.828 . 3.828 2.484 2.325 2.642 . 0 0 "[ . 1 . 2]" 1
352 1 39 VAL QG 1 76 TYR H 5.786 . 5.786 4.702 4.382 5.080 . 0 0 "[ . 1 . 2]" 1
353 1 76 TYR H 1 77 VAL MG2 6.050 . 6.050 4.175 3.990 4.327 . 0 0 "[ . 1 . 2]" 1
354 1 63 VAL H 1 63 VAL MG1 4.301 . 4.301 3.827 3.810 3.847 . 0 0 "[ . 1 . 2]" 1
355 1 67 ILE H 1 67 ILE HG13 4.433 . 4.433 2.120 1.973 2.388 . 0 0 "[ . 1 . 2]" 1
356 1 63 VAL MG1 1 66 ASP H 5.269 . 5.269 4.738 4.558 4.938 . 0 0 "[ . 1 . 2]" 1
357 1 63 VAL MG1 1 64 LEU H 4.246 . 4.246 3.532 3.341 3.647 . 0 0 "[ . 1 . 2]" 1
358 1 39 VAL QG 1 78 ALA H 4.422 . 4.422 3.478 3.229 3.805 . 0 0 "[ . 1 . 2]" 1
359 1 77 VAL MG1 1 78 ALA H 4.906 . 4.906 3.330 3.044 3.590 . 0 0 "[ . 1 . 2]" 1
360 1 64 LEU MD1 1 68 LEU H 4.081 . 4.081 3.827 3.450 4.099 0.018 12 0 "[ . 1 . 2]" 1
361 1 77 VAL H 1 77 VAL MG2 3.355 . 3.355 2.051 1.937 2.170 . 0 0 "[ . 1 . 2]" 1
362 1 39 VAL QG 1 79 PHE H 4.521 . 4.521 3.959 3.691 4.180 . 0 0 "[ . 1 . 2]" 1
363 1 39 VAL QG 1 40 LEU H 3.916 . 3.916 2.578 2.261 3.039 . 0 0 "[ . 1 . 2]" 1
364 1 61 VAL H 1 61 VAL MG1 4.191 . 4.191 3.882 3.841 3.909 . 0 0 "[ . 1 . 2]" 1
365 1 49 LEU H 1 49 LEU MD1 5.456 . 5.456 3.769 3.688 3.942 . 0 0 "[ . 1 . 2]" 1
366 1 39 VAL H 1 39 VAL QG 3.366 . 3.366 2.021 1.931 2.188 . 0 0 "[ . 1 . 2]" 1
367 1 39 VAL QG 1 75 GLY H 4.356 . 4.356 3.424 3.182 3.880 . 0 0 "[ . 1 . 2]" 1
368 1 61 VAL MG1 1 62 GLY H 4.609 . 4.609 3.597 3.418 3.809 . 0 0 "[ . 1 . 2]" 1
369 1 22 THR H 1 61 VAL MG1 4.620 . 4.620 3.733 3.219 4.111 . 0 0 "[ . 1 . 2]" 1
370 1 24 VAL H 1 24 VAL MG1 4.323 . 4.323 3.880 3.828 3.924 . 0 0 "[ . 1 . 2]" 1
371 1 24 VAL MG1 1 25 ILE H 4.301 . 4.301 3.503 3.170 3.771 . 0 0 "[ . 1 . 2]" 1
372 1 35 ARG H 1 40 LEU MD2 5.038 . 5.038 3.643 2.908 5.146 0.108 3 0 "[ . 1 . 2]" 1
373 1 40 LEU MD1 1 45 GLU H 5.203 . 5.203 3.645 3.099 4.263 . 0 0 "[ . 1 . 2]" 1
374 1 40 LEU MD2 1 45 GLU H 5.456 . 5.456 3.720 3.223 4.315 . 0 0 "[ . 1 . 2]" 1
375 1 90 LEU H 1 90 LEU MD1 4.477 . 4.477 4.139 4.075 4.193 . 0 0 "[ . 1 . 2]" 1
376 1 21 LEU H 1 25 ILE MD 5.511 . 5.511 4.573 4.411 5.012 . 0 0 "[ . 1 . 2]" 1
377 1 21 LEU H 1 90 LEU MD2 5.852 . 5.852 4.699 3.938 5.647 . 0 0 "[ . 1 . 2]" 1
378 1 65 LEU H 1 65 LEU MD1 4.411 . 4.411 3.689 3.576 3.836 . 0 0 "[ . 1 . 2]" 1
379 1 67 ILE H 1 67 ILE MG 4.510 . 4.510 3.820 3.788 3.841 . 0 0 "[ . 1 . 2]" 1
380 1 67 ILE MG 1 68 LEU H 4.488 . 4.488 3.408 3.152 3.617 . 0 0 "[ . 1 . 2]" 1
381 1 68 LEU H 1 68 LEU MD1 4.906 . 4.906 3.734 3.549 3.846 . 0 0 "[ . 1 . 2]" 1
382 1 24 VAL H 1 90 LEU MD2 4.851 . 4.851 4.103 3.607 4.753 . 0 0 "[ . 1 . 2]" 1
383 1 25 ILE H 1 25 ILE MD 4.686 . 4.686 3.600 3.476 3.866 . 0 0 "[ . 1 . 2]" 1
384 1 25 ILE H 1 90 LEU MD2 4.906 . 4.906 3.425 2.969 4.020 . 0 0 "[ . 1 . 2]" 1
385 1 95 THR H 1 95 THR MG 3.817 . 3.817 2.539 1.986 2.856 . 0 0 "[ . 1 . 2]" 1
386 1 84 GLU H 1 84 GLU HB2 3.597 . 3.597 2.467 2.261 2.606 . 0 0 "[ . 1 . 2]" 1
387 1 84 GLU HB2 1 85 LEU H 4.741 . 4.741 3.950 3.650 4.113 . 0 0 "[ . 1 . 2]" 1
388 1 25 ILE MG 1 26 ASP H 3.894 . 3.894 2.917 2.285 3.563 . 0 0 "[ . 1 . 2]" 1
389 1 25 ILE H 1 25 ILE MG 4.367 . 4.367 3.859 3.796 3.900 . 0 0 "[ . 1 . 2]" 1
390 1 83 LEU H 1 83 LEU MD2 4.202 . 4.202 2.972 2.552 3.226 . 0 0 "[ . 1 . 2]" 1
391 1 91 TYR H 1 94 VAL MG2 4.763 . 4.763 4.115 3.965 4.255 . 0 0 "[ . 1 . 2]" 1
392 1 94 VAL H 1 94 VAL MG2 3.421 . 3.421 2.146 2.071 2.220 . 0 0 "[ . 1 . 2]" 1
393 1 94 VAL MG2 1 95 THR H 4.070 . 4.070 2.579 2.031 2.869 . 0 0 "[ . 1 . 2]" 1
394 1 80 LEU H 1 80 LEU MD1 4.323 . 4.323 3.828 3.685 3.920 . 0 0 "[ . 1 . 2]" 1
395 1 83 LEU H 1 83 LEU MD1 4.488 . 4.488 3.866 3.711 4.006 . 0 0 "[ . 1 . 2]" 1
396 1 85 LEU H 1 85 LEU MD2 4.851 . 4.851 3.415 3.239 3.587 . 0 0 "[ . 1 . 2]" 1
397 1 94 VAL H 1 94 VAL MG1 3.663 . 3.663 2.350 2.250 2.558 . 0 0 "[ . 1 . 2]" 1
398 1 94 VAL MG1 1 95 THR H 4.554 . 4.554 4.147 4.075 4.211 . 0 0 "[ . 1 . 2]" 1
399 1 25 ILE H 1 25 ILE HG12 4.191 . 4.191 3.541 3.381 3.638 . 0 0 "[ . 1 . 2]" 1
400 1 85 LEU HB3 1 86 TYR H 4.400 . 4.400 3.592 3.411 3.895 . 0 0 "[ . 1 . 2]" 1
401 1 85 LEU MD1 1 86 TYR H 4.862 . 4.862 4.510 4.328 4.776 . 0 0 "[ . 1 . 2]" 1
402 1 11 TRP HE1 1 76 TYR HB3 5.170 . 5.170 3.790 3.291 4.729 . 0 0 "[ . 1 . 2]" 1
403 1 79 PHE QD 1 80 LEU H 4.950 . 4.950 4.148 3.903 4.761 . 0 0 "[ . 1 . 2]" 1
404 1 83 LEU H 1 85 LEU H 4.983 . 4.983 4.272 4.106 4.520 . 0 0 "[ . 1 . 2]" 1
405 1 9 GLU H 1 10 CYS H 4.928 . 4.928 2.660 2.411 2.864 . 0 0 "[ . 1 . 2]" 1
406 1 41 ASN H 1 44 ASP H 5.016 . 5.016 4.045 3.664 4.551 . 0 0 "[ . 1 . 2]" 1
407 1 81 GLU H 1 84 GLU H 5.511 . 5.511 4.697 4.476 4.954 . 0 0 "[ . 1 . 2]" 1
408 1 82 SER H 1 84 GLU H 5.742 . 5.742 4.007 3.729 4.208 . 0 0 "[ . 1 . 2]" 1
409 1 34 LEU H 1 36 GLN H 5.357 . 5.357 4.106 3.848 4.274 . 0 0 "[ . 1 . 2]" 1
410 1 26 ASP H 1 87 TYR QE 4.895 . 4.895 3.154 2.410 4.733 . 0 0 "[ . 1 . 2]" 1
411 1 77 VAL H 1 79 PHE H 5.049 . 5.049 4.098 3.768 4.307 . 0 0 "[ . 1 . 2]" 1
412 1 79 PHE H 1 81 GLU H 4.972 . 4.972 4.169 3.960 4.491 . 0 0 "[ . 1 . 2]" 1
413 1 79 PHE H 1 79 PHE QD 4.928 . 4.928 4.161 3.799 4.243 . 0 0 "[ . 1 . 2]" 1
414 1 91 TYR H 1 91 TYR QD 4.972 . 4.972 4.229 4.199 4.256 . 0 0 "[ . 1 . 2]" 1
415 1 72 GLY H 1 75 GLY H 5.379 . 5.379 4.597 4.371 4.790 . 0 0 "[ . 1 . 2]" 1
416 1 40 LEU HB3 1 41 ASN H 5.049 . 5.049 4.109 3.832 4.324 . 0 0 "[ . 1 . 2]" 1
417 1 25 ILE HG13 1 26 ASP H 5.357 . 5.357 5.095 5.004 5.259 . 0 0 "[ . 1 . 2]" 1
418 1 54 LEU H 1 54 LEU HG 5.500 . 5.500 3.136 2.338 4.609 . 0 0 "[ . 1 . 2]" 1
419 1 76 TYR H 1 76 TYR QD 4.928 . 4.928 4.234 4.165 4.281 . 0 0 "[ . 1 . 2]" 1
420 1 83 LEU H 1 86 TYR QB 5.126 . 5.126 4.998 4.678 5.163 0.037 18 0 "[ . 1 . 2]" 1
421 1 77 VAL MG1 1 80 LEU H 5.610 . 5.610 4.932 4.720 5.122 . 0 0 "[ . 1 . 2]" 1
422 1 80 LEU H 1 83 LEU HB2 6.050 . 6.050 5.387 5.076 5.707 . 0 0 "[ . 1 . 2]" 1
423 1 84 GLU H 1 85 LEU HG 5.115 . 5.115 4.466 4.251 4.668 . 0 0 "[ . 1 . 2]" 1
424 1 10 CYS HB3 1 11 TRP H 4.752 . 4.752 3.674 2.889 4.102 . 0 0 "[ . 1 . 2]" 1
425 1 57 ARG HA 1 60 LYS H 4.862 . 4.862 3.351 3.022 3.688 . 0 0 "[ . 1 . 2]" 1
426 1 13 VAL HA 1 15 GLU H 5.236 . 5.236 4.396 4.137 5.019 . 0 0 "[ . 1 . 2]" 1
427 1 34 LEU MD1 1 35 ARG H 5.588 . 5.588 4.573 4.429 4.777 . 0 0 "[ . 1 . 2]" 1
428 1 34 LEU HG 1 35 ARG H 5.192 . 5.192 4.467 4.327 4.585 . 0 0 "[ . 1 . 2]" 1
429 1 44 ASP H 1 45 GLU HB3 5.775 . 5.775 4.738 4.430 5.002 . 0 0 "[ . 1 . 2]" 1
430 1 65 LEU HA 1 69 GLN H 4.906 . 4.906 4.131 3.960 4.253 . 0 0 "[ . 1 . 2]" 1
431 1 56 ILE MG 1 60 LYS H 5.038 . 5.038 3.565 3.200 3.937 . 0 0 "[ . 1 . 2]" 1
432 1 87 TYR H 1 88 PRO HD2 4.818 . 4.818 4.097 3.632 4.749 . 0 0 "[ . 1 . 2]" 1
433 1 68 LEU MD1 1 79 PHE H 5.951 . 5.951 4.660 4.067 5.532 . 0 0 "[ . 1 . 2]" 1
434 1 77 VAL HA 1 81 GLU H 5.016 . 5.016 4.237 4.072 4.357 . 0 0 "[ . 1 . 2]" 1
435 1 34 LEU H 1 40 LEU MD2 5.764 . 5.764 4.393 3.940 5.481 . 0 0 "[ . 1 . 2]" 1
436 1 24 VAL H 1 25 ILE HG13 5.489 . 5.489 4.214 4.003 4.634 . 0 0 "[ . 1 . 2]" 1
437 1 68 LEU H 1 71 THR MG 5.973 . 5.973 4.198 3.946 4.460 . 0 0 "[ . 1 . 2]" 1
438 1 68 LEU MD2 1 69 GLN H 5.203 . 5.203 4.810 4.731 4.888 . 0 0 "[ . 1 . 2]" 1
439 1 85 LEU HB2 1 87 TYR H 5.830 . 5.830 5.043 4.876 5.310 . 0 0 "[ . 1 . 2]" 1
440 1 83 LEU MD2 1 87 TYR H 5.126 . 5.126 3.951 3.570 4.260 . 0 0 "[ . 1 . 2]" 1
441 1 77 VAL MG1 1 81 GLU H 4.862 . 4.862 4.191 4.057 4.323 . 0 0 "[ . 1 . 2]" 1
442 1 91 TYR H 1 92 LYS QB 5.137 . 5.137 4.623 4.397 4.936 . 0 0 "[ . 1 . 2]" 1
443 1 27 PRO HD3 1 61 VAL H 5.291 . 5.291 4.471 3.712 5.292 0.001 16 0 "[ . 1 . 2]" 1
444 1 83 LEU MD1 1 84 GLU H 5.324 . 5.324 4.916 4.744 5.057 . 0 0 "[ . 1 . 2]" 1
445 1 64 LEU H 1 67 ILE MD 5.654 . 5.654 4.046 3.681 4.871 . 0 0 "[ . 1 . 2]" 1
446 1 83 LEU HB2 1 87 TYR H 5.401 . 5.401 5.101 4.946 5.208 . 0 0 "[ . 1 . 2]" 1
447 1 57 ARG HA 1 61 VAL H 5.577 . 5.577 4.223 3.873 4.429 . 0 0 "[ . 1 . 2]" 1
448 1 73 HIS HB3 1 74 LYS H 4.939 . 4.939 3.127 2.247 3.985 . 0 0 "[ . 1 . 2]" 1
449 1 55 VAL H 1 56 ILE HB 5.544 . 5.544 4.978 4.675 5.168 . 0 0 "[ . 1 . 2]" 1
450 1 54 LEU HB2 1 55 VAL H 4.961 . 4.961 3.616 2.152 4.273 . 0 0 "[ . 1 . 2]" 1
451 1 47 GLN H 1 48 VAL MG2 5.027 . 5.027 4.405 4.158 4.719 . 0 0 "[ . 1 . 2]" 1
452 1 53 ASN H 1 54 LEU HG 6.039 . 6.039 4.375 2.571 6.327 0.288 12 0 "[ . 1 . 2]" 1
453 1 31 THR H 1 32 PRO HG3 5.346 . 5.346 5.109 4.961 5.257 . 0 0 "[ . 1 . 2]" 1
454 1 77 VAL H 1 78 ALA HA 5.929 . 5.929 5.426 5.341 5.524 . 0 0 "[ . 1 . 2]" 1
455 1 15 GLU HA 1 17 PHE H 4.917 . 4.917 3.711 3.513 4.001 . 0 0 "[ . 1 . 2]" 1
456 1 70 ARG H 1 70 ARG HD2 5.786 . 5.786 3.879 1.958 4.819 . 0 0 "[ . 1 . 2]" 1
457 1 70 ARG H 1 70 ARG HD3 5.786 . 5.786 3.843 1.983 4.950 . 0 0 "[ . 1 . 2]" 1
458 1 48 VAL H 1 49 LEU HG 5.489 . 5.489 4.504 4.178 4.916 . 0 0 "[ . 1 . 2]" 1
459 1 85 LEU H 1 86 TYR QB 4.884 . 4.884 4.556 4.362 4.715 . 0 0 "[ . 1 . 2]" 1
460 1 83 LEU HA 1 85 LEU H 5.027 . 5.027 4.173 3.878 4.406 . 0 0 "[ . 1 . 2]" 1
461 1 48 VAL MG1 1 50 SER H 5.819 . 5.819 4.773 4.671 4.973 . 0 0 "[ . 1 . 2]" 1
462 1 49 LEU MD1 1 50 SER H 6.050 . 6.050 5.161 4.869 5.331 . 0 0 "[ . 1 . 2]" 1
463 1 27 PRO HG2 1 28 SER H 4.895 . 4.895 2.881 2.217 3.831 . 0 0 "[ . 1 . 2]" 1
464 1 37 CYS HB2 1 38 LYS H 5.357 . 5.357 4.105 3.345 4.451 . 0 0 "[ . 1 . 2]" 1
465 1 83 LEU HA 1 86 TYR H 4.796 . 4.796 3.414 3.217 3.664 . 0 0 "[ . 1 . 2]" 1
466 1 45 GLU HA 1 48 VAL H 5.082 . 5.082 3.680 3.304 4.101 . 0 0 "[ . 1 . 2]" 1
467 1 38 LYS H 1 39 VAL QG 4.939 . 4.939 3.737 3.579 3.885 . 0 0 "[ . 1 . 2]" 1
468 1 38 LYS HB3 1 39 VAL H 5.434 . 5.434 4.474 4.334 4.558 . 0 0 "[ . 1 . 2]" 1
469 1 37 CYS HB2 1 39 VAL H 5.390 . 5.390 4.171 2.793 5.238 . 0 0 "[ . 1 . 2]" 1
470 1 39 VAL H 1 78 ALA MB 5.005 . 5.005 4.387 4.200 4.948 . 0 0 "[ . 1 . 2]" 1
471 1 69 GLN HA 1 72 GLY H 5.126 . 5.126 3.577 3.353 3.903 . 0 0 "[ . 1 . 2]" 1
472 1 71 THR MG 1 72 GLY H 4.884 . 4.884 3.659 3.525 3.765 . 0 0 "[ . 1 . 2]" 1
473 1 68 LEU MD2 1 71 THR H 5.071 . 5.071 4.755 4.579 4.941 . 0 0 "[ . 1 . 2]" 1
474 1 70 ARG HB3 1 71 THR H 4.796 . 4.796 3.658 3.388 3.912 . 0 0 "[ . 1 . 2]" 1
475 1 69 GLN HA 1 71 THR H 4.972 . 4.972 4.362 4.164 4.601 . 0 0 "[ . 1 . 2]" 1
476 1 19 VAL HA 1 22 THR H 5.060 . 5.060 3.908 3.400 4.312 . 0 0 "[ . 1 . 2]" 1
477 1 15 GLU HB2 1 16 GLY H 5.159 . 5.159 3.798 2.732 4.224 . 0 0 "[ . 1 . 2]" 1
478 1 28 SER HA 1 30 ILE H 4.895 . 4.895 4.167 3.838 4.586 . 0 0 "[ . 1 . 2]" 1
479 1 4 TYR H 1 4 TYR QD 5.280 . 5.280 3.035 1.980 4.397 . 0 0 "[ . 1 . 2]" 1
480 1 5 GLU H 1 5 GLU QG 5.082 . 5.082 3.012 1.867 4.537 . 0 0 "[ . 1 . 2]" 1
481 1 3 ASP H 1 4 TYR H 5.720 . 5.720 3.910 2.378 4.659 . 0 0 "[ . 1 . 2]" 1
482 1 15 GLU HB3 1 16 GLY H 5.159 . 5.159 3.100 2.446 4.199 . 0 0 "[ . 1 . 2]" 1
483 1 17 PHE H 1 21 LEU MD1 5.071 . 5.071 4.173 3.708 5.207 0.136 19 0 "[ . 1 . 2]" 1
484 1 14 LEU MD2 1 17 PHE H 5.445 . 5.445 4.829 4.259 5.234 . 0 0 "[ . 1 . 2]" 1
485 1 18 ARG H 1 19 VAL H 5.170 . 5.170 2.993 2.718 3.398 . 0 0 "[ . 1 . 2]" 1
486 1 17 PHE HB2 1 18 ARG H 5.456 . 5.456 4.006 3.703 4.367 . 0 0 "[ . 1 . 2]" 1
487 1 19 VAL MG2 1 20 THR H 5.060 . 5.060 3.485 2.249 4.041 . 0 0 "[ . 1 . 2]" 1
488 1 17 PHE HB2 1 21 LEU H 5.379 . 5.379 4.352 3.418 4.740 . 0 0 "[ . 1 . 2]" 1
489 1 18 ARG HA 1 22 THR H 5.082 . 5.082 3.878 3.470 4.187 . 0 0 "[ . 1 . 2]" 1
490 1 21 LEU MD1 1 22 THR H 5.038 . 5.038 4.505 4.227 4.674 . 0 0 "[ . 1 . 2]" 1
491 1 22 THR H 1 25 ILE MD 6.050 . 6.050 5.076 4.719 6.114 0.064 18 0 "[ . 1 . 2]" 1
492 1 22 THR H 1 65 LEU MD1 6.050 . 6.050 4.206 3.398 4.814 . 0 0 "[ . 1 . 2]" 1
493 1 18 ARG HG2 1 22 THR H 6.050 . 6.050 4.896 3.983 6.354 0.304 20 0 "[ . 1 . 2]" 1
494 1 18 ARG HG3 1 22 THR H 6.050 . 6.050 5.088 4.230 6.209 0.159 6 0 "[ . 1 . 2]" 1
495 1 23 SER H 1 24 VAL HB 5.786 . 5.786 4.970 4.639 5.268 . 0 0 "[ . 1 . 2]" 1
496 1 20 THR MG 1 23 SER H 5.555 . 5.555 4.783 4.616 5.034 . 0 0 "[ . 1 . 2]" 1
497 1 23 SER H 1 24 VAL MG2 5.126 . 5.126 4.021 3.804 4.228 . 0 0 "[ . 1 . 2]" 1
498 1 23 SER H 1 61 VAL MG1 5.643 . 5.643 4.830 4.629 5.044 . 0 0 "[ . 1 . 2]" 1
499 1 23 SER H 1 90 LEU MD2 6.050 . 6.050 5.640 5.126 6.146 0.096 20 0 "[ . 1 . 2]" 1
500 1 22 THR H 1 24 VAL H 5.962 . 5.962 4.489 4.144 4.817 . 0 0 "[ . 1 . 2]" 1
501 1 24 VAL H 1 25 ILE HB 5.599 . 5.599 4.802 4.600 5.103 . 0 0 "[ . 1 . 2]" 1
502 1 23 SER H 1 25 ILE H 5.544 . 5.544 4.154 3.865 4.436 . 0 0 "[ . 1 . 2]" 1
503 1 25 ILE H 1 26 ASP H 5.357 . 5.357 4.439 4.044 4.626 . 0 0 "[ . 1 . 2]" 1
504 1 25 ILE MD 1 26 ASP H 5.588 . 5.588 5.299 4.998 5.630 0.042 16 0 "[ . 1 . 2]" 1
505 1 25 ILE HG12 1 26 ASP H 5.214 . 5.214 4.634 4.177 4.973 . 0 0 "[ . 1 . 2]" 1
506 1 29 ARG H 1 29 ARG HD2 6.050 . 6.050 5.116 2.738 5.890 . 0 0 "[ . 1 . 2]" 1
507 1 29 ARG H 1 29 ARG HD3 6.050 . 6.050 4.728 3.990 5.949 . 0 0 "[ . 1 . 2]" 1
508 1 29 ARG H 1 30 ILE HG12 5.412 . 5.412 3.923 3.591 4.143 . 0 0 "[ . 1 . 2]" 1
509 1 29 ARG H 1 30 ILE MG 5.412 . 5.412 4.444 4.232 4.725 . 0 0 "[ . 1 . 2]" 1
510 1 33 TYR H 1 86 TYR QE 6.050 . 6.050 5.019 4.426 5.497 . 0 0 "[ . 1 . 2]" 1
511 1 20 THR H 1 21 LEU HA 6.050 . 6.050 5.270 5.090 5.456 . 0 0 "[ . 1 . 2]" 1
512 1 33 TYR H 1 34 LEU HA 6.050 . 6.050 5.283 5.162 5.432 . 0 0 "[ . 1 . 2]" 1
513 1 31 THR HA 1 35 ARG H 5.027 . 5.027 4.072 3.884 4.257 . 0 0 "[ . 1 . 2]" 1
514 1 36 GLN HG2 1 37 CYS H 6.050 . 6.050 4.300 3.628 5.181 . 0 0 "[ . 1 . 2]" 1
515 1 36 GLN HG3 1 37 CYS H 6.050 . 6.050 4.582 3.453 5.351 . 0 0 "[ . 1 . 2]" 1
516 1 36 GLN H 1 38 LYS H 4.785 . 4.785 3.902 3.759 4.136 . 0 0 "[ . 1 . 2]" 1
517 1 37 CYS HB3 1 39 VAL H 5.390 . 5.390 3.504 2.940 4.927 . 0 0 "[ . 1 . 2]" 1
518 1 38 LYS HB2 1 39 VAL H 5.434 . 5.434 4.055 3.795 4.541 . 0 0 "[ . 1 . 2]" 1
519 1 34 LEU HB3 1 39 VAL H 5.489 . 5.489 4.557 4.247 4.881 . 0 0 "[ . 1 . 2]" 1
520 1 34 LEU MD2 1 39 VAL H 5.852 . 5.852 4.968 4.575 5.242 . 0 0 "[ . 1 . 2]" 1
521 1 34 LEU HB2 1 40 LEU H 5.808 . 5.808 4.633 4.204 5.126 . 0 0 "[ . 1 . 2]" 1
522 1 34 LEU HB3 1 40 LEU H 5.214 . 5.214 3.527 3.126 4.043 . 0 0 "[ . 1 . 2]" 1
523 1 40 LEU H 1 41 ASN H 5.478 . 5.478 4.423 4.162 4.578 . 0 0 "[ . 1 . 2]" 1
524 1 41 ASN H 1 42 PRO QD 5.203 . 5.203 4.523 4.385 4.559 . 0 0 "[ . 1 . 2]" 1
525 1 42 PRO HA 1 44 ASP H 5.390 . 5.390 4.686 4.226 4.943 . 0 0 "[ . 1 . 2]" 1
526 1 42 PRO QD 1 44 ASP H 5.126 . 5.126 4.736 4.551 5.125 . 0 0 "[ . 1 . 2]" 1
527 1 44 ASP H 1 45 GLU HB2 5.775 . 5.775 4.958 4.667 5.189 . 0 0 "[ . 1 . 2]" 1
528 1 44 ASP H 1 47 GLN QB 6.050 . 6.050 4.727 4.390 5.848 . 0 0 "[ . 1 . 2]" 1
529 1 40 LEU MD1 1 44 ASP H 6.050 . 6.050 4.373 4.057 4.656 . 0 0 "[ . 1 . 2]" 1
530 1 40 LEU MD2 1 44 ASP H 6.039 . 6.039 5.473 4.953 5.984 . 0 0 "[ . 1 . 2]" 1
531 1 41 ASN H 1 45 GLU H 5.280 . 5.280 4.439 4.224 4.750 . 0 0 "[ . 1 . 2]" 1
532 1 40 LEU HG 1 45 GLU H 4.972 . 4.972 3.277 3.011 3.749 . 0 0 "[ . 1 . 2]" 1
533 1 48 VAL H 1 50 SER H 5.533 . 5.533 3.946 3.787 4.150 . 0 0 "[ . 1 . 2]" 1
534 1 49 LEU MD2 1 50 SER H 5.720 . 5.720 4.774 4.697 4.873 . 0 0 "[ . 1 . 2]" 1
535 1 51 ASP HA 1 53 ASN H 5.170 . 5.170 3.816 2.865 4.526 . 0 0 "[ . 1 . 2]" 1
536 1 47 GLN HE22 1 67 ILE MD 5.434 . 5.434 2.778 1.652 5.472 0.038 4 0 "[ . 1 . 2]" 1
537 1 47 GLN HE21 1 67 ILE MD 5.434 . 5.434 3.328 2.315 5.450 0.016 2 0 "[ . 1 . 2]" 1
538 1 48 VAL H 1 49 LEU HB2 5.291 . 5.291 4.806 4.559 5.042 . 0 0 "[ . 1 . 2]" 1
539 1 22 THR MG 1 61 VAL H 5.610 . 5.610 4.100 3.543 4.900 . 0 0 "[ . 1 . 2]" 1
540 1 65 LEU H 1 68 LEU HB2 6.050 . 6.050 5.066 4.798 5.324 . 0 0 "[ . 1 . 2]" 1
541 1 60 LYS H 1 62 GLY H 5.379 . 5.379 4.311 4.086 4.694 . 0 0 "[ . 1 . 2]" 1
542 1 58 LYS HA 1 62 GLY H 6.050 . 6.050 4.620 4.157 5.182 . 0 0 "[ . 1 . 2]" 1
543 1 62 GLY H 1 65 LEU MD1 5.753 . 5.753 4.478 4.156 4.757 . 0 0 "[ . 1 . 2]" 1
544 1 61 VAL H 1 63 VAL H 5.324 . 5.324 4.161 3.975 4.435 . 0 0 "[ . 1 . 2]" 1
545 1 63 VAL H 1 65 LEU H 5.665 . 5.665 4.270 4.122 4.431 . 0 0 "[ . 1 . 2]" 1
546 1 63 VAL H 1 65 LEU HB2 6.050 . 6.050 5.424 5.268 5.692 . 0 0 "[ . 1 . 2]" 1
547 1 60 LYS HA 1 64 LEU H 5.071 . 5.071 3.861 3.616 4.077 . 0 0 "[ . 1 . 2]" 1
548 1 63 VAL HA 1 67 ILE H 6.050 . 6.050 4.518 4.239 5.100 . 0 0 "[ . 1 . 2]" 1
549 1 64 LEU HA 1 66 ASP H 5.137 . 5.137 4.370 4.159 4.557 . 0 0 "[ . 1 . 2]" 1
550 1 65 LEU MD1 1 66 ASP H 5.126 . 5.126 4.567 4.446 4.726 . 0 0 "[ . 1 . 2]" 1
551 1 67 ILE H 1 69 GLN H 5.126 . 5.126 3.975 3.746 4.241 . 0 0 "[ . 1 . 2]" 1
552 1 67 ILE HA 1 69 GLN H 5.302 . 5.302 4.306 4.144 4.549 . 0 0 "[ . 1 . 2]" 1
553 1 67 ILE MG 1 71 THR H 5.819 . 5.819 4.608 4.129 4.959 . 0 0 "[ . 1 . 2]" 1
554 1 70 ARG H 1 72 GLY H 5.467 . 5.467 4.049 3.919 4.195 . 0 0 "[ . 1 . 2]" 1
555 1 71 THR HG1 1 72 GLY H 5.489 . 5.489 5.143 4.453 5.584 0.095 17 0 "[ . 1 . 2]" 1
556 1 75 GLY H 1 77 VAL H 5.654 . 5.654 4.473 4.206 4.829 . 0 0 "[ . 1 . 2]" 1
557 1 71 THR MG 1 75 GLY H 5.544 . 5.544 2.814 2.302 3.475 . 0 0 "[ . 1 . 2]" 1
558 1 73 HIS H 1 76 TYR H 5.863 . 5.863 4.707 4.526 4.822 . 0 0 "[ . 1 . 2]" 1
559 1 74 LYS H 1 76 TYR H 6.050 . 6.050 4.344 4.077 4.554 . 0 0 "[ . 1 . 2]" 1
560 1 77 VAL H 1 78 ALA MB 5.324 . 5.324 4.424 4.317 4.564 . 0 0 "[ . 1 . 2]" 1
561 1 78 ALA H 1 79 PHE HB2 5.665 . 5.665 4.982 4.720 5.165 . 0 0 "[ . 1 . 2]" 1
562 1 76 TYR HA 1 79 PHE H 4.994 . 4.994 3.678 3.387 4.020 . 0 0 "[ . 1 . 2]" 1
563 1 79 PHE H 1 80 LEU HG 5.192 . 5.192 4.663 4.363 4.893 . 0 0 "[ . 1 . 2]" 1
564 1 80 LEU H 1 81 GLU HB2 5.489 . 5.489 4.912 4.766 5.065 . 0 0 "[ . 1 . 2]" 1
565 1 80 LEU MD1 1 81 GLU H 5.357 . 5.357 4.580 4.160 4.984 . 0 0 "[ . 1 . 2]" 1
566 1 82 SER H 1 85 LEU MD1 5.731 . 5.731 5.060 4.608 5.669 . 0 0 "[ . 1 . 2]" 1
567 1 83 LEU H 1 87 TYR H 5.742 . 5.742 5.216 5.065 5.367 . 0 0 "[ . 1 . 2]" 1
568 1 33 TYR QE 1 83 LEU H 6.050 . 6.050 5.493 5.269 5.829 . 0 0 "[ . 1 . 2]" 1
569 1 79 PHE HA 1 83 LEU H 5.159 . 5.159 4.042 3.458 4.248 . 0 0 "[ . 1 . 2]" 1
570 1 81 GLU HA 1 83 LEU H 5.082 . 5.082 4.655 4.352 5.013 . 0 0 "[ . 1 . 2]" 1
571 1 30 ILE MG 1 83 LEU H 5.775 . 5.775 4.528 4.205 5.013 . 0 0 "[ . 1 . 2]" 1
572 1 30 ILE MD 1 83 LEU H 6.050 . 6.050 4.599 4.196 4.872 . 0 0 "[ . 1 . 2]" 1
573 1 84 GLU H 1 91 TYR QE 5.566 . 5.566 4.564 4.278 4.949 . 0 0 "[ . 1 . 2]" 1
574 1 84 GLU H 1 85 LEU HA 6.050 . 6.050 5.363 5.267 5.439 . 0 0 "[ . 1 . 2]" 1
575 1 80 LEU HA 1 84 GLU H 5.412 . 5.412 4.113 3.893 4.240 . 0 0 "[ . 1 . 2]" 1
576 1 85 LEU H 1 87 TYR H 5.269 . 5.269 4.139 3.870 4.550 . 0 0 "[ . 1 . 2]" 1
577 1 81 GLU HA 1 85 LEU H 5.478 . 5.478 4.482 4.193 4.961 . 0 0 "[ . 1 . 2]" 1
578 1 86 TYR H 1 88 PRO HD3 5.203 . 5.203 4.226 3.824 4.905 . 0 0 "[ . 1 . 2]" 1
579 1 85 LEU MD2 1 86 TYR H 5.291 . 5.291 4.691 4.613 4.798 . 0 0 "[ . 1 . 2]" 1
580 1 83 LEU MD1 1 87 TYR H 5.588 . 5.588 5.562 5.369 5.691 0.103 7 0 "[ . 1 . 2]" 1
581 1 90 LEU H 1 91 TYR HA 6.006 . 6.006 5.292 5.155 5.430 . 0 0 "[ . 1 . 2]" 1
582 1 90 LEU H 1 91 TYR HB3 5.126 . 5.126 4.613 4.469 5.162 0.036 20 0 "[ . 1 . 2]" 1
583 1 89 GLN HG3 1 90 LEU H 5.698 . 5.698 3.828 2.019 5.104 . 0 0 "[ . 1 . 2]" 1
584 1 90 LEU MD1 1 91 TYR H 5.676 . 5.676 4.570 4.456 4.693 . 0 0 "[ . 1 . 2]" 1
585 1 90 LEU MD2 1 91 TYR H 5.984 . 5.984 4.372 4.033 4.790 . 0 0 "[ . 1 . 2]" 1
586 1 83 LEU MD1 1 91 TYR H 5.852 . 5.852 4.596 4.231 5.111 . 0 0 "[ . 1 . 2]" 1
587 1 91 TYR H 1 94 VAL MG1 6.050 . 6.050 4.895 4.730 5.093 . 0 0 "[ . 1 . 2]" 1
588 1 91 TYR H 1 93 LYS H 5.148 . 5.148 4.082 3.842 4.338 . 0 0 "[ . 1 . 2]" 1
589 1 93 LYS H 1 94 VAL MG1 5.148 . 5.148 4.334 4.147 4.494 . 0 0 "[ . 1 . 2]" 1
590 1 90 LEU MD1 1 93 LYS H 5.632 . 5.632 4.442 3.966 4.878 . 0 0 "[ . 1 . 2]" 1
591 1 91 TYR H 1 94 VAL H 5.544 . 5.544 4.841 4.729 4.990 . 0 0 "[ . 1 . 2]" 1
592 1 90 LEU HA 1 94 VAL H 5.346 . 5.346 4.041 3.835 4.270 . 0 0 "[ . 1 . 2]" 1
593 1 93 LYS HG2 1 94 VAL H 5.456 . 5.456 4.439 3.420 5.367 . 0 0 "[ . 1 . 2]" 1
594 1 14 LEU MD2 1 94 VAL H 5.456 . 5.456 5.088 4.889 5.386 . 0 0 "[ . 1 . 2]" 1
595 1 90 LEU MD1 1 94 VAL H 5.247 . 5.247 3.929 3.502 4.296 . 0 0 "[ . 1 . 2]" 1
596 1 92 LYS QB 1 95 THR H 5.874 . 5.874 5.293 4.961 5.734 . 0 0 "[ . 1 . 2]" 1
597 1 92 LYS HA 1 96 GLY H 5.148 . 5.148 4.306 2.608 5.158 0.010 4 0 "[ . 1 . 2]" 1
598 1 95 THR MG 1 96 GLY H 5.192 . 5.192 4.061 2.218 4.355 . 0 0 "[ . 1 . 2]" 1
599 1 34 LEU HA 1 36 GLN H 5.346 . 5.346 4.575 4.458 4.694 . 0 0 "[ . 1 . 2]" 1
600 1 11 TRP HE3 1 14 LEU MD1 4.653 . 4.653 3.318 2.392 4.469 . 0 0 "[ . 1 . 2]" 1
601 1 11 TRP HA 1 11 TRP HD1 4.928 . 4.928 4.278 3.998 4.514 . 0 0 "[ . 1 . 2]" 1
602 1 11 TRP HD1 1 69 GLN HA 5.159 . 5.159 3.590 2.841 4.924 . 0 0 "[ . 1 . 2]" 1
603 1 4 TYR HA 1 4 TYR QD 4.433 . 4.433 3.155 2.198 3.825 . 0 0 "[ . 1 . 2]" 1
604 1 33 TYR HA 1 33 TYR QD 4.081 . 4.081 2.896 2.589 3.188 . 0 0 "[ . 1 . 2]" 1
605 1 33 TYR QD 1 82 SER HA 4.631 . 4.631 3.611 3.103 4.234 . 0 0 "[ . 1 . 2]" 1
606 1 79 PHE QD 1 83 LEU MD1 3.938 . 3.938 3.202 2.908 3.454 . 0 0 "[ . 1 . 2]" 1
607 1 34 LEU MD2 1 79 PHE QD 3.641 . 3.641 2.568 2.228 2.970 . 0 0 "[ . 1 . 2]" 1
608 1 34 LEU MD2 1 79 PHE QE 3.828 . 3.828 3.928 3.744 4.044 0.216 17 0 "[ . 1 . 2]" 1
609 1 79 PHE QE 1 83 LEU MD2 4.235 . 4.235 3.203 2.852 3.930 . 0 0 "[ . 1 . 2]" 1
610 1 79 PHE HZ 1 83 LEU MD1 4.554 . 4.554 3.197 2.883 3.728 . 0 0 "[ . 1 . 2]" 1
611 1 11 TRP HH2 1 68 LEU HB3 4.521 . 4.521 2.847 2.258 3.364 . 0 0 "[ . 1 . 2]" 1
612 1 11 TRP HH2 1 68 LEU MD1 4.532 . 4.532 2.629 2.209 3.113 . 0 0 "[ . 1 . 2]" 1
613 1 11 TRP HZ2 1 75 GLY HA3 5.335 . 5.335 3.268 2.447 3.959 . 0 0 "[ . 1 . 2]" 1
614 1 11 TRP HZ2 1 68 LEU HB3 4.598 . 4.598 2.548 1.971 2.917 . 0 0 "[ . 1 . 2]" 1
615 1 29 ARG QB 1 87 TYR QE 4.521 . 4.521 3.229 2.777 4.317 . 0 0 "[ . 1 . 2]" 1
616 1 86 TYR QB 1 87 TYR QE 4.433 . 4.433 3.227 2.824 3.708 . 0 0 "[ . 1 . 2]" 1
617 1 30 ILE MG 1 86 TYR QE 4.400 . 4.400 3.149 2.972 3.332 . 0 0 "[ . 1 . 2]" 1
618 1 85 LEU MD1 1 86 TYR QE 4.356 . 4.356 3.389 2.887 4.161 . 0 0 "[ . 1 . 2]" 1
619 1 11 TRP HE3 1 14 LEU HB2 5.104 . 5.104 3.127 2.677 4.114 . 0 0 "[ . 1 . 2]" 1
620 1 11 TRP HH2 1 68 LEU HB2 4.807 . 4.807 2.983 2.598 3.685 . 0 0 "[ . 1 . 2]" 1
621 1 24 VAL MG1 1 87 TYR QE 4.367 . 4.367 3.168 2.598 4.189 . 0 0 "[ . 1 . 2]" 1
622 1 25 ILE MG 1 87 TYR QE 4.433 . 4.433 2.808 2.317 3.764 . 0 0 "[ . 1 . 2]" 1
623 1 83 LEU MD2 1 87 TYR QE 4.840 . 4.840 3.631 3.056 4.400 . 0 0 "[ . 1 . 2]" 1
624 1 17 PHE HA 1 17 PHE QD 4.180 . 4.180 3.070 2.498 3.757 . 0 0 "[ . 1 . 2]" 1
625 1 87 TYR HA 1 87 TYR QD 4.323 . 4.323 2.814 2.576 3.115 . 0 0 "[ . 1 . 2]" 1
626 1 26 ASP HA 1 27 PRO HD2 3.883 . 3.883 2.433 2.003 3.137 . 0 0 "[ . 1 . 2]" 1
627 1 26 ASP HA 1 27 PRO HD3 3.861 . 3.861 2.316 1.997 2.690 . 0 0 "[ . 1 . 2]" 1
628 1 41 ASN HA 1 42 PRO QD 3.443 . 3.443 2.171 1.980 2.269 . 0 0 "[ . 1 . 2]" 1
629 1 31 THR HB 1 49 LEU MD2 4.290 . 4.290 3.584 2.963 4.279 . 0 0 "[ . 1 . 2]" 1
630 1 88 PRO HA 1 91 TYR HB3 4.125 . 4.125 2.579 2.105 3.435 . 0 0 "[ . 1 . 2]" 1
631 1 84 GLU HA 1 88 PRO HA 4.466 . 4.466 2.659 2.277 3.380 . 0 0 "[ . 1 . 2]" 1
632 1 63 VAL HA 1 66 ASP HB2 4.884 . 4.884 3.650 3.032 4.116 . 0 0 "[ . 1 . 2]" 1
633 1 19 VAL HA 1 19 VAL MG2 3.751 . 3.751 2.596 2.355 3.276 . 0 0 "[ . 1 . 2]" 1
634 1 67 ILE HA 1 67 ILE HG13 4.499 . 4.499 3.023 2.905 3.121 . 0 0 "[ . 1 . 2]" 1
635 1 61 VAL HA 1 64 LEU HB3 4.323 . 4.323 2.759 2.004 3.962 . 0 0 "[ . 1 . 2]" 1
636 1 61 VAL HA 1 64 LEU HB2 4.323 . 4.323 2.839 2.242 3.500 . 0 0 "[ . 1 . 2]" 1
637 1 77 VAL HA 1 77 VAL MG1 3.729 . 3.729 2.479 2.429 2.527 . 0 0 "[ . 1 . 2]" 1
638 1 25 ILE HA 1 25 ILE HG13 4.378 . 4.378 3.057 2.954 3.170 . 0 0 "[ . 1 . 2]" 1
639 1 94 VAL HA 1 94 VAL MG1 3.685 . 3.685 2.389 2.335 2.417 . 0 0 "[ . 1 . 2]" 1
640 1 25 ILE HA 1 25 ILE HG12 4.202 . 4.202 2.673 2.391 2.787 . 0 0 "[ . 1 . 2]" 1
641 1 84 GLU HA 1 91 TYR HB3 4.389 . 4.389 3.051 2.830 3.310 . 0 0 "[ . 1 . 2]" 1
642 1 84 GLU HA 1 91 TYR HB2 4.345 . 4.345 3.221 2.865 3.999 . 0 0 "[ . 1 . 2]" 1
643 1 45 GLU HA 1 48 VAL HB 4.422 . 4.422 3.224 2.764 3.975 . 0 0 "[ . 1 . 2]" 1
644 1 92 LYS HA 1 92 LYS HG2 4.213 . 4.213 2.936 2.494 3.704 . 0 0 "[ . 1 . 2]" 1
645 1 65 LEU HA 1 68 LEU MD1 4.213 . 4.213 2.970 2.049 3.726 . 0 0 "[ . 1 . 2]" 1
646 1 91 TYR HA 1 94 VAL MG2 3.872 . 3.872 2.187 1.695 2.480 . 0 0 "[ . 1 . 2]" 1
647 1 18 ARG HA 1 21 LEU MD1 4.092 . 4.092 2.666 2.219 3.947 . 0 0 "[ . 1 . 2]" 1
648 1 47 GLN HA 1 48 VAL HA 5.115 . 5.115 4.817 4.711 4.896 . 0 0 "[ . 1 . 2]" 1
649 1 28 SER QB 1 49 LEU MD2 4.301 . 4.301 2.566 2.005 3.811 . 0 0 "[ . 1 . 2]" 1
650 1 27 PRO HA 1 30 ILE HG13 4.565 . 4.565 3.119 2.573 4.079 . 0 0 "[ . 1 . 2]" 1
651 1 79 PHE HA 1 79 PHE QD 3.949 . 3.949 2.301 2.105 2.583 . 0 0 "[ . 1 . 2]" 1
652 1 11 TRP HA 1 11 TRP HE3 4.587 . 4.587 2.806 2.345 3.274 . 0 0 "[ . 1 . 2]" 1
653 1 81 GLU HA 1 84 GLU HB3 4.279 . 4.279 2.760 2.086 3.325 . 0 0 "[ . 1 . 2]" 1
654 1 64 LEU HA 1 67 ILE HB 4.114 . 4.114 2.598 2.207 2.952 . 0 0 "[ . 1 . 2]" 1
655 1 68 LEU HA 1 68 LEU HG 4.345 . 4.345 3.111 2.931 3.232 . 0 0 "[ . 1 . 2]" 1
656 1 83 LEU HA 1 87 TYR HB2 4.367 . 4.367 3.138 2.762 3.510 . 0 0 "[ . 1 . 2]" 1
657 1 46 GLU HA 1 49 LEU H 4.686 . 4.686 3.392 2.930 3.708 . 0 0 "[ . 1 . 2]" 1
658 1 89 GLN HA 1 92 LYS QD 4.928 . 4.928 3.677 2.849 5.002 0.074 17 0 "[ . 1 . 2]" 1
659 1 43 ASP HA 1 46 GLU QB 3.751 . 3.751 3.028 2.462 3.755 0.004 16 0 "[ . 1 . 2]" 1
660 1 14 LEU HA 1 17 PHE QD 4.279 . 4.279 2.535 1.964 3.549 . 0 0 "[ . 1 . 2]" 1
661 1 78 ALA HA 1 81 GLU HB2 4.257 . 4.257 2.679 2.346 3.193 . 0 0 "[ . 1 . 2]" 1
662 1 39 VAL QG 1 78 ALA HA 4.895 . 4.895 4.100 3.819 4.264 . 0 0 "[ . 1 . 2]" 1
663 1 77 VAL MG1 1 78 ALA HA 5.181 . 5.181 3.542 3.275 3.765 . 0 0 "[ . 1 . 2]" 1
664 1 31 THR H 1 32 PRO HD3 4.510 . 4.510 3.527 3.299 3.700 . 0 0 "[ . 1 . 2]" 1
665 1 27 PRO HD2 1 61 VAL MG2 4.532 . 4.532 2.857 1.959 3.436 . 0 0 "[ . 1 . 2]" 1
666 1 41 ASN HB3 1 42 PRO QD 4.015 . 4.015 2.401 2.181 3.387 . 0 0 "[ . 1 . 2]" 1
667 1 87 TYR HA 1 88 PRO HD2 3.872 . 3.872 2.458 2.136 2.883 . 0 0 "[ . 1 . 2]" 1
668 1 87 TYR HA 1 88 PRO HD3 4.268 . 4.268 3.069 2.411 3.467 . 0 0 "[ . 1 . 2]" 1
669 1 86 TYR HA 1 86 TYR QD 4.092 . 4.092 2.992 2.623 3.181 . 0 0 "[ . 1 . 2]" 1
670 1 20 THR HA 1 24 VAL MG2 4.455 . 4.455 3.310 2.948 3.695 . 0 0 "[ . 1 . 2]" 1
671 1 31 THR HA 1 40 LEU MD2 4.807 . 4.807 2.757 2.138 4.561 . 0 0 "[ . 1 . 2]" 1
672 1 96 GLY QA 1 97 LYS HA 4.499 . 4.499 4.120 3.980 4.595 0.096 18 0 "[ . 1 . 2]" 1
673 1 87 TYR HB3 1 90 LEU HB2 4.312 . 4.312 3.051 2.705 3.405 . 0 0 "[ . 1 . 2]" 1
674 1 64 LEU MD1 1 68 LEU HB2 4.840 . 4.840 4.525 3.978 4.902 0.062 3 0 "[ . 1 . 2]" 1
675 1 34 LEU HB2 1 40 LEU MD1 5.874 . 5.874 4.198 3.105 5.640 . 0 0 "[ . 1 . 2]" 1
676 1 34 LEU HB3 1 39 VAL QG 4.136 . 4.136 2.481 2.240 2.957 . 0 0 "[ . 1 . 2]" 1
677 1 41 ASN HB2 1 42 PRO QD 4.015 . 4.015 3.628 2.169 4.101 0.086 3 0 "[ . 1 . 2]" 1
678 1 14 LEU MD2 1 17 PHE HB2 4.400 . 4.400 3.998 3.129 4.665 0.265 18 0 "[ . 1 . 2]" 1
679 1 44 ASP HB3 1 67 ILE MG 4.444 . 4.444 2.886 2.037 3.802 . 0 0 "[ . 1 . 2]" 1
680 1 81 GLU H 1 81 GLU HG2 4.433 . 4.433 2.895 2.187 3.761 . 0 0 "[ . 1 . 2]" 1
681 1 47 GLN H 1 47 GLN HG3 5.291 . 5.291 4.410 3.367 4.637 . 0 0 "[ . 1 . 2]" 1
682 1 15 GLU H 1 15 GLU QG 4.433 . 4.433 3.593 2.157 4.108 . 0 0 "[ . 1 . 2]" 1
683 1 21 LEU HB3 1 25 ILE HB 4.906 . 4.906 3.371 2.064 3.799 . 0 0 "[ . 1 . 2]" 1
684 1 93 LYS H 1 93 LYS HB2 4.037 . 4.037 2.491 2.235 2.631 . 0 0 "[ . 1 . 2]" 1
685 1 88 PRO HB2 1 92 LYS QB 5.346 . 5.346 5.089 4.488 5.578 0.232 17 0 "[ . 1 . 2]" 1
686 1 27 PRO QB 1 61 VAL MG2 4.356 . 4.356 3.612 2.217 4.472 0.116 11 0 "[ . 1 . 2]" 1
687 1 47 GLN QB 1 67 ILE MD 4.829 . 4.829 4.223 3.259 4.971 0.142 19 0 "[ . 1 . 2]" 1
688 1 36 GLN H 1 36 GLN HB3 4.268 . 4.268 2.770 2.462 3.653 . 0 0 "[ . 1 . 2]" 1
689 1 37 CYS HB3 1 78 ALA MB 4.543 . 4.543 2.669 2.265 3.033 . 0 0 "[ . 1 . 2]" 1
690 1 37 CYS HB2 1 78 ALA MB 4.543 . 4.543 3.012 2.291 3.452 . 0 0 "[ . 1 . 2]" 1
691 1 37 CYS HB3 1 39 VAL QG 4.378 . 4.378 2.459 1.937 3.885 . 0 0 "[ . 1 . 2]" 1
692 1 11 TRP H 1 11 TRP HB2 4.301 . 4.301 2.365 2.274 2.512 . 0 0 "[ . 1 . 2]" 1
693 1 67 ILE H 1 67 ILE HG12 4.433 . 4.433 3.436 3.246 3.581 . 0 0 "[ . 1 . 2]" 1
694 1 45 GLU H 1 45 GLU HB3 4.213 . 4.213 2.497 2.334 2.631 . 0 0 "[ . 1 . 2]" 1
695 1 38 LYS HA 1 38 LYS HD3 4.521 . 4.521 2.968 1.939 4.562 0.041 19 0 "[ . 1 . 2]" 1
696 1 29 ARG HA 1 29 ARG HG3 4.444 . 4.444 3.128 2.896 4.098 . 0 0 "[ . 1 . 2]" 1
697 1 30 ILE HG13 1 34 LEU HG 5.060 . 5.060 2.639 2.345 3.031 . 0 0 "[ . 1 . 2]" 1
698 1 30 ILE HG13 1 34 LEU MD1 3.949 . 3.949 2.180 2.037 2.399 . 0 0 "[ . 1 . 2]" 1
699 1 25 ILE HG13 1 90 LEU MD2 4.499 . 4.499 2.170 1.931 2.462 . 0 0 "[ . 1 . 2]" 1
700 1 25 ILE HG12 1 83 LEU MD2 5.115 . 5.115 2.595 2.143 3.646 . 0 0 "[ . 1 . 2]" 1
701 1 31 THR MG 1 49 LEU MD1 3.003 . 3.003 2.951 2.382 3.228 0.225 19 0 "[ . 1 . 2]" 1
702 1 95 THR HB 1 96 GLY H 5.478 . 5.478 4.137 3.641 4.518 . 0 0 "[ . 1 . 2]" 1
703 1 17 PHE QD 1 94 VAL HA 4.598 . 4.598 3.651 3.199 4.683 0.085 20 0 "[ . 1 . 2]" 1
704 1 25 ILE HA 1 87 TYR QE 4.972 . 4.972 2.878 2.283 3.931 . 0 0 "[ . 1 . 2]" 1
705 1 79 PHE HA 1 82 SER H 5.181 . 5.181 3.491 3.271 3.665 . 0 0 "[ . 1 . 2]" 1
706 1 11 TRP HZ2 1 76 TYR HA 4.411 . 4.411 2.630 2.073 3.028 . 0 0 "[ . 1 . 2]" 1
707 1 91 TYR HA 1 94 VAL H 4.664 . 4.664 3.739 3.262 4.051 . 0 0 "[ . 1 . 2]" 1
708 1 33 TYR HA 1 36 GLN H 4.994 . 4.994 3.547 3.185 3.821 . 0 0 "[ . 1 . 2]" 1
709 1 28 SER HA 1 31 THR H 4.895 . 4.895 3.393 3.075 3.782 . 0 0 "[ . 1 . 2]" 1
710 1 73 HIS HA 1 73 HIS HD2 4.884 . 4.884 3.489 2.641 4.639 . 0 0 "[ . 1 . 2]" 1
711 1 84 GLU HA 1 91 TYR QD 4.917 . 4.917 3.074 2.777 3.350 . 0 0 "[ . 1 . 2]" 1
712 1 91 TYR QD 1 92 LYS HA 5.236 . 5.236 3.778 3.368 4.614 . 0 0 "[ . 1 . 2]" 1
713 1 64 LEU HA 1 68 LEU H 6.050 . 6.050 3.994 3.538 4.235 . 0 0 "[ . 1 . 2]" 1
714 1 49 LEU HA 1 51 ASP H 5.335 . 5.335 3.746 3.497 3.997 . 0 0 "[ . 1 . 2]" 1
715 1 11 TRP HA 1 11 TRP HZ3 5.676 . 5.676 4.900 4.525 5.305 . 0 0 "[ . 1 . 2]" 1
716 1 70 ARG HA 1 72 GLY H 4.928 . 4.928 3.686 3.524 3.976 . 0 0 "[ . 1 . 2]" 1
717 1 11 TRP HH2 1 76 TYR HA 5.863 . 5.863 3.700 2.729 4.420 . 0 0 "[ . 1 . 2]" 1
718 1 11 TRP HZ2 1 75 GLY HA2 5.335 . 5.335 4.379 3.732 5.194 . 0 0 "[ . 1 . 2]" 1
719 1 32 PRO HD3 1 33 TYR H 5.621 . 5.621 4.055 3.869 4.212 . 0 0 "[ . 1 . 2]" 1
720 1 17 PHE HA 1 20 THR HB 4.906 . 4.906 3.673 2.801 4.194 . 0 0 "[ . 1 . 2]" 1
721 1 68 LEU MD2 1 71 THR HB 4.906 . 4.906 4.873 4.721 5.020 0.114 8 0 "[ . 1 . 2]" 1
722 1 77 VAL HA 1 80 LEU MD1 4.851 . 4.851 2.886 1.762 3.739 . 0 0 "[ . 1 . 2]" 1
723 1 77 VAL HA 1 80 LEU HB2 4.543 . 4.543 2.967 2.578 3.295 . 0 0 "[ . 1 . 2]" 1
724 1 63 VAL HA 1 66 ASP HB3 4.884 . 4.884 3.041 2.320 3.742 . 0 0 "[ . 1 . 2]" 1
725 1 44 ASP HA 1 67 ILE MD 4.411 . 4.411 3.523 2.946 4.577 0.166 15 0 "[ . 1 . 2]" 1
726 1 81 GLU HA 1 84 GLU HB2 4.598 . 4.598 3.202 2.336 4.041 . 0 0 "[ . 1 . 2]" 1
727 1 80 LEU HA 1 83 LEU HB2 4.543 . 4.543 2.993 2.531 4.134 . 0 0 "[ . 1 . 2]" 1
728 1 58 LYS HA 1 61 VAL MG1 5.995 . 5.995 4.533 4.058 5.213 . 0 0 "[ . 1 . 2]" 1
729 1 31 THR HB 1 32 PRO HG3 5.335 . 5.335 5.452 5.318 5.597 0.262 14 0 "[ . 1 . 2]" 1
730 1 23 SER HB3 1 24 VAL MG2 4.994 . 4.994 2.933 2.471 3.724 . 0 0 "[ . 1 . 2]" 1
731 1 12 SER HA 1 15 GLU QG 4.697 . 4.697 3.694 1.971 4.741 0.044 1 0 "[ . 1 . 2]" 1
732 1 77 VAL HA 1 80 LEU HB3 4.994 . 4.994 4.570 4.069 4.973 . 0 0 "[ . 1 . 2]" 1
733 1 90 LEU HG 1 91 TYR HA 5.577 . 5.577 4.108 3.624 4.389 . 0 0 "[ . 1 . 2]" 1
734 1 84 GLU HB3 1 85 LEU HA 5.533 . 5.533 4.446 4.242 4.564 . 0 0 "[ . 1 . 2]" 1
735 1 14 LEU HA 1 17 PHE HB2 5.005 . 5.005 3.452 2.530 5.205 0.200 18 0 "[ . 1 . 2]" 1
736 1 48 VAL HB 1 49 LEU HA 4.818 . 4.818 4.419 4.240 4.630 . 0 0 "[ . 1 . 2]" 1
737 1 18 ARG HA 1 65 LEU MD1 4.708 . 4.708 3.049 2.239 3.713 . 0 0 "[ . 1 . 2]" 1
738 1 84 GLU HA 1 85 LEU HA 5.181 . 5.181 4.769 4.728 4.824 . 0 0 "[ . 1 . 2]" 1
739 1 81 GLU HA 1 84 GLU HA 5.808 . 5.808 5.320 4.774 5.808 0.000 11 0 "[ . 1 . 2]" 1
740 1 30 ILE HA 1 32 PRO HD2 5.115 . 5.115 3.276 3.003 3.466 . 0 0 "[ . 1 . 2]" 1
741 1 27 PRO HD3 1 57 ARG QD 5.148 . 5.148 3.947 2.467 5.224 0.076 15 0 "[ . 1 . 2]" 1
742 1 27 PRO HD3 1 61 VAL MG1 5.060 . 5.060 3.248 2.054 4.380 . 0 0 "[ . 1 . 2]" 1
743 1 95 THR H 1 96 GLY QA 5.126 . 5.126 4.225 3.961 4.383 . 0 0 "[ . 1 . 2]" 1
744 1 30 ILE H 1 32 PRO HD2 5.665 . 5.665 4.245 3.935 4.773 . 0 0 "[ . 1 . 2]" 1
745 1 75 GLY HA3 1 78 ALA MB 4.983 . 4.983 4.272 3.878 4.635 . 0 0 "[ . 1 . 2]" 1
746 1 39 VAL HB 1 75 GLY HA3 5.071 . 5.071 3.327 3.012 3.851 . 0 0 "[ . 1 . 2]" 1
747 1 39 VAL HB 1 75 GLY HA2 5.071 . 5.071 2.406 2.008 3.024 . 0 0 "[ . 1 . 2]" 1
748 1 71 THR MG 1 75 GLY HA2 5.643 . 5.643 3.047 2.818 3.591 . 0 0 "[ . 1 . 2]" 1
749 1 25 ILE MG 1 27 PRO HD2 5.643 . 5.643 5.053 3.915 5.656 0.013 11 0 "[ . 1 . 2]" 1
750 1 30 ILE MG 1 32 PRO HD2 5.489 . 5.489 5.068 4.846 5.244 . 0 0 "[ . 1 . 2]" 1
751 1 51 ASP HB2 1 52 PRO HD3 6.050 . 6.050 4.969 4.723 5.367 . 0 0 "[ . 1 . 2]" 1
752 1 83 LEU HA 1 87 TYR HB3 6.028 . 6.028 4.863 4.517 5.229 . 0 0 "[ . 1 . 2]" 1
753 1 87 TYR HB3 1 90 LEU HA 6.050 . 6.050 5.021 4.784 5.258 . 0 0 "[ . 1 . 2]" 1
754 1 33 TYR HB3 1 86 TYR QE 5.082 . 5.082 3.785 3.292 4.339 . 0 0 "[ . 1 . 2]" 1
755 1 21 LEU HB3 1 22 THR H 5.478 . 5.478 3.617 3.360 3.807 . 0 0 "[ . 1 . 2]" 1
756 1 11 TRP HZ2 1 68 LEU HB2 5.115 . 5.115 3.529 2.881 4.141 . 0 0 "[ . 1 . 2]" 1
757 1 87 TYR HB3 1 90 LEU HB3 4.598 . 4.598 2.276 1.846 2.580 . 0 0 "[ . 1 . 2]" 1
758 1 83 LEU MD2 1 87 TYR HB3 4.763 . 4.763 4.259 3.795 4.574 . 0 0 "[ . 1 . 2]" 1
759 1 83 LEU MD2 1 87 TYR HB2 4.543 . 4.543 2.930 2.477 3.334 . 0 0 "[ . 1 . 2]" 1
760 1 25 ILE MD 1 87 TYR HB2 5.324 . 5.324 4.167 2.915 5.238 . 0 0 "[ . 1 . 2]" 1
761 1 87 TYR HB2 1 90 LEU HB3 4.543 . 4.543 3.017 2.631 3.340 . 0 0 "[ . 1 . 2]" 1
762 1 17 PHE HB2 1 21 LEU HG 4.565 . 4.565 2.939 2.563 3.252 . 0 0 "[ . 1 . 2]" 1
763 1 17 PHE HB3 1 21 LEU HG 4.543 . 4.543 3.426 2.870 4.333 . 0 0 "[ . 1 . 2]" 1
764 1 17 PHE HB3 1 21 LEU MD1 4.477 . 4.477 4.210 3.653 4.558 0.081 12 0 "[ . 1 . 2]" 1
765 1 29 ARG HG2 1 86 TYR QB 5.973 . 5.973 3.365 2.732 4.597 . 0 0 "[ . 1 . 2]" 1
766 1 14 LEU MD1 1 79 PHE HB3 5.324 . 5.324 3.984 3.267 4.975 . 0 0 "[ . 1 . 2]" 1
767 1 34 LEU MD2 1 79 PHE HB3 5.907 . 5.907 5.041 4.508 5.807 . 0 0 "[ . 1 . 2]" 1
768 1 53 ASN HB2 1 54 LEU MD2 6.050 . 6.050 4.439 2.794 5.973 . 0 0 "[ . 1 . 2]" 1
769 1 53 ASN HB3 1 54 LEU MD2 6.050 . 6.050 4.644 3.265 6.245 0.195 11 0 "[ . 1 . 2]" 1
770 1 46 GLU H 1 46 GLU HG3 5.247 . 5.247 4.295 2.409 4.597 . 0 0 "[ . 1 . 2]" 1
771 1 47 GLN H 1 47 GLN HG2 5.291 . 5.291 4.279 2.262 4.628 . 0 0 "[ . 1 . 2]" 1
772 1 69 GLN H 1 69 GLN HG2 5.368 . 5.368 4.523 4.436 4.657 . 0 0 "[ . 1 . 2]" 1
773 1 91 TYR HB2 1 92 LYS H 4.763 . 4.763 3.854 3.750 3.955 . 0 0 "[ . 1 . 2]" 1
774 1 11 TRP HH2 1 79 PHE HB3 5.148 . 5.148 3.605 2.805 4.483 . 0 0 "[ . 1 . 2]" 1
775 1 83 LEU HB2 1 91 TYR QD 4.664 . 4.664 2.459 2.058 3.095 . 0 0 "[ . 1 . 2]" 1
776 1 51 ASP HB3 1 54 LEU MD1 4.983 . 4.983 3.471 1.980 5.052 0.069 13 0 "[ . 1 . 2]" 1
777 1 85 LEU HB2 1 86 TYR QB 5.291 . 5.291 4.195 4.056 4.404 . 0 0 "[ . 1 . 2]" 1
778 1 90 LEU HB2 1 94 VAL MG1 5.357 . 5.357 4.799 4.666 4.934 . 0 0 "[ . 1 . 2]" 1
779 1 68 LEU MD1 1 79 PHE HB2 5.027 . 5.027 2.867 2.152 3.992 . 0 0 "[ . 1 . 2]" 1
780 1 83 LEU HB3 1 91 TYR HB2 4.763 . 4.763 2.286 1.819 2.623 . 0 0 "[ . 1 . 2]" 1
781 1 83 LEU HB2 1 91 TYR HB2 4.609 . 4.609 2.785 2.504 3.287 . 0 0 "[ . 1 . 2]" 1
782 1 88 PRO HA 1 91 TYR HB2 4.466 . 4.466 3.561 2.926 4.210 . 0 0 "[ . 1 . 2]" 1
783 1 73 HIS HA 1 76 TYR HB3 4.884 . 4.884 4.002 3.056 4.476 . 0 0 "[ . 1 . 2]" 1
784 1 30 ILE HB 1 33 TYR HB2 5.203 . 5.203 4.041 3.458 4.304 . 0 0 "[ . 1 . 2]" 1
785 1 30 ILE HB 1 33 TYR HB3 5.203 . 5.203 2.763 2.375 2.900 . 0 0 "[ . 1 . 2]" 1
786 1 65 LEU HA 1 68 LEU HB3 4.785 . 4.785 4.332 3.936 4.801 0.016 9 0 "[ . 1 . 2]" 1
787 1 17 PHE HB2 1 94 VAL MG1 4.939 . 4.939 2.994 2.202 3.653 . 0 0 "[ . 1 . 2]" 1
788 1 47 GLN HG2 1 48 VAL MG2 4.928 . 4.928 3.546 3.021 4.538 . 0 0 "[ . 1 . 2]" 1
789 1 60 LYS HA 1 63 VAL HB 4.499 . 4.499 2.387 1.946 3.000 . 0 0 "[ . 1 . 2]" 1
790 1 83 LEU HB3 1 91 TYR HB3 5.093 . 5.093 3.955 3.536 4.359 . 0 0 "[ . 1 . 2]" 1
791 1 69 GLN H 1 69 GLN HG3 5.368 . 5.368 4.524 4.394 4.583 . 0 0 "[ . 1 . 2]" 1
792 1 30 ILE HB 1 33 TYR QD 5.566 . 5.566 3.791 3.110 4.456 . 0 0 "[ . 1 . 2]" 1
793 1 41 ASN H 1 44 ASP HB2 5.258 . 5.258 2.947 2.494 4.105 . 0 0 "[ . 1 . 2]" 1
794 1 35 ARG HB3 1 36 GLN H 4.763 . 4.763 3.934 3.356 4.482 . 0 0 "[ . 1 . 2]" 1
795 1 37 CYS HB3 1 38 LYS H 5.357 . 5.357 3.891 3.416 4.510 . 0 0 "[ . 1 . 2]" 1
796 1 34 LEU MD1 1 79 PHE QD 4.785 . 4.785 3.683 2.972 4.294 . 0 0 "[ . 1 . 2]" 1
797 1 14 LEU HG 1 76 TYR QE 5.236 . 5.236 2.550 1.790 4.653 . 0 0 "[ . 1 . 2]" 1
798 1 29 ARG H 1 29 ARG HG2 5.192 . 5.192 4.537 2.720 4.673 . 0 0 "[ . 1 . 2]" 1
799 1 68 LEU H 1 68 LEU HG 5.709 . 5.709 2.505 2.378 2.792 . 0 0 "[ . 1 . 2]" 1
800 1 14 LEU MD1 1 79 PHE QD 3.971 . 3.971 2.606 1.870 3.911 . 0 0 "[ . 1 . 2]" 1
801 1 11 TRP HZ2 1 68 LEU MD1 4.499 . 4.499 3.837 3.230 4.483 . 0 0 "[ . 1 . 2]" 1
802 1 68 LEU MD1 1 79 PHE QD 5.170 . 5.170 2.761 2.468 3.652 . 0 0 "[ . 1 . 2]" 1
803 1 65 LEU H 1 68 LEU MD1 5.423 . 5.423 4.514 3.996 4.962 . 0 0 "[ . 1 . 2]" 1
804 1 68 LEU MD1 1 69 GLN H 5.489 . 5.489 4.911 4.664 5.003 . 0 0 "[ . 1 . 2]" 1
805 1 21 LEU MD1 1 79 PHE QE 4.675 . 4.675 2.608 2.128 3.348 . 0 0 "[ . 1 . 2]" 1
806 1 92 LYS H 1 92 LYS HG2 5.005 . 5.005 4.024 2.573 4.579 . 0 0 "[ . 1 . 2]" 1
807 1 93 LYS H 1 93 LYS HG3 5.192 . 5.192 3.907 2.402 4.549 . 0 0 "[ . 1 . 2]" 1
808 1 90 LEU H 1 90 LEU HG 5.236 . 5.236 4.556 4.499 4.611 . 0 0 "[ . 1 . 2]" 1
809 1 14 LEU MD1 1 76 TYR QE 4.411 . 4.411 2.242 1.787 3.713 . 0 0 "[ . 1 . 2]" 1
810 1 11 TRP HZ3 1 14 LEU MD1 4.499 . 4.499 3.366 2.563 4.520 0.021 3 0 "[ . 1 . 2]" 1
811 1 14 LEU MD2 1 94 VAL HB 4.719 . 4.719 2.617 1.783 3.240 . 0 0 "[ . 1 . 2]" 1
812 1 34 LEU HA 1 37 CYS HB3 5.159 . 5.159 3.688 2.889 4.853 . 0 0 "[ . 1 . 2]" 1
813 1 27 PRO HA 1 30 ILE HG12 4.609 . 4.609 2.654 1.951 3.334 . 0 0 "[ . 1 . 2]" 1
814 1 44 ASP HA 1 47 GLN QB 4.510 . 4.510 2.570 2.138 3.735 . 0 0 "[ . 1 . 2]" 1
815 1 90 LEU HG 1 94 VAL MG2 4.510 . 4.510 3.395 3.172 3.706 . 0 0 "[ . 1 . 2]" 1
816 1 67 ILE HA 1 67 ILE HG12 4.499 . 4.499 2.652 2.481 2.742 . 0 0 "[ . 1 . 2]" 1
817 1 84 GLU HB2 1 91 TYR QE 5.214 . 5.214 3.456 3.085 3.884 . 0 0 "[ . 1 . 2]" 1
818 1 27 PRO HA 1 34 LEU MD1 4.191 . 4.191 3.521 2.488 4.224 0.033 19 0 "[ . 1 . 2]" 1
819 1 68 LEU HA 1 68 LEU MD1 4.631 . 4.631 3.910 3.885 3.928 . 0 0 "[ . 1 . 2]" 1
820 1 21 LEU HB2 1 21 LEU MD1 3.608 . 3.608 2.434 2.400 2.491 . 0 0 "[ . 1 . 2]" 1
821 1 14 LEU MD1 1 83 LEU MD1 3.817 . 3.817 3.521 2.899 4.219 0.402 19 0 "[ . 1 . 2]" 1
822 1 62 GLY HA3 1 65 LEU MD1 4.719 . 4.719 3.851 3.553 4.322 . 0 0 "[ . 1 . 2]" 1
823 1 85 LEU H 1 85 LEU MD1 4.510 . 4.510 3.770 3.660 3.888 . 0 0 "[ . 1 . 2]" 1
824 1 91 TYR QE 1 95 THR MG 4.422 . 4.422 2.948 2.522 3.735 . 0 0 "[ . 1 . 2]" 1
825 1 65 LEU MD2 1 79 PHE QE 4.928 . 4.928 2.912 2.520 3.730 . 0 0 "[ . 1 . 2]" 1
826 1 20 THR MG 1 24 VAL H 4.598 . 4.598 4.012 3.773 4.244 . 0 0 "[ . 1 . 2]" 1
827 1 25 ILE MD 1 79 PHE QE 3.696 . 3.696 3.172 2.323 3.853 0.157 20 0 "[ . 1 . 2]" 1
828 1 25 ILE MD 1 79 PHE HZ 4.224 . 4.224 2.662 1.984 3.562 . 0 0 "[ . 1 . 2]" 1
829 1 30 ILE MD 1 79 PHE QE 3.608 . 3.608 2.167 1.917 2.502 . 0 0 "[ . 1 . 2]" 1
830 1 30 ILE MG 1 33 TYR QD 4.257 . 4.257 4.368 4.185 4.505 0.248 5 0 "[ . 1 . 2]" 1
831 1 30 ILE MG 1 87 TYR QE 3.828 . 3.828 3.150 2.261 3.867 0.039 14 0 "[ . 1 . 2]" 1
832 1 93 LYS H 1 94 VAL MG2 4.246 . 4.246 4.082 3.832 4.209 . 0 0 "[ . 1 . 2]" 1
833 1 34 LEU H 1 34 LEU MD2 4.411 . 4.411 3.374 3.258 3.538 . 0 0 "[ . 1 . 2]" 1
834 1 21 LEU MD2 1 79 PHE QE 3.795 . 3.795 3.458 2.826 4.028 0.233 20 0 "[ . 1 . 2]" 1
835 1 25 ILE MG 1 79 PHE HZ 4.532 . 4.532 2.647 1.962 3.691 . 0 0 "[ . 1 . 2]" 1
836 1 67 ILE H 1 67 ILE MD 4.664 . 4.664 3.539 3.401 3.764 . 0 0 "[ . 1 . 2]" 1
837 1 56 ILE H 1 56 ILE MD 4.972 . 4.972 3.200 1.878 3.768 . 0 0 "[ . 1 . 2]" 1
838 1 54 LEU HA 1 54 LEU MD1 4.334 . 4.334 3.361 2.022 4.197 . 0 0 "[ . 1 . 2]" 1
839 1 30 ILE MG 1 33 TYR H 6.028 . 6.028 4.951 4.756 5.181 . 0 0 "[ . 1 . 2]" 1
840 1 30 ILE MG 1 31 THR H 5.005 . 5.005 4.425 4.323 4.491 . 0 0 "[ . 1 . 2]" 1
841 1 38 LYS H 1 78 ALA MB 6.050 . 6.050 5.616 5.329 5.949 . 0 0 "[ . 1 . 2]" 1
842 1 91 TYR QD 1 95 THR MG 4.774 . 4.774 3.324 2.937 4.010 . 0 0 "[ . 1 . 2]" 1
843 1 30 ILE H 1 31 THR MG 5.269 . 5.269 4.110 3.633 4.437 . 0 0 "[ . 1 . 2]" 1
844 1 25 ILE HB 1 25 ILE MD 3.652 . 3.652 2.420 2.351 2.567 . 0 0 "[ . 1 . 2]" 1
845 1 21 LEU HB3 1 25 ILE MD 3.762 . 3.762 2.435 2.032 3.073 . 0 0 "[ . 1 . 2]" 1
846 1 21 LEU HA 1 25 ILE MD 4.224 . 4.224 2.433 2.029 3.489 . 0 0 "[ . 1 . 2]" 1
847 1 27 PRO HA 1 30 ILE MD 4.675 . 4.675 3.007 2.474 3.675 . 0 0 "[ . 1 . 2]" 1
848 1 21 LEU HB2 1 25 ILE MD 4.554 . 4.554 3.884 3.588 4.412 . 0 0 "[ . 1 . 2]" 1
849 1 21 LEU HG 1 25 ILE MD 4.818 . 4.818 4.091 3.998 4.204 . 0 0 "[ . 1 . 2]" 1
850 1 30 ILE MD 1 83 LEU MD2 4.169 . 4.169 2.706 2.132 3.132 . 0 0 "[ . 1 . 2]" 1
851 1 27 PRO QB 1 30 ILE MD 5.093 . 5.093 4.109 3.143 4.884 . 0 0 "[ . 1 . 2]" 1
852 1 30 ILE MD 1 86 TYR QB 5.093 . 5.093 4.573 4.320 4.797 . 0 0 "[ . 1 . 2]" 1
853 1 25 ILE MG 1 30 ILE MD 3.597 . 3.597 2.608 2.223 3.147 . 0 0 "[ . 1 . 2]" 1
854 1 25 ILE MG 1 26 ASP HA 5.137 . 5.137 3.783 3.226 4.283 . 0 0 "[ . 1 . 2]" 1
855 1 30 ILE HG13 1 30 ILE MG 3.751 . 3.751 3.259 3.248 3.268 . 0 0 "[ . 1 . 2]" 1
856 1 30 ILE MG 1 86 TYR QB 3.872 . 3.872 2.798 2.479 3.097 . 0 0 "[ . 1 . 2]" 1
857 1 29 ARG QB 1 30 ILE MG 3.839 . 3.839 2.713 2.265 3.845 0.006 14 0 "[ . 1 . 2]" 1
858 1 30 ILE HA 1 30 ILE MG 3.707 . 3.707 2.355 2.321 2.382 . 0 0 "[ . 1 . 2]" 1
859 1 30 ILE MG 1 82 SER HB2 4.807 . 4.807 2.817 2.036 4.251 . 0 0 "[ . 1 . 2]" 1
860 1 68 LEU HA 1 71 THR MG 3.916 . 3.916 1.966 1.898 2.062 . 0 0 "[ . 1 . 2]" 1
861 1 22 THR HA 1 22 THR MG 3.652 . 3.652 2.394 2.372 2.415 . 0 0 "[ . 1 . 2]" 1
862 1 22 THR MG 1 62 GLY HA2 4.246 . 4.246 2.864 2.375 3.620 . 0 0 "[ . 1 . 2]" 1
863 1 34 LEU MD2 1 79 PHE HA 3.718 . 3.718 3.034 2.431 3.788 0.070 20 0 "[ . 1 . 2]" 1
864 1 24 VAL HA 1 24 VAL MG2 3.333 . 3.333 2.497 2.456 2.543 . 0 0 "[ . 1 . 2]" 1
865 1 34 LEU HA 1 34 LEU MD2 3.421 . 3.421 2.137 2.062 2.247 . 0 0 "[ . 1 . 2]" 1
866 1 10 CYS HA 1 13 VAL MG2 3.927 . 3.927 2.607 2.087 3.345 . 0 0 "[ . 1 . 2]" 1
867 1 48 VAL HA 1 48 VAL MG2 3.487 . 3.487 2.418 2.345 2.530 . 0 0 "[ . 1 . 2]" 1
868 1 63 VAL HA 1 63 VAL MG1 3.597 . 3.597 2.494 2.432 2.549 . 0 0 "[ . 1 . 2]" 1
869 1 61 VAL HA 1 61 VAL MG1 3.641 . 3.641 2.412 2.355 2.491 . 0 0 "[ . 1 . 2]" 1
870 1 95 THR HA 1 95 THR MG 3.641 . 3.641 2.469 2.386 3.258 . 0 0 "[ . 1 . 2]" 1
871 1 83 LEU HA 1 83 LEU MD2 3.718 . 3.718 2.081 1.982 2.208 . 0 0 "[ . 1 . 2]" 1
872 1 24 VAL HA 1 24 VAL MG1 3.597 . 3.597 2.426 2.360 2.465 . 0 0 "[ . 1 . 2]" 1
873 1 21 LEU HA 1 21 LEU MD2 3.487 . 3.487 2.194 2.067 2.368 . 0 0 "[ . 1 . 2]" 1
874 1 68 LEU HA 1 68 LEU MD2 3.267 . 3.267 2.054 2.017 2.089 . 0 0 "[ . 1 . 2]" 1
875 1 49 LEU HA 1 49 LEU MD2 3.443 . 3.443 2.051 1.967 2.101 . 0 0 "[ . 1 . 2]" 1
876 1 80 LEU HA 1 80 LEU MD2 3.674 . 3.674 2.063 1.982 2.203 . 0 0 "[ . 1 . 2]" 1
877 1 83 LEU MD2 1 86 TYR QB 4.499 . 4.499 3.576 3.283 3.953 . 0 0 "[ . 1 . 2]" 1
878 1 77 VAL HA 1 77 VAL MG2 3.641 . 3.641 2.441 2.391 2.497 . 0 0 "[ . 1 . 2]" 1
879 1 31 THR HA 1 31 THR MG 3.586 . 3.586 2.265 2.249 2.281 . 0 0 "[ . 1 . 2]" 1
880 1 14 LEU HA 1 14 LEU MD2 3.784 . 3.784 2.053 1.949 2.156 . 0 0 "[ . 1 . 2]" 1
881 1 54 LEU HA 1 54 LEU MD2 3.916 . 3.916 2.490 1.976 4.094 0.178 11 0 "[ . 1 . 2]" 1
882 1 27 PRO HD3 1 61 VAL MG2 3.652 . 3.652 1.833 1.491 2.249 . 0 0 "[ . 1 . 2]" 1
883 1 63 VAL HA 1 63 VAL MG2 3.608 . 3.608 2.449 2.406 2.514 . 0 0 "[ . 1 . 2]" 1
884 1 67 ILE MG 1 68 LEU HA 4.400 . 4.400 3.542 3.374 3.724 . 0 0 "[ . 1 . 2]" 1
885 1 60 LYS HA 1 63 VAL MG2 4.235 . 4.235 2.657 2.274 3.514 . 0 0 "[ . 1 . 2]" 1
886 1 31 THR MG 1 45 GLU HA 4.730 . 4.730 3.123 2.259 4.793 0.063 3 0 "[ . 1 . 2]" 1
887 1 85 LEU HA 1 85 LEU MD1 4.400 . 4.400 3.927 3.879 3.960 . 0 0 "[ . 1 . 2]" 1
888 1 85 LEU HA 1 85 LEU MD2 3.630 . 3.630 2.100 2.031 2.190 . 0 0 "[ . 1 . 2]" 1
889 1 31 THR HB 1 49 LEU MD1 4.235 . 4.235 3.174 2.809 4.119 . 0 0 "[ . 1 . 2]" 1
890 1 30 ILE MG 1 83 LEU MD2 3.883 . 3.883 3.029 2.380 3.397 . 0 0 "[ . 1 . 2]" 1
891 1 22 THR MG 1 61 VAL HB 3.740 . 3.740 2.073 1.715 2.635 . 0 0 "[ . 1 . 2]" 1
892 1 68 LEU MD2 1 71 THR MG 3.487 . 3.487 2.565 2.416 2.712 . 0 0 "[ . 1 . 2]" 1
893 1 22 THR MG 1 61 VAL MG1 3.234 . 3.234 2.647 2.228 2.893 . 0 0 "[ . 1 . 2]" 1
894 1 27 PRO HG2 1 48 VAL MG1 3.355 . 3.355 2.190 1.879 2.678 . 0 0 "[ . 1 . 2]" 1
895 1 49 LEU HB3 1 49 LEU MD2 3.586 . 3.586 2.491 2.418 2.565 . 0 0 "[ . 1 . 2]" 1
896 1 49 LEU HB2 1 49 LEU MD2 3.597 . 3.597 3.258 3.246 3.267 . 0 0 "[ . 1 . 2]" 1
897 1 39 VAL QG 1 78 ALA MB 3.124 . 3.124 1.894 1.763 2.020 . 0 0 "[ . 1 . 2]" 1
898 1 34 LEU MD2 1 78 ALA MB 3.289 . 3.289 3.058 2.481 3.371 0.082 19 0 "[ . 1 . 2]" 1
899 1 21 LEU MD2 1 94 VAL MG1 3.289 . 3.289 2.099 1.686 2.489 . 0 0 "[ . 1 . 2]" 1
900 1 27 PRO HG3 1 61 VAL MG2 3.553 . 3.553 2.754 2.029 3.613 0.060 12 0 "[ . 1 . 2]" 1
901 1 21 LEU HB3 1 21 LEU MD2 3.498 . 3.498 2.576 2.513 2.667 . 0 0 "[ . 1 . 2]" 1
902 1 25 ILE MG 1 61 VAL MG2 4.609 . 4.609 3.936 3.232 4.627 0.018 16 0 "[ . 1 . 2]" 1
903 1 44 ASP HB2 1 67 ILE MG 4.444 . 4.444 3.401 2.701 4.305 . 0 0 "[ . 1 . 2]" 1
904 1 56 ILE MG 1 59 ARG QD 4.796 . 4.796 2.790 2.096 3.522 . 0 0 "[ . 1 . 2]" 1
905 1 25 ILE HB 1 83 LEU MD2 4.521 . 4.521 4.131 3.942 4.534 0.013 20 0 "[ . 1 . 2]" 1
906 1 31 THR MG 1 49 LEU HG 3.850 . 3.850 2.626 2.012 3.589 . 0 0 "[ . 1 . 2]" 1
907 1 39 VAL HB 1 71 THR MG 4.136 . 4.136 2.553 2.020 3.288 . 0 0 "[ . 1 . 2]" 1
908 1 21 LEU MD2 1 83 LEU MD1 4.763 . 4.763 2.968 2.557 3.369 . 0 0 "[ . 1 . 2]" 1
909 1 34 LEU HB2 1 40 LEU MD2 4.125 . 4.125 2.442 2.019 3.401 . 0 0 "[ . 1 . 2]" 1
910 1 30 ILE MG 1 33 TYR HB2 5.214 . 5.214 4.172 3.789 4.467 . 0 0 "[ . 1 . 2]" 1
911 1 17 PHE HA 1 21 LEU H 5.720 . 5.720 4.653 4.080 4.845 . 0 0 "[ . 1 . 2]" 1
912 1 65 LEU H 1 65 LEU MD2 4.609 . 4.609 3.228 2.995 3.516 . 0 0 "[ . 1 . 2]" 1
913 1 14 LEU MD1 1 76 TYR QD 4.664 . 4.664 2.834 2.352 3.849 . 0 0 "[ . 1 . 2]" 1
914 1 17 PHE HB3 1 94 VAL MG1 4.928 . 4.928 2.643 2.244 3.066 . 0 0 "[ . 1 . 2]" 1
915 1 18 ARG HA 1 65 LEU MD2 5.709 . 5.709 4.866 4.209 5.832 0.123 7 0 "[ . 1 . 2]" 1
916 1 48 VAL MG2 1 49 LEU H 4.224 . 4.224 3.892 3.716 4.030 . 0 0 "[ . 1 . 2]" 1
917 1 17 PHE HB3 1 20 THR MG 4.774 . 4.774 3.942 3.330 4.758 . 0 0 "[ . 1 . 2]" 1
918 1 21 LEU HB2 1 65 LEU MD2 5.346 . 5.346 3.941 3.304 4.711 . 0 0 "[ . 1 . 2]" 1
919 1 17 PHE HB2 1 21 LEU MD1 4.653 . 4.653 3.181 2.644 3.473 . 0 0 "[ . 1 . 2]" 1
920 1 22 THR MG 1 23 SER H 5.291 . 5.291 4.114 3.990 4.230 . 0 0 "[ . 1 . 2]" 1
921 1 22 THR HA 1 25 ILE HB 5.115 . 5.115 4.418 4.002 5.284 0.169 18 0 "[ . 1 . 2]" 1
922 1 26 ASP HB2 1 27 PRO HD2 5.643 . 5.643 3.997 2.413 4.696 . 0 0 "[ . 1 . 2]" 1
923 1 30 ILE HG12 1 83 LEU MD2 4.994 . 4.994 4.737 3.996 5.016 0.022 16 0 "[ . 1 . 2]" 1
924 1 30 ILE MD 1 82 SER H 5.456 . 5.456 5.187 4.867 5.490 0.034 5 0 "[ . 1 . 2]" 1
925 1 30 ILE MD 1 82 SER HG 5.159 . 5.159 2.797 1.999 3.465 . 0 0 "[ . 1 . 2]" 1
926 1 30 ILE MD 1 82 SER HA 6.050 . 6.050 5.034 4.502 5.522 . 0 0 "[ . 1 . 2]" 1
927 1 31 THR HA 1 34 LEU HB2 4.323 . 4.323 2.790 2.450 3.197 . 0 0 "[ . 1 . 2]" 1
928 1 28 SER HA 1 31 THR MG 3.894 . 3.894 2.266 1.629 2.895 . 0 0 "[ . 1 . 2]" 1
929 1 31 THR MG 1 32 PRO HD3 5.038 . 5.038 4.257 4.069 4.388 . 0 0 "[ . 1 . 2]" 1
930 1 34 LEU HB2 1 35 ARG H 5.280 . 5.280 2.628 2.478 2.824 . 0 0 "[ . 1 . 2]" 1
931 1 42 PRO HA 1 45 GLU HB3 4.807 . 4.807 2.381 2.021 2.968 . 0 0 "[ . 1 . 2]" 1
932 1 81 GLU HB3 1 82 SER HA 5.324 . 5.324 4.573 4.372 4.752 . 0 0 "[ . 1 . 2]" 1
933 1 31 THR HB 1 45 GLU HG3 5.280 . 5.280 2.980 1.842 5.104 . 0 0 "[ . 1 . 2]" 1
934 1 45 GLU HG2 1 49 LEU MD1 4.301 . 4.301 2.305 1.897 3.251 . 0 0 "[ . 1 . 2]" 1
935 1 49 LEU H 1 49 LEU MD2 4.675 . 4.675 3.381 3.148 3.666 . 0 0 "[ . 1 . 2]" 1
936 1 46 GLU HA 1 49 LEU MD1 4.092 . 4.092 3.384 2.242 3.967 . 0 0 "[ . 1 . 2]" 1
937 1 59 ARG HA 1 59 ARG QD 4.598 . 4.598 4.025 2.961 4.330 . 0 0 "[ . 1 . 2]" 1
938 1 27 PRO HD2 1 57 ARG QD 4.521 . 4.521 2.992 2.044 4.488 . 0 0 "[ . 1 . 2]" 1
939 1 58 LYS HA 1 61 VAL HB 5.390 . 5.390 3.454 2.851 4.013 . 0 0 "[ . 1 . 2]" 1
940 1 39 VAL QG 1 74 LYS HA 4.345 . 4.345 3.799 3.373 4.277 . 0 0 "[ . 1 . 2]" 1
941 1 74 LYS HA 1 77 VAL MG2 4.675 . 4.675 3.557 3.091 3.994 . 0 0 "[ . 1 . 2]" 1
942 1 27 PRO HG3 1 61 VAL HA 5.027 . 5.027 3.066 2.003 4.246 . 0 0 "[ . 1 . 2]" 1
943 1 27 PRO QB 1 61 VAL HA 5.357 . 5.357 3.643 2.271 4.735 . 0 0 "[ . 1 . 2]" 1
944 1 48 VAL MG1 1 49 LEU H 4.323 . 4.323 3.326 3.038 3.866 . 0 0 "[ . 1 . 2]" 1
945 1 65 LEU HA 1 65 LEU MD2 3.564 . 3.564 2.096 2.015 2.181 . 0 0 "[ . 1 . 2]" 1
946 1 67 ILE MG 1 69 GLN H 5.522 . 5.522 4.994 4.781 5.156 . 0 0 "[ . 1 . 2]" 1
947 1 68 LEU HA 1 71 THR HG1 6.050 . 6.050 5.456 4.919 5.934 . 0 0 "[ . 1 . 2]" 1
948 1 71 THR MG 1 75 GLY HA3 5.643 . 5.643 2.185 1.826 2.619 . 0 0 "[ . 1 . 2]" 1
949 1 76 TYR QD 1 77 VAL HA 5.335 . 5.335 3.782 3.043 4.118 . 0 0 "[ . 1 . 2]" 1
950 1 78 ALA MB 1 81 GLU H 5.852 . 5.852 4.725 4.526 4.898 . 0 0 "[ . 1 . 2]" 1
951 1 78 ALA MB 1 82 SER H 6.050 . 6.050 4.578 4.472 4.711 . 0 0 "[ . 1 . 2]" 1
952 1 34 LEU HA 1 78 ALA MB 4.422 . 4.422 3.600 3.007 4.016 . 0 0 "[ . 1 . 2]" 1
953 1 80 LEU HG 1 91 TYR QE 5.313 . 5.313 4.155 3.819 4.428 . 0 0 "[ . 1 . 2]" 1
954 1 80 LEU HG 1 91 TYR QD 6.050 . 6.050 5.507 5.053 6.096 0.046 7 0 "[ . 1 . 2]" 1
955 1 80 LEU MD2 1 91 TYR QE 4.631 . 4.631 2.054 1.691 2.680 . 0 0 "[ . 1 . 2]" 1
956 1 83 LEU HA 1 87 TYR QD 4.433 . 4.433 2.941 2.143 3.600 . 0 0 "[ . 1 . 2]" 1
957 1 83 LEU HB3 1 87 TYR HB2 5.071 . 5.071 3.169 2.666 3.508 . 0 0 "[ . 1 . 2]" 1
958 1 80 LEU HA 1 83 LEU HG 4.939 . 4.939 3.596 2.663 5.005 0.066 20 0 "[ . 1 . 2]" 1
959 1 25 ILE MD 1 25 ILE MG 3.289 . 3.289 2.052 1.983 2.098 . 0 0 "[ . 1 . 2]" 1
960 1 25 ILE MD 1 83 LEU MD2 3.234 . 3.234 2.019 1.705 2.427 . 0 0 "[ . 1 . 2]" 1
961 1 79 PHE QE 1 83 LEU MD1 4.961 . 4.961 2.592 2.220 2.807 . 0 0 "[ . 1 . 2]" 1
962 1 84 GLU HA 1 91 TYR H 6.017 . 6.017 5.024 4.768 5.339 . 0 0 "[ . 1 . 2]" 1
963 1 84 GLU HA 1 91 TYR QE 6.050 . 6.050 4.274 3.905 5.168 . 0 0 "[ . 1 . 2]" 1
964 1 83 LEU HB2 1 84 GLU HA 5.181 . 5.181 4.397 4.241 4.516 . 0 0 "[ . 1 . 2]" 1
965 1 84 GLU H 1 84 GLU HG3 5.258 . 5.258 4.508 4.437 4.609 . 0 0 "[ . 1 . 2]" 1
966 1 84 GLU H 1 84 GLU HG2 5.258 . 5.258 4.512 4.300 4.691 . 0 0 "[ . 1 . 2]" 1
967 1 84 GLU HG3 1 91 TYR QD 5.654 . 5.654 3.801 2.984 4.903 . 0 0 "[ . 1 . 2]" 1
968 1 84 GLU HG2 1 91 TYR QD 5.654 . 5.654 4.424 3.024 5.304 . 0 0 "[ . 1 . 2]" 1
969 1 85 LEU HB3 1 86 TYR QE 5.819 . 5.819 4.329 3.811 5.071 . 0 0 "[ . 1 . 2]" 1
970 1 33 TYR QE 1 85 LEU MD1 4.576 . 4.576 2.670 1.771 3.637 . 0 0 "[ . 1 . 2]" 1
971 1 86 TYR HA 1 86 TYR QE 5.291 . 5.291 4.654 4.479 4.791 . 0 0 "[ . 1 . 2]" 1
972 1 87 TYR HA 1 90 LEU H 5.346 . 5.346 4.212 4.042 4.425 . 0 0 "[ . 1 . 2]" 1
973 1 88 PRO HA 1 92 LYS H 5.236 . 5.236 4.099 3.794 4.265 . 0 0 "[ . 1 . 2]" 1
974 1 90 LEU HB3 1 91 TYR HA 4.686 . 4.686 4.351 4.205 4.513 . 0 0 "[ . 1 . 2]" 1
975 1 14 LEU MD2 1 94 VAL MG2 3.564 . 3.564 2.432 2.131 2.906 . 0 0 "[ . 1 . 2]" 1
976 1 94 VAL H 1 95 THR MG 5.060 . 5.060 4.194 3.915 4.343 . 0 0 "[ . 1 . 2]" 1
977 1 92 LYS HA 1 95 THR MG 4.565 . 4.565 4.143 3.256 4.612 0.047 14 0 "[ . 1 . 2]" 1
978 1 91 TYR HB3 1 95 THR MG 5.764 . 5.764 5.175 4.501 5.712 . 0 0 "[ . 1 . 2]" 1
979 1 55 VAL HA 1 56 ILE HB 6.050 . 6.050 5.838 5.601 6.094 0.044 20 0 "[ . 1 . 2]" 1
980 1 34 LEU HG 1 79 PHE QD 5.390 . 5.390 4.942 4.415 5.403 0.013 15 0 "[ . 1 . 2]" 1
981 1 34 LEU HG 1 79 PHE QE 5.984 . 5.984 5.707 5.390 5.885 . 0 0 "[ . 1 . 2]" 1
982 1 22 THR HB 1 61 VAL HB 4.686 . 4.686 3.090 2.750 3.762 . 0 0 "[ . 1 . 2]" 1
983 1 23 SER HB2 1 24 VAL MG2 4.994 . 4.994 3.683 2.544 4.480 . 0 0 "[ . 1 . 2]" 1
984 1 22 THR HA 1 61 VAL HB 3.696 . 3.696 2.279 1.918 3.059 . 0 0 "[ . 1 . 2]" 1
985 1 25 ILE MG 1 27 PRO HA 5.104 . 5.104 3.703 3.102 4.404 . 0 0 "[ . 1 . 2]" 1
986 1 18 ARG HA 1 22 THR MG 4.697 . 4.697 3.582 3.302 3.935 . 0 0 "[ . 1 . 2]" 1
987 1 39 VAL HA 1 71 THR MG 4.697 . 4.697 3.140 2.450 3.924 . 0 0 "[ . 1 . 2]" 1
988 1 45 GLU HA 1 49 LEU MD1 4.664 . 4.664 4.359 3.855 4.706 0.042 3 0 "[ . 1 . 2]" 1
989 1 34 LEU HA 1 37 CYS HB2 5.159 . 5.159 3.734 2.625 4.737 . 0 0 "[ . 1 . 2]" 1
990 1 92 LYS HA 1 93 LYS HA 5.544 . 5.544 4.850 4.795 4.913 . 0 0 "[ . 1 . 2]" 1
991 1 83 LEU HA 1 86 TYR HA 5.687 . 5.687 5.515 5.313 5.736 0.049 18 0 "[ . 1 . 2]" 1
992 1 29 ARG HA 1 29 ARG HD2 5.115 . 5.115 3.103 2.003 4.478 . 0 0 "[ . 1 . 2]" 1
993 1 29 ARG HA 1 29 ARG HD3 5.115 . 5.115 2.880 2.147 5.457 0.342 14 0 "[ . 1 . 2]" 1
994 1 38 LYS HA 1 38 LYS HD2 4.521 . 4.521 2.898 2.075 4.214 . 0 0 "[ . 1 . 2]" 1
995 1 97 LYS HA 1 97 LYS QG 3.927 . 3.927 3.022 2.456 3.612 . 0 0 "[ . 1 . 2]" 1
996 1 83 LEU HA 1 83 LEU HG 4.103 . 4.103 3.344 3.173 3.570 . 0 0 "[ . 1 . 2]" 1
997 1 89 GLN HA 1 92 LYS QB 4.004 . 4.004 2.858 2.440 3.491 . 0 0 "[ . 1 . 2]" 1
998 1 73 HIS HA 1 76 TYR HB2 4.884 . 4.884 4.802 3.655 5.120 0.236 6 0 "[ . 1 . 2]" 1
999 1 35 ARG HA 1 38 LYS HA 4.554 . 4.554 3.387 2.874 3.866 . 0 0 "[ . 1 . 2]" 1
1000 1 49 LEU HA 1 50 SER HA 5.434 . 5.434 4.842 4.725 4.894 . 0 0 "[ . 1 . 2]" 1
1001 1 44 ASP HA 1 67 ILE MG 4.939 . 4.939 4.647 4.146 5.013 0.074 15 0 "[ . 1 . 2]" 1
1002 1 39 VAL HA 1 40 LEU HA 5.159 . 5.159 4.658 4.555 4.731 . 0 0 "[ . 1 . 2]" 1
1003 1 40 LEU HA 1 40 LEU MD1 3.751 . 3.751 2.115 1.988 2.203 . 0 0 "[ . 1 . 2]" 1
1004 1 26 ASP HA 1 57 ARG QD 4.488 . 4.488 3.412 1.716 4.521 0.033 11 0 "[ . 1 . 2]" 1
1005 1 26 ASP HA 1 27 PRO HG3 4.884 . 4.884 4.436 4.035 4.622 . 0 0 "[ . 1 . 2]" 1
1006 1 68 LEU MD1 1 79 PHE HB3 5.489 . 5.489 4.159 3.341 5.258 . 0 0 "[ . 1 . 2]" 1
1007 1 87 TYR HB2 1 90 LEU HB2 4.653 . 4.653 4.387 3.887 4.706 0.053 19 0 "[ . 1 . 2]" 1
1008 1 34 LEU HB2 1 39 VAL QG 4.730 . 4.730 3.832 3.595 4.198 . 0 0 "[ . 1 . 2]" 1
1009 1 90 LEU HB3 1 94 VAL MG2 4.697 . 4.697 4.714 4.600 4.791 0.094 2 0 "[ . 1 . 2]" 1
1010 1 25 ILE HB 1 61 VAL MG2 5.599 . 5.599 4.145 3.614 5.005 . 0 0 "[ . 1 . 2]" 1
1011 1 45 GLU HG3 1 49 LEU MD1 4.301 . 4.301 2.687 2.033 3.171 . 0 0 "[ . 1 . 2]" 1
1012 1 33 TYR QE 1 81 GLU HB2 4.609 . 4.609 2.799 2.084 3.781 . 0 0 "[ . 1 . 2]" 1
1013 1 27 PRO HG2 1 28 SER QB 4.862 . 4.862 4.318 3.389 5.062 0.200 16 0 "[ . 1 . 2]" 1
1014 1 27 PRO HG2 1 61 VAL MG2 4.631 . 4.631 3.579 2.609 4.166 . 0 0 "[ . 1 . 2]" 1
1015 1 25 ILE HG13 1 83 LEU MD2 5.203 . 5.203 3.866 3.581 4.447 . 0 0 "[ . 1 . 2]" 1
1016 1 29 ARG HG3 1 30 ILE MG 3.949 . 3.949 2.866 2.237 3.421 . 0 0 "[ . 1 . 2]" 1
1017 1 34 LEU HA 1 39 VAL QG 3.432 . 3.432 2.422 2.223 2.658 . 0 0 "[ . 1 . 2]" 1
1018 1 19 VAL HA 1 19 VAL MG1 3.751 . 3.751 2.860 2.363 3.282 . 0 0 "[ . 1 . 2]" 1
1019 1 20 THR HA 1 20 THR MG 3.597 . 3.597 2.438 2.377 2.566 . 0 0 "[ . 1 . 2]" 1
1020 1 20 THR MG 1 90 LEU HG 3.795 . 3.795 3.803 3.494 3.947 0.152 15 0 "[ . 1 . 2]" 1
1021 1 20 THR MG 1 90 LEU MD1 3.454 . 3.454 1.910 1.747 2.024 . 0 0 "[ . 1 . 2]" 1
1022 1 20 THR MG 1 90 LEU MD2 3.883 . 3.883 2.739 2.060 3.578 . 0 0 "[ . 1 . 2]" 1
1023 1 27 PRO HG3 1 48 VAL MG1 3.751 . 3.751 3.191 2.443 3.884 0.133 8 0 "[ . 1 . 2]" 1
1024 1 77 VAL MG2 1 80 LEU HB2 5.027 . 5.027 4.846 4.522 5.055 0.028 15 0 "[ . 1 . 2]" 1
1025 1 64 LEU MD1 1 67 ILE HB 3.784 . 3.784 2.732 2.024 3.483 . 0 0 "[ . 1 . 2]" 1
1026 1 64 LEU MD1 1 68 LEU HG 3.971 . 3.971 2.588 2.024 3.152 . 0 0 "[ . 1 . 2]" 1
1027 1 21 LEU MD2 1 25 ILE HB 4.400 . 4.400 4.143 3.093 4.454 0.054 4 0 "[ . 1 . 2]" 1
1028 1 21 LEU MD2 1 94 VAL HB 4.752 . 4.752 3.291 2.599 4.083 . 0 0 "[ . 1 . 2]" 1
1029 1 68 LEU HB3 1 68 LEU MD2 3.564 . 3.564 2.469 2.405 2.515 . 0 0 "[ . 1 . 2]" 1
1030 1 22 THR HA 1 61 VAL MG1 3.476 . 3.476 2.183 1.873 2.821 . 0 0 "[ . 1 . 2]" 1
1031 1 22 THR HB 1 61 VAL MG1 4.873 . 4.873 4.070 3.617 4.523 . 0 0 "[ . 1 . 2]" 1
1032 1 20 THR HB 1 21 LEU HG 5.093 . 5.093 3.704 3.494 3.993 . 0 0 "[ . 1 . 2]" 1
1033 1 17 PHE HB2 1 20 THR HB 5.423 . 5.423 3.979 2.952 4.694 . 0 0 "[ . 1 . 2]" 1
1034 1 31 THR HA 1 34 LEU HG 5.192 . 5.192 3.488 3.069 4.010 . 0 0 "[ . 1 . 2]" 1
1035 1 17 PHE QD 1 20 THR HB 5.379 . 5.379 4.033 3.298 4.840 . 0 0 "[ . 1 . 2]" 1
1036 1 91 TYR HA 1 91 TYR QE 6.050 . 6.050 4.706 4.324 4.819 . 0 0 "[ . 1 . 2]" 1
1037 1 73 HIS HA 1 76 TYR QD 5.940 . 5.940 5.158 4.047 5.785 . 0 0 "[ . 1 . 2]" 1
1038 1 11 TRP HA 1 76 TYR QD 5.049 . 5.049 3.727 2.813 4.916 . 0 0 "[ . 1 . 2]" 1
1039 1 11 TRP HA 1 76 TYR QE 5.159 . 5.159 3.578 2.480 5.222 0.063 20 0 "[ . 1 . 2]" 1
1040 1 33 TYR QE 1 78 ALA HA 4.785 . 4.785 3.200 2.538 3.796 . 0 0 "[ . 1 . 2]" 1
1041 1 83 LEU HB3 1 91 TYR QD 5.126 . 5.126 3.285 2.894 3.838 . 0 0 "[ . 1 . 2]" 1
1042 1 80 LEU HB3 1 91 TYR QE 4.917 . 4.917 2.043 1.645 3.567 . 0 0 "[ . 1 . 2]" 1
1043 1 80 LEU HB2 1 91 TYR QE 5.511 . 5.511 3.673 3.380 4.532 . 0 0 "[ . 1 . 2]" 1
1044 1 33 TYR HB2 1 86 TYR QE 5.082 . 5.082 3.000 2.509 3.488 . 0 0 "[ . 1 . 2]" 1
1045 1 11 TRP HH2 1 79 PHE HB2 5.357 . 5.357 3.157 2.455 4.420 . 0 0 "[ . 1 . 2]" 1
1046 1 33 TYR QE 1 81 GLU HB3 4.928 . 4.928 3.474 2.424 4.453 . 0 0 "[ . 1 . 2]" 1
1047 1 34 LEU MD1 1 79 PHE QE 4.983 . 4.983 3.817 3.362 4.201 . 0 0 "[ . 1 . 2]" 1
1048 1 14 LEU MD1 1 79 PHE QE 5.027 . 5.027 2.996 2.186 4.676 . 0 0 "[ . 1 . 2]" 1
1049 1 80 LEU MD1 1 91 TYR QD 6.050 . 6.050 4.842 4.223 6.099 0.049 20 0 "[ . 1 . 2]" 1
1050 1 87 TYR QD 1 90 LEU MD2 4.543 . 4.543 3.601 2.734 4.165 . 0 0 "[ . 1 . 2]" 1
1051 1 11 TRP HZ2 1 68 LEU MD2 4.499 . 4.499 4.284 3.707 4.536 0.037 19 0 "[ . 1 . 2]" 1
1052 1 25 ILE MG 1 79 PHE QE 4.950 . 4.950 2.912 2.527 3.944 . 0 0 "[ . 1 . 2]" 1
1053 1 25 ILE MG 1 87 TYR QD 5.643 . 5.643 3.325 2.791 3.816 . 0 0 "[ . 1 . 2]" 1
1054 1 67 ILE HA 1 67 ILE MD 4.455 . 4.455 3.925 3.834 3.967 . 0 0 "[ . 1 . 2]" 1
1055 1 25 ILE MG 1 27 PRO HD3 4.686 . 4.686 4.067 2.644 4.758 0.072 13 0 "[ . 1 . 2]" 1
1056 1 30 ILE MG 1 82 SER HA 4.356 . 4.356 3.903 3.317 4.333 . 0 0 "[ . 1 . 2]" 1
1057 1 17 PHE QD 1 94 VAL MG1 4.554 . 4.554 2.995 2.466 3.430 . 0 0 "[ . 1 . 2]" 1
1058 1 17 PHE QD 1 94 VAL MG2 4.972 . 4.972 4.253 2.094 4.999 0.027 16 0 "[ . 1 . 2]" 1
1059 1 13 VAL MG1 1 17 PHE QD 4.642 . 4.642 3.837 2.766 5.107 0.465 18 0 "[ . 1 . 2]" 1
1060 1 70 ARG HB2 1 71 THR HB 5.170 . 5.170 4.388 4.034 5.050 . 0 0 "[ . 1 . 2]" 1
1061 1 19 VAL HB 1 20 THR HA 6.050 . 6.050 5.172 4.299 5.919 . 0 0 "[ . 1 . 2]" 1
1062 1 20 THR HA 1 21 LEU HG 6.050 . 6.050 5.727 5.604 5.879 . 0 0 "[ . 1 . 2]" 1
1063 1 91 TYR HA 1 94 VAL HB 5.478 . 5.478 5.209 4.678 5.533 0.055 12 0 "[ . 1 . 2]" 1
1064 1 11 TRP HA 1 14 LEU HB2 4.609 . 4.609 2.810 1.857 3.387 . 0 0 "[ . 1 . 2]" 1
1065 1 87 TYR HA 1 88 PRO QG 4.697 . 4.697 4.169 3.979 4.364 . 0 0 "[ . 1 . 2]" 1
1066 1 11 TRP HA 1 14 LEU MD1 4.620 . 4.620 3.313 2.892 3.921 . 0 0 "[ . 1 . 2]" 1
1067 1 51 ASP HA 1 52 PRO HG2 4.763 . 4.763 4.583 4.113 4.870 0.107 2 0 "[ . 1 . 2]" 1
1068 1 27 PRO HD2 1 48 VAL MG1 5.379 . 5.379 3.513 2.048 4.482 . 0 0 "[ . 1 . 2]" 1
1069 1 27 PRO HD2 1 61 VAL MG1 6.050 . 6.050 4.664 3.379 5.761 . 0 0 "[ . 1 . 2]" 1
1070 1 75 GLY HA2 1 78 ALA MB 4.983 . 4.983 2.793 2.374 3.152 . 0 0 "[ . 1 . 2]" 1
1071 1 87 TYR HA 1 90 LEU HB2 5.379 . 5.379 4.975 4.548 5.379 . 0 0 "[ . 1 . 2]" 1
1072 1 84 GLU HA 1 88 PRO HB3 5.148 . 5.148 3.910 2.977 4.758 . 0 0 "[ . 1 . 2]" 1
1073 1 39 VAL QG 1 74 LYS QE 4.466 . 4.466 3.027 1.940 4.743 0.277 5 0 "[ . 1 . 2]" 1
1074 1 51 ASP HB2 1 52 PRO HD2 6.050 . 6.050 4.807 4.249 5.484 . 0 0 "[ . 1 . 2]" 1
1075 1 51 ASP HB3 1 52 PRO HD2 6.050 . 6.050 4.572 3.434 5.100 . 0 0 "[ . 1 . 2]" 1
1076 1 51 ASP HB3 1 52 PRO HD3 6.050 . 6.050 4.870 4.418 5.294 . 0 0 "[ . 1 . 2]" 1
1077 1 65 LEU HA 1 68 LEU HB2 5.192 . 5.192 2.696 2.335 3.222 . 0 0 "[ . 1 . 2]" 1
1078 1 46 GLU HA 1 49 LEU HB3 5.236 . 5.236 4.232 3.518 4.759 . 0 0 "[ . 1 . 2]" 1
1079 1 49 LEU HB2 1 50 SER HB2 6.050 . 6.050 5.086 4.621 5.420 . 0 0 "[ . 1 . 2]" 1
1080 1 49 LEU HB2 1 50 SER HB3 6.050 . 6.050 5.771 5.287 6.044 . 0 0 "[ . 1 . 2]" 1
1081 1 77 VAL MG1 1 80 LEU HB2 5.181 . 5.181 4.045 3.525 4.464 . 0 0 "[ . 1 . 2]" 1
1082 1 17 PHE HB2 1 94 VAL MG2 5.929 . 5.929 4.491 3.385 5.458 . 0 0 "[ . 1 . 2]" 1
1083 1 29 ARG HG3 1 86 TYR QB 5.236 . 5.236 3.360 2.761 4.216 . 0 0 "[ . 1 . 2]" 1
1084 1 25 ILE HG12 1 86 TYR QB 6.050 . 6.050 5.637 5.274 6.095 0.045 7 0 "[ . 1 . 2]" 1
1085 1 85 LEU HB3 1 86 TYR QB 6.050 . 6.050 5.100 4.910 5.347 . 0 0 "[ . 1 . 2]" 1
1086 1 85 LEU MD1 1 86 TYR QB 6.050 . 6.050 5.515 5.343 5.769 . 0 0 "[ . 1 . 2]" 1
1087 1 79 PHE HB2 1 83 LEU MD1 5.588 . 5.588 5.370 4.925 5.638 0.050 19 0 "[ . 1 . 2]" 1
1088 1 85 LEU HB3 1 86 TYR QD 5.764 . 5.764 3.896 3.379 4.643 . 0 0 "[ . 1 . 2]" 1
1089 1 85 LEU HB2 1 86 TYR QD 5.841 . 5.841 2.630 2.121 3.301 . 0 0 "[ . 1 . 2]" 1
1090 1 83 LEU MD2 1 91 TYR HB2 5.687 . 5.687 4.475 3.927 4.864 . 0 0 "[ . 1 . 2]" 1
1091 1 91 TYR HB2 1 94 VAL MG2 5.313 . 5.313 4.236 3.826 4.507 . 0 0 "[ . 1 . 2]" 1
1092 1 83 LEU HB2 1 91 TYR HB3 5.720 . 5.720 4.421 3.802 4.915 . 0 0 "[ . 1 . 2]" 1
1093 1 88 PRO HB3 1 91 TYR HB3 6.050 . 6.050 4.745 4.244 5.651 . 0 0 "[ . 1 . 2]" 1
1094 1 90 LEU HB3 1 91 TYR HB3 6.050 . 6.050 4.940 4.656 5.268 . 0 0 "[ . 1 . 2]" 1
1095 1 30 ILE HB 1 33 TYR HA 5.676 . 5.676 5.755 5.420 5.897 0.221 4 0 "[ . 1 . 2]" 1
1096 1 47 GLN HG3 1 48 VAL MG2 4.928 . 4.928 4.416 2.257 4.994 0.066 18 0 "[ . 1 . 2]" 1
1097 1 47 GLN QB 1 48 VAL MG2 4.246 . 4.246 3.134 2.649 4.039 . 0 0 "[ . 1 . 2]" 1
1098 1 21 LEU MD1 1 65 LEU MD2 4.642 . 4.642 2.621 2.063 3.511 . 0 0 "[ . 1 . 2]" 1
1099 1 21 LEU MD1 1 94 VAL MG1 5.071 . 5.071 3.945 3.377 4.382 . 0 0 "[ . 1 . 2]" 1
1100 1 21 LEU HB2 1 65 LEU MD1 4.708 . 4.708 2.877 2.227 3.433 . 0 0 "[ . 1 . 2]" 1
1101 1 32 PRO HG2 1 33 TYR HA 4.708 . 4.708 4.575 4.337 4.728 0.020 14 0 "[ . 1 . 2]" 1
1102 1 40 LEU HA 1 40 LEU MD2 4.422 . 4.422 3.942 3.913 3.975 . 0 0 "[ . 1 . 2]" 1
1103 1 14 LEU MD1 1 94 VAL MG2 3.894 . 3.894 3.739 3.305 3.947 0.053 18 0 "[ . 1 . 2]" 1
1104 1 61 VAL HA 1 64 LEU MD2 4.708 . 4.708 3.562 2.798 4.737 0.029 7 0 "[ . 1 . 2]" 1
1105 1 40 LEU MD2 1 44 ASP HB3 4.818 . 4.818 4.343 3.373 4.914 0.096 16 0 "[ . 1 . 2]" 1
1106 1 40 LEU MD2 1 44 ASP HB2 4.818 . 4.818 4.144 3.116 4.910 0.092 9 0 "[ . 1 . 2]" 1
1107 1 25 ILE HB 1 83 LEU MD1 4.642 . 4.642 4.811 4.722 4.970 0.328 19 0 "[ . 1 . 2]" 1
1108 1 51 ASP HB2 1 54 LEU MD1 4.983 . 4.983 3.624 1.713 5.346 0.363 7 0 "[ . 1 . 2]" 1
1109 1 58 LYS HA 1 61 VAL MG2 4.488 . 4.488 2.437 1.919 3.580 . 0 0 "[ . 1 . 2]" 1
1110 1 87 TYR HB2 1 90 LEU MD2 4.323 . 4.323 3.397 2.498 4.132 . 0 0 "[ . 1 . 2]" 1
1111 1 21 LEU HA 1 90 LEU MD2 4.136 . 4.136 3.031 2.430 3.728 . 0 0 "[ . 1 . 2]" 1
1112 1 90 LEU HA 1 90 LEU MD1 3.652 . 3.652 2.086 1.981 2.296 . 0 0 "[ . 1 . 2]" 1
1113 1 87 TYR HB3 1 90 LEU MD2 4.400 . 4.400 3.044 2.376 3.622 . 0 0 "[ . 1 . 2]" 1
1114 1 22 THR MG 1 62 GLY HA3 4.246 . 4.246 2.994 2.579 3.746 . 0 0 "[ . 1 . 2]" 1
1115 1 56 ILE HA 1 56 ILE MD 4.664 . 4.664 3.048 2.077 3.982 . 0 0 "[ . 1 . 2]" 1
1116 1 94 VAL HB 1 95 THR MG 4.444 . 4.444 4.288 3.926 4.591 0.147 13 0 "[ . 1 . 2]" 1
1117 1 13 VAL MG1 1 14 LEU HA 5.005 . 5.005 3.445 2.845 3.733 . 0 0 "[ . 1 . 2]" 1
1118 1 14 LEU HA 1 94 VAL MG1 5.489 . 5.489 4.743 3.935 5.620 0.131 19 0 "[ . 1 . 2]" 1
1119 1 14 LEU HA 1 94 VAL MG2 5.797 . 5.797 4.568 3.838 5.299 . 0 0 "[ . 1 . 2]" 1
1120 1 14 LEU HA 1 17 PHE HB3 6.050 . 6.050 4.674 3.718 5.281 . 0 0 "[ . 1 . 2]" 1
1121 1 14 LEU MD1 1 17 PHE QD 5.874 . 5.874 5.256 3.483 5.904 0.030 10 0 "[ . 1 . 2]" 1
1122 1 17 PHE HA 1 18 ARG HA 6.050 . 6.050 4.947 4.870 5.028 . 0 0 "[ . 1 . 2]" 1
1123 1 17 PHE HA 1 21 LEU HG 5.401 . 5.401 4.491 4.221 4.687 . 0 0 "[ . 1 . 2]" 1
1124 1 17 PHE HA 1 20 THR MG 6.028 . 6.028 4.880 4.048 5.400 . 0 0 "[ . 1 . 2]" 1
1125 1 17 PHE HB3 1 20 THR HB 4.994 . 4.994 2.899 2.193 4.226 . 0 0 "[ . 1 . 2]" 1
1126 1 19 VAL HA 1 22 THR MG 5.093 . 5.093 3.775 3.263 4.166 . 0 0 "[ . 1 . 2]" 1
1127 1 20 THR HB 1 94 VAL MG1 5.742 . 5.742 3.575 3.074 4.696 . 0 0 "[ . 1 . 2]" 1
1128 1 20 THR HB 1 90 LEU MD1 5.819 . 5.819 3.668 3.009 4.285 . 0 0 "[ . 1 . 2]" 1
1129 1 20 THR HB 1 90 LEU MD2 6.050 . 6.050 4.490 3.552 5.554 . 0 0 "[ . 1 . 2]" 1
1130 1 21 LEU HB3 1 65 LEU MD2 6.050 . 6.050 3.425 2.692 4.519 . 0 0 "[ . 1 . 2]" 1
1131 1 21 LEU HB3 1 83 LEU MD1 6.050 . 6.050 4.660 4.141 5.056 . 0 0 "[ . 1 . 2]" 1
1132 1 21 LEU MD2 1 94 VAL MG2 3.806 . 3.806 2.884 1.869 3.714 . 0 0 "[ . 1 . 2]" 1
1133 1 15 GLU HA 1 21 LEU MD1 5.544 . 5.544 3.932 2.544 5.948 0.404 19 0 "[ . 1 . 2]" 1
1134 1 24 VAL MG1 1 87 TYR QD 4.554 . 4.554 3.026 2.311 4.080 . 0 0 "[ . 1 . 2]" 1
1135 1 26 ASP HA 1 61 VAL HB 5.929 . 5.929 5.690 4.594 6.153 0.224 6 0 "[ . 1 . 2]" 1
1136 1 26 ASP HB3 1 27 PRO HD2 5.643 . 5.643 3.322 2.501 4.303 . 0 0 "[ . 1 . 2]" 1
1137 1 29 ARG QB 1 30 ILE HA 5.423 . 5.423 4.355 4.074 4.650 . 0 0 "[ . 1 . 2]" 1
1138 1 27 PRO QB 1 30 ILE HG12 5.610 . 5.610 4.447 3.734 4.988 . 0 0 "[ . 1 . 2]" 1
1139 1 25 ILE MG 1 30 ILE HG12 5.280 . 5.280 3.646 3.294 3.914 . 0 0 "[ . 1 . 2]" 1
1140 1 30 ILE MG 1 82 SER HB3 4.807 . 4.807 3.554 1.848 3.994 . 0 0 "[ . 1 . 2]" 1
1141 1 25 ILE HG12 1 30 ILE MG 6.050 . 6.050 5.462 5.054 5.836 . 0 0 "[ . 1 . 2]" 1
1142 1 30 ILE MG 1 85 LEU MD1 6.050 . 6.050 5.390 4.861 5.872 . 0 0 "[ . 1 . 2]" 1
1143 1 30 ILE MG 1 33 TYR HB3 5.214 . 5.214 3.744 3.629 3.909 . 0 0 "[ . 1 . 2]" 1
1144 1 33 TYR QD 1 34 LEU HA 5.412 . 5.412 3.453 2.922 4.214 . 0 0 "[ . 1 . 2]" 1
1145 1 37 CYS HB2 1 39 VAL QG 4.378 . 4.378 3.139 2.172 3.820 . 0 0 "[ . 1 . 2]" 1
1146 1 40 LEU HG 1 41 ASN HA 5.786 . 5.786 4.530 4.259 4.773 . 0 0 "[ . 1 . 2]" 1
1147 1 42 PRO HA 1 45 GLU HB2 4.807 . 4.807 3.283 2.831 3.990 . 0 0 "[ . 1 . 2]" 1
1148 1 31 THR HB 1 45 GLU HG2 5.280 . 5.280 3.990 3.393 5.215 . 0 0 "[ . 1 . 2]" 1
1149 1 51 ASP HA 1 52 PRO HB3 6.050 . 6.050 5.249 4.926 5.624 . 0 0 "[ . 1 . 2]" 1
1150 1 52 PRO HB2 1 53 ASN HA 5.511 . 5.511 4.585 4.010 5.837 0.326 18 0 "[ . 1 . 2]" 1
1151 1 52 PRO HG2 1 53 ASN HA 6.050 . 6.050 4.831 4.012 6.129 0.079 15 0 "[ . 1 . 2]" 1
1152 1 53 ASN HA 1 54 LEU MD2 6.050 . 6.050 4.767 3.272 5.744 . 0 0 "[ . 1 . 2]" 1
1153 1 56 ILE MD 1 59 ARG QD 5.434 . 5.434 4.215 2.651 5.511 0.077 14 0 "[ . 1 . 2]" 1
1154 1 27 PRO HG2 1 61 VAL HA 5.687 . 5.687 4.418 3.032 5.741 0.054 13 0 "[ . 1 . 2]" 1
1155 1 26 ASP HA 1 61 VAL MG2 4.917 . 4.917 2.854 1.834 3.404 . 0 0 "[ . 1 . 2]" 1
1156 1 61 VAL HA 1 64 LEU HG 5.621 . 5.621 4.461 3.438 5.111 . 0 0 "[ . 1 . 2]" 1
1157 1 62 GLY HA2 1 65 LEU MD1 4.719 . 4.719 2.395 2.075 2.815 . 0 0 "[ . 1 . 2]" 1
1158 1 70 ARG HB3 1 71 THR HB 5.170 . 5.170 4.832 4.387 5.154 . 0 0 "[ . 1 . 2]" 1
1159 1 76 TYR QD 1 77 VAL MG2 4.488 . 4.488 3.010 2.213 3.446 . 0 0 "[ . 1 . 2]" 1
1160 1 76 TYR HA 1 79 PHE HB2 4.785 . 4.785 3.437 2.837 4.052 . 0 0 "[ . 1 . 2]" 1
1161 1 33 TYR QE 1 78 ALA MB 5.115 . 5.115 3.224 2.130 4.053 . 0 0 "[ . 1 . 2]" 1
1162 1 78 ALA MB 1 79 PHE HA 5.126 . 5.126 3.915 3.748 3.996 . 0 0 "[ . 1 . 2]" 1
1163 1 79 PHE HA 1 83 LEU MD2 5.500 . 5.500 4.504 4.003 4.867 . 0 0 "[ . 1 . 2]" 1
1164 1 80 LEU HA 1 91 TYR QD 5.313 . 5.313 3.036 2.721 3.689 . 0 0 "[ . 1 . 2]" 1
1165 1 80 LEU HA 1 91 TYR QE 5.335 . 5.335 2.733 1.949 3.311 . 0 0 "[ . 1 . 2]" 1
1166 1 30 ILE HB 1 82 SER HA 5.841 . 5.841 4.826 4.240 5.297 . 0 0 "[ . 1 . 2]" 1
1167 1 84 GLU HB2 1 91 TYR QD 5.610 . 5.610 3.598 3.031 3.969 . 0 0 "[ . 1 . 2]" 1
1168 1 85 LEU HB2 1 86 TYR QE 5.819 . 5.819 3.558 3.172 4.044 . 0 0 "[ . 1 . 2]" 1
1169 1 29 ARG QB 1 86 TYR QB 5.401 . 5.401 4.385 3.788 5.242 . 0 0 "[ . 1 . 2]" 1
1170 1 87 TYR HA 1 87 TYR QE 5.511 . 5.511 4.697 4.533 4.869 . 0 0 "[ . 1 . 2]" 1
1171 1 83 LEU HA 1 87 TYR HA 5.907 . 5.907 5.208 4.967 5.449 . 0 0 "[ . 1 . 2]" 1
1172 1 83 LEU MD2 1 87 TYR HA 5.863 . 5.863 5.416 5.052 5.689 . 0 0 "[ . 1 . 2]" 1
1173 1 87 TYR HA 1 90 LEU MD2 6.017 . 6.017 5.133 4.433 5.719 . 0 0 "[ . 1 . 2]" 1
1174 1 88 PRO HA 1 91 TYR QD 5.379 . 5.379 3.610 3.020 4.754 . 0 0 "[ . 1 . 2]" 1
1175 1 87 TYR QD 1 90 LEU HB2 5.467 . 5.467 4.359 3.950 4.873 . 0 0 "[ . 1 . 2]" 1
1176 1 87 TYR QD 1 90 LEU HB3 5.423 . 5.423 4.188 3.848 4.375 . 0 0 "[ . 1 . 2]" 1
1177 1 25 ILE HA 1 90 LEU MD2 4.807 . 4.807 4.128 3.459 4.485 . 0 0 "[ . 1 . 2]" 1
1178 1 83 LEU HB3 1 91 TYR HA 4.961 . 4.961 3.386 2.990 4.223 . 0 0 "[ . 1 . 2]" 1
1179 1 92 LYS HA 1 92 LYS HG3 4.213 . 4.213 2.924 2.489 3.738 . 0 0 "[ . 1 . 2]" 1
1180 1 21 LEU MD2 1 94 VAL HA 6.050 . 6.050 4.937 4.417 5.574 . 0 0 "[ . 1 . 2]" 1
1181 1 17 PHE QD 1 94 VAL HB 6.039 . 6.039 3.218 2.132 3.958 . 0 0 "[ . 1 . 2]" 1
1182 1 91 TYR HA 1 94 VAL MG1 5.379 . 5.379 4.003 3.482 4.313 . 0 0 "[ . 1 . 2]" 1
1183 1 22 THR HA 1 61 VAL HA 6.006 . 6.006 4.978 4.767 5.522 . 0 0 "[ . 1 . 2]" 1
1184 1 61 VAL HA 1 64 LEU HA 6.050 . 6.050 5.118 4.645 5.898 . 0 0 "[ . 1 . 2]" 1
1185 1 33 TYR QD 1 34 LEU HG 5.786 . 5.786 3.903 3.060 4.453 . 0 0 "[ . 1 . 2]" 1
1186 1 30 ILE MD 1 34 LEU HG 4.455 . 4.455 3.180 2.917 3.475 . 0 0 "[ . 1 . 2]" 1
1187 1 7 ASP QB 1 72 GLY QA 4.455 . 4.455 3.005 1.937 4.101 . 0 0 "[ . 1 . 2]" 1
1188 1 8 ASP H 1 8 ASP QB 3.575 . 3.575 2.449 2.205 2.654 . 0 0 "[ . 1 . 2]" 1
1189 1 9 GLU H 1 9 GLU QB 3.685 . 3.685 2.340 2.142 2.667 . 0 0 "[ . 1 . 2]" 1
1190 1 9 GLU H 1 9 GLU QG 4.829 . 4.829 3.457 2.025 4.101 . 0 0 "[ . 1 . 2]" 1
1191 1 9 GLU QB 1 10 CYS H 4.213 . 4.213 2.708 2.401 3.514 . 0 0 "[ . 1 . 2]" 1
1192 1 11 TRP H 1 11 TRP QB 3.608 . 3.608 2.335 2.249 2.470 . 0 0 "[ . 1 . 2]" 1
1193 1 11 TRP QB 1 12 SER H 4.829 . 4.829 2.910 2.592 3.201 . 0 0 "[ . 1 . 2]" 1
1194 1 11 TRP HD1 1 72 GLY QA 5.555 . 5.555 3.382 2.674 4.109 . 0 0 "[ . 1 . 2]" 1
1195 1 11 TRP HE1 1 72 GLY QA 4.653 . 4.653 2.021 1.779 2.425 . 0 0 "[ . 1 . 2]" 1
1196 1 11 TRP HE1 1 76 TYR QB 4.202 . 4.202 2.299 1.825 3.167 . 0 0 "[ . 1 . 2]" 1
1197 1 11 TRP HZ2 1 75 GLY QA 4.378 . 4.378 3.179 2.416 3.811 . 0 0 "[ . 1 . 2]" 1
1198 1 12 SER H 1 15 GLU QB 5.258 . 5.258 4.644 4.108 5.331 0.073 19 0 "[ . 1 . 2]" 1
1199 1 12 SER HA 1 15 GLU QB 4.543 . 4.543 2.538 1.971 3.645 . 0 0 "[ . 1 . 2]" 1
1200 1 12 SER QB 1 15 GLU QB 5.192 . 5.192 4.273 3.649 5.222 0.030 13 0 "[ . 1 . 2]" 1
1201 1 15 GLU H 1 15 GLU QB 3.366 . 3.366 2.302 2.084 2.573 . 0 0 "[ . 1 . 2]" 1
1202 1 15 GLU HA 1 18 ARG QB 3.509 . 3.509 2.540 1.757 3.697 0.188 20 0 "[ . 1 . 2]" 1
1203 1 16 GLY QA 1 17 PHE HA 5.863 . 5.863 4.122 4.054 4.149 . 0 0 "[ . 1 . 2]" 1
1204 1 16 GLY QA 1 18 ARG H 5.115 . 5.115 3.669 3.565 3.809 . 0 0 "[ . 1 . 2]" 1
1205 1 17 PHE H 1 18 ARG QB 5.258 . 5.258 4.165 3.928 4.524 . 0 0 "[ . 1 . 2]" 1
1206 1 18 ARG H 1 18 ARG QB 3.377 . 3.377 2.281 2.164 2.468 . 0 0 "[ . 1 . 2]" 1
1207 1 18 ARG H 1 18 ARG QG 4.972 . 4.972 3.719 2.431 4.121 . 0 0 "[ . 1 . 2]" 1
1208 1 18 ARG H 1 18 ARG QD 5.148 . 5.148 4.502 3.584 4.946 . 0 0 "[ . 1 . 2]" 1
1209 1 18 ARG HA 1 18 ARG QD 4.961 . 4.961 4.065 2.398 4.690 . 0 0 "[ . 1 . 2]" 1
1210 1 18 ARG QG 1 19 VAL HA 5.852 . 5.852 3.848 3.260 5.195 . 0 0 "[ . 1 . 2]" 1
1211 1 19 VAL QG 1 20 THR H 4.290 . 4.290 2.528 2.015 3.212 . 0 0 "[ . 1 . 2]" 1
1212 1 19 VAL QG 1 20 THR HA 4.114 . 4.114 3.395 3.196 3.712 . 0 0 "[ . 1 . 2]" 1
1213 1 23 SER H 1 23 SER QB 3.586 . 3.586 2.359 2.274 2.448 . 0 0 "[ . 1 . 2]" 1
1214 1 23 SER QB 1 24 VAL H 3.894 . 3.894 2.540 2.163 3.056 . 0 0 "[ . 1 . 2]" 1
1215 1 23 SER QB 1 24 VAL MG2 4.103 . 4.103 2.629 2.450 2.914 . 0 0 "[ . 1 . 2]" 1
1216 1 26 ASP QB 1 27 PRO HG3 5.775 . 5.775 5.371 4.810 5.943 0.168 18 0 "[ . 1 . 2]" 1
1217 1 26 ASP QB 1 27 PRO HD2 4.895 . 4.895 2.995 2.386 3.651 . 0 0 "[ . 1 . 2]" 1
1218 1 26 ASP QB 1 27 PRO HD3 5.313 . 5.313 3.865 2.828 4.474 . 0 0 "[ . 1 . 2]" 1
1219 1 26 ASP QB 1 29 ARG H 4.554 . 4.554 2.780 1.907 3.880 . 0 0 "[ . 1 . 2]" 1
1220 1 26 ASP QB 1 29 ARG QB 4.906 . 4.906 2.424 1.635 4.058 . 0 0 "[ . 1 . 2]" 1
1221 1 26 ASP QB 1 29 ARG HG2 5.874 . 5.874 4.306 3.525 5.988 0.114 9 0 "[ . 1 . 2]" 1
1222 1 29 ARG HA 1 29 ARG QD 4.367 . 4.367 2.355 1.968 4.284 . 0 0 "[ . 1 . 2]" 1
1223 1 30 ILE HA 1 33 TYR QB 4.895 . 4.895 3.047 2.656 3.366 . 0 0 "[ . 1 . 2]" 1
1224 1 30 ILE HB 1 33 TYR QB 4.477 . 4.477 2.718 2.342 2.857 . 0 0 "[ . 1 . 2]" 1
1225 1 30 ILE HB 1 82 SER QB 4.664 . 4.664 2.896 2.250 3.793 . 0 0 "[ . 1 . 2]" 1
1226 1 30 ILE MG 1 33 TYR QB 4.477 . 4.477 3.487 3.322 3.675 . 0 0 "[ . 1 . 2]" 1
1227 1 30 ILE MG 1 82 SER QB 3.839 . 3.839 2.539 1.839 3.635 . 0 0 "[ . 1 . 2]" 1
1228 1 30 ILE MD 1 33 TYR QB 5.357 . 5.357 4.438 3.968 4.629 . 0 0 "[ . 1 . 2]" 1
1229 1 30 ILE MD 1 82 SER QB 4.763 . 4.763 2.940 2.247 3.346 . 0 0 "[ . 1 . 2]" 1
1230 1 31 THR MG 1 45 GLU QG 3.487 . 3.487 2.554 1.840 3.657 0.170 5 0 "[ . 1 . 2]" 1
1231 1 32 PRO QB 1 33 TYR H 3.806 . 3.806 3.232 2.902 3.556 . 0 0 "[ . 1 . 2]" 1
1232 1 33 TYR HA 1 36 GLN QB 3.630 . 3.630 2.534 2.083 2.816 . 0 0 "[ . 1 . 2]" 1
1233 1 33 TYR QB 1 82 SER QB 4.785 . 4.785 3.400 2.749 4.426 . 0 0 "[ . 1 . 2]" 1
1234 1 33 TYR QD 1 82 SER QB 4.169 . 4.169 2.407 1.848 3.515 . 0 0 "[ . 1 . 2]" 1
1235 1 33 TYR QE 1 82 SER QB 4.741 . 4.741 2.899 2.046 4.443 . 0 0 "[ . 1 . 2]" 1
1236 1 34 LEU H 1 35 ARG QG 5.390 . 5.390 4.322 4.062 4.774 . 0 0 "[ . 1 . 2]" 1
1237 1 34 LEU HA 1 37 CYS QB 4.334 . 4.334 3.023 2.603 4.080 . 0 0 "[ . 1 . 2]" 1
1238 1 34 LEU HB2 1 40 LEU QB 5.148 . 5.148 2.656 2.375 3.404 . 0 0 "[ . 1 . 2]" 1
1239 1 34 LEU HB3 1 40 LEU QB 4.554 . 4.554 1.944 1.708 2.229 . 0 0 "[ . 1 . 2]" 1
1240 1 35 ARG H 1 35 ARG QB 3.333 . 3.333 2.582 2.298 2.895 . 0 0 "[ . 1 . 2]" 1
1241 1 35 ARG H 1 40 LEU QB 5.786 . 5.786 3.361 2.872 4.655 . 0 0 "[ . 1 . 2]" 1
1242 1 35 ARG HA 1 35 ARG QG 3.861 . 3.861 3.172 2.388 3.534 . 0 0 "[ . 1 . 2]" 1
1243 1 35 ARG HA 1 35 ARG QD 4.367 . 4.367 3.856 2.105 4.501 0.134 15 0 "[ . 1 . 2]" 1
1244 1 35 ARG HA 1 40 LEU QB 4.444 . 4.444 3.029 2.466 4.557 0.113 20 0 "[ . 1 . 2]" 1
1245 1 35 ARG QB 1 36 GLN HA 5.390 . 5.390 4.362 3.755 4.658 . 0 0 "[ . 1 . 2]" 1
1246 1 35 ARG QG 1 36 GLN H 5.456 . 5.456 3.088 1.948 4.318 . 0 0 "[ . 1 . 2]" 1
1247 1 36 GLN H 1 36 GLN QB 3.333 . 3.333 2.297 2.212 2.455 . 0 0 "[ . 1 . 2]" 1
1248 1 36 GLN H 1 36 GLN QG 5.093 . 5.093 3.717 2.300 4.119 . 0 0 "[ . 1 . 2]" 1
1249 1 36 GLN QB 1 37 CYS H 3.674 . 3.674 2.668 2.470 2.936 . 0 0 "[ . 1 . 2]" 1
1250 1 36 GLN QG 1 37 CYS H 5.236 . 5.236 3.819 3.352 4.375 . 0 0 "[ . 1 . 2]" 1
1251 1 37 CYS H 1 37 CYS QB 3.443 . 3.443 2.370 2.283 2.711 . 0 0 "[ . 1 . 2]" 1
1252 1 37 CYS HA 1 38 LYS QG 5.027 . 5.027 3.890 3.485 4.652 . 0 0 "[ . 1 . 2]" 1
1253 1 37 CYS QB 1 38 LYS H 4.576 . 4.576 3.457 3.214 3.945 . 0 0 "[ . 1 . 2]" 1
1254 1 37 CYS QB 1 39 VAL H 4.499 . 4.499 3.123 2.670 3.816 . 0 0 "[ . 1 . 2]" 1
1255 1 37 CYS QB 1 39 VAL QG 3.619 . 3.619 2.286 1.810 2.773 . 0 0 "[ . 1 . 2]" 1
1256 1 38 LYS H 1 38 LYS QG 3.949 . 3.949 2.938 2.784 3.099 . 0 0 "[ . 1 . 2]" 1
1257 1 38 LYS H 1 38 LYS QD 4.928 . 4.928 3.229 2.723 4.700 . 0 0 "[ . 1 . 2]" 1
1258 1 38 LYS HA 1 38 LYS QG 3.773 . 3.773 2.933 2.515 3.110 . 0 0 "[ . 1 . 2]" 1
1259 1 38 LYS HA 1 38 LYS QD 3.927 . 3.927 2.317 1.916 3.630 . 0 0 "[ . 1 . 2]" 1
1260 1 38 LYS QB 1 38 LYS QD 3.421 . 3.421 2.544 2.247 2.897 . 0 0 "[ . 1 . 2]" 1
1261 1 38 LYS QB 1 39 VAL H 4.631 . 4.631 3.764 3.576 3.980 . 0 0 "[ . 1 . 2]" 1
1262 1 39 VAL H 1 40 LEU QB 5.368 . 5.368 4.174 3.819 4.448 . 0 0 "[ . 1 . 2]" 1
1263 1 39 VAL QG 1 74 LYS QB 3.399 . 3.399 2.061 1.646 2.898 . 0 0 "[ . 1 . 2]" 1
1264 1 39 VAL QG 1 74 LYS QG 4.290 . 4.290 3.023 1.815 3.706 . 0 0 "[ . 1 . 2]" 1
1265 1 39 VAL QG 1 75 GLY QA 4.290 . 4.290 2.211 1.932 2.750 . 0 0 "[ . 1 . 2]" 1
1266 1 40 LEU QB 1 41 ASN H 4.378 . 4.378 3.739 3.526 3.895 . 0 0 "[ . 1 . 2]" 1
1267 1 40 LEU QB 1 44 ASP QB 4.917 . 4.917 4.455 3.995 4.937 0.020 3 0 "[ . 1 . 2]" 1
1268 1 40 LEU HG 1 44 ASP QB 4.840 . 4.840 2.954 1.973 3.856 . 0 0 "[ . 1 . 2]" 1
1269 1 40 LEU MD1 1 44 ASP QB 4.631 . 4.631 2.119 1.929 2.376 . 0 0 "[ . 1 . 2]" 1
1270 1 40 LEU MD2 1 44 ASP QB 4.191 . 4.191 3.714 2.972 4.187 . 0 0 "[ . 1 . 2]" 1
1271 1 40 LEU MD2 1 45 GLU QB 3.828 . 3.828 2.467 2.202 3.086 . 0 0 "[ . 1 . 2]" 1
1272 1 40 LEU MD2 1 45 GLU QG 4.631 . 4.631 2.965 2.276 3.986 . 0 0 "[ . 1 . 2]" 1
1273 1 41 ASN H 1 41 ASN QB 3.663 . 3.663 2.508 2.420 2.867 . 0 0 "[ . 1 . 2]" 1
1274 1 41 ASN H 1 41 ASN QD 5.555 . 5.555 2.977 2.114 4.414 . 0 0 "[ . 1 . 2]" 1
1275 1 41 ASN H 1 44 ASP QB 4.444 . 4.444 2.819 2.469 3.366 . 0 0 "[ . 1 . 2]" 1
1276 1 41 ASN HA 1 42 PRO QG 4.961 . 4.961 4.076 3.907 4.170 . 0 0 "[ . 1 . 2]" 1
1277 1 41 ASN QB 1 42 PRO QG 5.214 . 5.214 3.765 3.337 4.685 . 0 0 "[ . 1 . 2]" 1
1278 1 41 ASN QB 1 42 PRO QD 3.421 . 3.421 2.314 2.145 2.899 . 0 0 "[ . 1 . 2]" 1
1279 1 41 ASN QB 1 43 ASP H 4.620 . 4.620 2.797 2.498 3.485 . 0 0 "[ . 1 . 2]" 1
1280 1 41 ASN QB 1 44 ASP H 4.334 . 4.334 2.665 2.266 4.066 . 0 0 "[ . 1 . 2]" 1
1281 1 41 ASN QD 1 42 PRO QD 5.676 . 5.676 4.437 2.781 4.878 . 0 0 "[ . 1 . 2]" 1
1282 1 42 PRO HA 1 45 GLU QB 4.147 . 4.147 2.325 1.994 2.856 . 0 0 "[ . 1 . 2]" 1
1283 1 42 PRO QG 1 43 ASP H 4.048 . 4.048 2.973 2.412 4.010 . 0 0 "[ . 1 . 2]" 1
1284 1 43 ASP H 1 43 ASP QB 3.652 . 3.652 2.491 2.252 2.602 . 0 0 "[ . 1 . 2]" 1
1285 1 43 ASP QB 1 44 ASP H 4.114 . 4.114 2.365 2.151 2.702 . 0 0 "[ . 1 . 2]" 1
1286 1 44 ASP H 1 44 ASP QB 3.575 . 3.575 2.468 2.241 2.616 . 0 0 "[ . 1 . 2]" 1
1287 1 44 ASP H 1 45 GLU QB 4.994 . 4.994 4.308 4.043 4.433 . 0 0 "[ . 1 . 2]" 1
1288 1 44 ASP QB 1 45 GLU H 3.586 . 3.586 2.719 2.343 2.954 . 0 0 "[ . 1 . 2]" 1
1289 1 44 ASP QB 1 67 ILE MG 3.674 . 3.674 2.704 2.008 3.564 . 0 0 "[ . 1 . 2]" 1
1290 1 44 ASP QB 1 67 ILE MD 3.762 . 3.762 2.367 1.628 3.875 0.113 15 0 "[ . 1 . 2]" 1
1291 1 45 GLU H 1 45 GLU QB 3.487 . 3.487 2.252 2.174 2.315 . 0 0 "[ . 1 . 2]" 1
1292 1 45 GLU H 1 45 GLU QG 4.961 . 4.961 4.008 3.944 4.117 . 0 0 "[ . 1 . 2]" 1
1293 1 45 GLU QB 1 46 GLU H 3.509 . 3.509 2.436 2.241 2.700 . 0 0 "[ . 1 . 2]" 1
1294 1 45 GLU QB 1 49 LEU MD1 4.664 . 4.664 3.855 3.509 4.092 . 0 0 "[ . 1 . 2]" 1
1295 1 45 GLU QG 1 49 LEU HG 4.829 . 4.829 2.797 2.317 3.315 . 0 0 "[ . 1 . 2]" 1
1296 1 45 GLU QG 1 49 LEU MD2 4.246 . 4.246 3.711 3.040 4.250 0.004 5 0 "[ . 1 . 2]" 1
1297 1 46 GLU H 1 46 GLU QG 4.587 . 4.587 3.718 2.379 4.092 . 0 0 "[ . 1 . 2]" 1
1298 1 46 GLU QG 1 47 GLN H 5.379 . 5.379 3.871 3.431 4.412 . 0 0 "[ . 1 . 2]" 1
1299 1 47 GLN H 1 47 GLN QG 4.488 . 4.488 3.841 2.229 4.080 . 0 0 "[ . 1 . 2]" 1
1300 1 47 GLN HA 1 47 GLN QG 4.015 . 4.015 2.728 2.507 3.394 . 0 0 "[ . 1 . 2]" 1
1301 1 47 GLN QG 1 48 VAL MG1 5.764 . 5.764 5.136 4.566 5.873 0.109 10 0 "[ . 1 . 2]" 1
1302 1 47 GLN QE 1 48 VAL MG2 5.236 . 5.236 3.682 2.416 5.370 0.134 7 0 "[ . 1 . 2]" 1
1303 1 50 SER H 1 50 SER QB 3.916 . 3.916 2.287 2.243 2.362 . 0 0 "[ . 1 . 2]" 1
1304 1 51 ASP H 1 52 PRO QD 4.829 . 4.829 3.279 2.383 4.365 . 0 0 "[ . 1 . 2]" 1
1305 1 51 ASP HA 1 52 PRO QD 3.344 . 3.344 2.219 1.931 2.507 . 0 0 "[ . 1 . 2]" 1
1306 1 51 ASP QB 1 52 PRO QD 4.565 . 4.565 3.744 3.220 4.004 . 0 0 "[ . 1 . 2]" 1
1307 1 51 ASP QB 1 54 LEU QB 4.037 . 4.037 2.813 1.739 4.212 0.175 11 0 "[ . 1 . 2]" 1
1308 1 51 ASP QB 1 54 LEU HG 4.587 . 4.587 3.571 2.134 4.657 0.070 20 0 "[ . 1 . 2]" 1
1309 1 51 ASP QB 1 54 LEU MD1 4.213 . 4.213 2.953 1.708 4.158 . 0 0 "[ . 1 . 2]" 1
1310 1 52 PRO QD 1 53 ASN H 4.334 . 4.334 2.629 2.009 4.071 . 0 0 "[ . 1 . 2]" 1
1311 1 53 ASN H 1 53 ASN QB 3.476 . 3.476 2.715 2.245 3.330 . 0 0 "[ . 1 . 2]" 1
1312 1 53 ASN H 1 53 ASN QD 5.104 . 5.104 4.014 2.798 4.899 . 0 0 "[ . 1 . 2]" 1
1313 1 53 ASN H 1 54 LEU QB 5.643 . 5.643 4.359 3.779 4.985 . 0 0 "[ . 1 . 2]" 1
1314 1 54 LEU QB 1 54 LEU MD1 3.179 . 3.179 2.230 2.138 2.434 . 0 0 "[ . 1 . 2]" 1
1315 1 54 LEU QB 1 55 VAL H 4.334 . 4.334 2.576 2.005 3.879 . 0 0 "[ . 1 . 2]" 1
1316 1 55 VAL H 1 55 VAL QG 3.740 . 3.740 2.013 1.912 2.212 . 0 0 "[ . 1 . 2]" 1
1317 1 55 VAL QG 1 56 ILE H 4.972 . 4.972 2.978 2.242 3.610 . 0 0 "[ . 1 . 2]" 1
1318 1 56 ILE MG 1 60 LYS QG 4.213 . 4.213 2.402 2.062 3.538 . 0 0 "[ . 1 . 2]" 1
1319 1 57 ARG HA 1 57 ARG QG 3.751 . 3.751 2.657 2.428 3.395 . 0 0 "[ . 1 . 2]" 1
1320 1 57 ARG QB 1 58 LYS H 4.147 . 4.147 2.680 2.352 3.568 . 0 0 "[ . 1 . 2]" 1
1321 1 57 ARG QB 1 58 LYS HA 5.005 . 5.005 4.263 4.051 4.615 . 0 0 "[ . 1 . 2]" 1
1322 1 57 ARG QG 1 58 LYS H 5.390 . 5.390 3.618 2.148 4.520 . 0 0 "[ . 1 . 2]" 1
1323 1 58 LYS H 1 58 LYS QB 3.696 . 3.696 2.387 2.125 2.804 . 0 0 "[ . 1 . 2]" 1
1324 1 58 LYS H 1 58 LYS QG 4.906 . 4.906 3.073 1.952 4.017 . 0 0 "[ . 1 . 2]" 1
1325 1 58 LYS QB 1 59 ARG H 3.971 . 3.971 2.737 2.201 3.547 . 0 0 "[ . 1 . 2]" 1
1326 1 58 LYS QG 1 59 ARG H 4.664 . 4.664 3.581 2.223 4.649 . 0 0 "[ . 1 . 2]" 1
1327 1 59 ARG H 1 60 LYS QG 4.895 . 4.895 4.220 3.938 4.534 . 0 0 "[ . 1 . 2]" 1
1328 1 59 ARG QG 1 62 GLY H 5.687 . 5.687 4.991 4.665 5.750 0.063 6 0 "[ . 1 . 2]" 1
1329 1 60 LYS H 1 60 LYS QG 3.850 . 3.850 2.275 2.065 2.547 . 0 0 "[ . 1 . 2]" 1
1330 1 60 LYS HA 1 60 LYS QD 4.279 . 4.279 3.050 1.980 4.445 0.166 15 0 "[ . 1 . 2]" 1
1331 1 60 LYS QB 1 61 VAL H 3.927 . 3.927 2.955 2.539 3.816 . 0 0 "[ . 1 . 2]" 1
1332 1 61 VAL H 1 62 GLY QA 5.874 . 5.874 4.561 4.454 4.788 . 0 0 "[ . 1 . 2]" 1
1333 1 61 VAL HA 1 64 LEU QB 3.795 . 3.795 2.375 1.947 3.081 . 0 0 "[ . 1 . 2]" 1
1334 1 61 VAL MG1 1 64 LEU QB 4.191 . 4.191 3.399 2.894 4.243 0.052 7 0 "[ . 1 . 2]" 1
1335 1 62 GLY QA 1 65 LEU H 5.874 . 5.874 3.454 3.198 3.693 . 0 0 "[ . 1 . 2]" 1
1336 1 62 GLY QA 1 65 LEU HB2 4.807 . 4.807 3.159 2.777 3.512 . 0 0 "[ . 1 . 2]" 1
1337 1 62 GLY QA 1 65 LEU HG 5.082 . 5.082 2.922 2.404 3.498 . 0 0 "[ . 1 . 2]" 1
1338 1 62 GLY QA 1 65 LEU MD1 4.004 . 4.004 2.372 2.062 2.781 . 0 0 "[ . 1 . 2]" 1
1339 1 63 VAL H 1 64 LEU QB 5.071 . 5.071 4.427 4.284 4.532 . 0 0 "[ . 1 . 2]" 1
1340 1 63 VAL HA 1 66 ASP QB 3.971 . 3.971 2.890 2.251 3.473 . 0 0 "[ . 1 . 2]" 1
1341 1 63 VAL MG1 1 66 ASP QB 4.092 . 4.092 3.551 3.172 3.715 . 0 0 "[ . 1 . 2]" 1
1342 1 64 LEU HA 1 67 ILE QG 5.544 . 5.544 3.058 2.598 4.048 . 0 0 "[ . 1 . 2]" 1
1343 1 64 LEU QB 1 65 LEU H 3.960 . 3.960 2.763 2.489 3.156 . 0 0 "[ . 1 . 2]" 1
1344 1 65 LEU H 1 66 ASP QB 5.577 . 5.577 4.370 4.217 4.566 . 0 0 "[ . 1 . 2]" 1
1345 1 66 ASP H 1 66 ASP QB 3.377 . 3.377 2.237 2.196 2.289 . 0 0 "[ . 1 . 2]" 1
1346 1 66 ASP H 1 67 ILE QG 5.610 . 5.610 4.247 4.096 4.458 . 0 0 "[ . 1 . 2]" 1
1347 1 66 ASP HA 1 69 GLN QB 5.027 . 5.027 2.546 2.152 3.044 . 0 0 "[ . 1 . 2]" 1
1348 1 66 ASP QB 1 67 ILE H 3.861 . 3.861 2.571 2.380 2.826 . 0 0 "[ . 1 . 2]" 1
1349 1 67 ILE H 1 67 ILE QG 3.729 . 3.729 2.100 1.957 2.355 . 0 0 "[ . 1 . 2]" 1
1350 1 67 ILE HA 1 67 ILE QG 3.685 . 3.685 2.490 2.371 2.563 . 0 0 "[ . 1 . 2]" 1
1351 1 67 ILE HA 1 70 ARG QD 5.027 . 5.027 2.782 1.973 5.089 0.062 6 0 "[ . 1 . 2]" 1
1352 1 68 LEU H 1 69 GLN QB 5.467 . 5.467 4.361 4.194 4.523 . 0 0 "[ . 1 . 2]" 1
1353 1 68 LEU MD1 1 75 GLY QA 5.324 . 5.324 3.990 3.458 4.906 . 0 0 "[ . 1 . 2]" 1
1354 1 68 LEU MD2 1 75 GLY QA 3.960 . 3.960 2.800 2.293 3.340 . 0 0 "[ . 1 . 2]" 1
1355 1 69 GLN H 1 69 GLN QG 4.554 . 4.554 4.029 4.005 4.109 . 0 0 "[ . 1 . 2]" 1
1356 1 69 GLN QB 1 70 ARG H 4.290 . 4.290 2.684 2.475 2.820 . 0 0 "[ . 1 . 2]" 1
1357 1 70 ARG H 1 70 ARG QB 3.355 . 3.355 2.440 2.230 2.617 . 0 0 "[ . 1 . 2]" 1
1358 1 70 ARG H 1 70 ARG QG 4.400 . 4.400 2.626 2.028 3.778 . 0 0 "[ . 1 . 2]" 1
1359 1 70 ARG H 1 70 ARG QD 4.917 . 4.917 3.293 1.916 4.100 . 0 0 "[ . 1 . 2]" 1
1360 1 70 ARG HA 1 70 ARG QD 4.796 . 4.796 3.601 2.124 4.303 . 0 0 "[ . 1 . 2]" 1
1361 1 70 ARG QB 1 71 THR H 4.125 . 4.125 2.693 2.370 2.919 . 0 0 "[ . 1 . 2]" 1
1362 1 70 ARG QB 1 71 THR HB 4.477 . 4.477 4.054 3.841 4.248 . 0 0 "[ . 1 . 2]" 1
1363 1 70 ARG QB 1 72 GLY H 5.467 . 5.467 4.491 4.371 4.614 . 0 0 "[ . 1 . 2]" 1
1364 1 71 THR MG 1 75 GLY QA 4.873 . 4.873 2.136 1.809 2.546 . 0 0 "[ . 1 . 2]" 1
1365 1 72 GLY QA 1 75 GLY H 5.819 . 5.819 3.503 3.058 3.884 . 0 0 "[ . 1 . 2]" 1
1366 1 73 HIS HA 1 76 TYR QB 4.235 . 4.235 3.808 2.910 4.209 . 0 0 "[ . 1 . 2]" 1
1367 1 73 HIS QB 1 74 LYS H 4.191 . 4.191 2.602 2.224 3.315 . 0 0 "[ . 1 . 2]" 1
1368 1 74 LYS H 1 74 LYS QB 3.476 . 3.476 2.385 2.203 2.733 . 0 0 "[ . 1 . 2]" 1
1369 1 74 LYS H 1 74 LYS QG 4.862 . 4.862 3.013 1.873 4.050 . 0 0 "[ . 1 . 2]" 1
1370 1 74 LYS HA 1 75 GLY QA 5.522 . 5.522 4.560 4.536 4.589 . 0 0 "[ . 1 . 2]" 1
1371 1 74 LYS QG 1 75 GLY H 5.368 . 5.368 3.983 2.498 4.667 . 0 0 "[ . 1 . 2]" 1
1372 1 75 GLY QA 1 78 ALA H 5.302 . 5.302 3.757 3.548 4.062 . 0 0 "[ . 1 . 2]" 1
1373 1 75 GLY QA 1 78 ALA MB 4.235 . 4.235 2.757 2.354 3.103 . 0 0 "[ . 1 . 2]" 1
1374 1 75 GLY QA 1 79 PHE H 5.082 . 5.082 3.836 3.608 4.046 . 0 0 "[ . 1 . 2]" 1
1375 1 76 TYR QB 1 77 VAL H 3.817 . 3.817 2.432 2.233 2.621 . 0 0 "[ . 1 . 2]" 1
1376 1 76 TYR QB 1 77 VAL HA 5.874 . 5.874 4.207 4.017 4.448 . 0 0 "[ . 1 . 2]" 1
1377 1 77 VAL MG1 1 81 GLU QG 4.884 . 4.884 2.736 2.494 3.064 . 0 0 "[ . 1 . 2]" 1
1378 1 81 GLU HA 1 81 GLU QG 3.839 . 3.839 2.711 2.369 3.106 . 0 0 "[ . 1 . 2]" 1
1379 1 82 SER H 1 82 SER QB 3.751 . 3.751 2.461 2.248 2.668 . 0 0 "[ . 1 . 2]" 1
1380 1 82 SER QB 1 83 LEU H 4.642 . 4.642 3.026 2.239 3.490 . 0 0 "[ . 1 . 2]" 1
1381 1 82 SER QB 1 85 LEU MD1 5.874 . 5.874 4.699 4.055 5.167 . 0 0 "[ . 1 . 2]" 1
1382 1 82 SER QB 1 86 TYR QE 5.742 . 5.742 3.967 2.969 5.119 . 0 0 "[ . 1 . 2]" 1
1383 1 84 GLU H 1 84 GLU QG 4.620 . 4.620 4.015 3.920 4.119 . 0 0 "[ . 1 . 2]" 1
1384 1 84 GLU HA 1 84 GLU QG 3.861 . 3.861 2.541 2.402 3.027 . 0 0 "[ . 1 . 2]" 1
1385 1 84 GLU QG 1 85 LEU H 5.159 . 5.159 4.021 3.662 4.607 . 0 0 "[ . 1 . 2]" 1
1386 1 84 GLU QG 1 85 LEU HA 5.874 . 5.874 4.236 3.672 5.289 . 0 0 "[ . 1 . 2]" 1
1387 1 84 GLU QG 1 91 TYR QE 5.544 . 5.544 3.311 2.720 5.172 . 0 0 "[ . 1 . 2]" 1
1388 1 89 GLN HA 1 89 GLN QG 3.905 . 3.905 2.866 2.449 3.408 . 0 0 "[ . 1 . 2]" 1
1389 1 89 GLN QB 1 90 LEU H 3.938 . 3.938 2.763 2.301 3.514 . 0 0 "[ . 1 . 2]" 1
1390 1 89 GLN QG 1 90 LEU H 4.785 . 4.785 3.402 1.958 4.495 . 0 0 "[ . 1 . 2]" 1
1391 1 90 LEU HA 1 93 LYS QB 3.872 . 3.872 2.411 1.956 2.841 . 0 0 "[ . 1 . 2]" 1
1392 1 91 TYR QD 1 92 LYS QG 5.038 . 5.038 3.958 2.185 5.125 0.087 12 0 "[ . 1 . 2]" 1
1393 1 92 LYS H 1 92 LYS QG 4.268 . 4.268 3.276 2.070 4.037 . 0 0 "[ . 1 . 2]" 1
1394 1 92 LYS QG 1 93 LYS H 5.445 . 5.445 4.070 3.484 4.668 . 0 0 "[ . 1 . 2]" 1
1395 1 93 LYS H 1 93 LYS QB 3.454 . 3.454 2.321 2.212 2.482 . 0 0 "[ . 1 . 2]" 1
1396 1 93 LYS H 1 93 LYS QG 4.554 . 4.554 3.350 2.314 4.088 . 0 0 "[ . 1 . 2]" 1
1397 1 93 LYS HA 1 93 LYS QD 4.356 . 4.356 3.253 2.008 4.323 . 0 0 "[ . 1 . 2]" 1
1398 1 93 LYS HA 1 93 LYS QE 5.291 . 5.291 4.259 3.167 4.965 . 0 0 "[ . 1 . 2]" 1
1399 1 93 LYS QB 1 94 VAL H 3.630 . 3.630 2.570 2.364 2.953 . 0 0 "[ . 1 . 2]" 1
1400 1 93 LYS QB 1 94 VAL MG1 5.379 . 5.379 2.956 2.715 3.201 . 0 0 "[ . 1 . 2]" 1
1401 1 93 LYS QB 1 95 THR H 5.874 . 5.874 4.670 4.537 5.213 . 0 0 "[ . 1 . 2]" 1
1402 1 97 LYS H 1 97 LYS QB 3.454 . 3.454 2.787 2.306 3.420 . 0 0 "[ . 1 . 2]" 1
1403 1 97 LYS H 1 97 LYS QD 4.972 . 4.972 3.820 2.131 4.860 . 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 66
_Distance_constraint_stats_list.Viol_count 703
_Distance_constraint_stats_list.Viol_total 668.712
_Distance_constraint_stats_list.Viol_max 0.152
_Distance_constraint_stats_list.Viol_rms 0.0335
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0253
_Distance_constraint_stats_list.Viol_average_violations_only 0.0476
_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 14 LEU 1.459 0.139 8 0 "[ . 1 . 2]"
1 15 GLU 2.514 0.128 7 0 "[ . 1 . 2]"
1 17 PHE 1.898 0.139 8 0 "[ . 1 . 2]"
1 18 ARG 2.846 0.128 7 0 "[ . 1 . 2]"
1 20 THR 0.956 0.090 12 0 "[ . 1 . 2]"
1 21 LEU 0.440 0.074 10 0 "[ . 1 . 2]"
1 22 THR 0.332 0.045 15 0 "[ . 1 . 2]"
1 24 VAL 0.956 0.090 12 0 "[ . 1 . 2]"
1 30 ILE 0.205 0.049 4 0 "[ . 1 . 2]"
1 31 THR 2.451 0.121 19 0 "[ . 1 . 2]"
1 32 PRO 1.492 0.114 9 0 "[ . 1 . 2]"
1 34 LEU 0.205 0.049 4 0 "[ . 1 . 2]"
1 35 ARG 4.441 0.150 5 0 "[ . 1 . 2]"
1 36 GLN 1.492 0.114 9 0 "[ . 1 . 2]"
1 38 LYS 1.990 0.150 5 0 "[ . 1 . 2]"
1 41 ASN 0.491 0.079 3 0 "[ . 1 . 2]"
1 42 PRO 0.823 0.058 16 0 "[ . 1 . 2]"
1 45 GLU 0.869 0.079 3 0 "[ . 1 . 2]"
1 46 GLU 2.258 0.152 15 0 "[ . 1 . 2]"
1 49 LEU 0.378 0.062 11 0 "[ . 1 . 2]"
1 50 SER 1.435 0.152 15 0 "[ . 1 . 2]"
1 56 ILE 1.025 0.101 1 0 "[ . 1 . 2]"
1 57 ARG 0.948 0.114 7 0 "[ . 1 . 2]"
1 59 ARG 1.261 0.118 15 0 "[ . 1 . 2]"
1 60 LYS 1.744 0.101 1 0 "[ . 1 . 2]"
1 61 VAL 0.948 0.114 7 0 "[ . 1 . 2]"
1 63 VAL 1.261 0.118 15 0 "[ . 1 . 2]"
1 64 LEU 0.820 0.066 8 0 "[ . 1 . 2]"
1 65 LEU 1.651 0.120 7 0 "[ . 1 . 2]"
1 68 LEU 0.102 0.039 2 0 "[ . 1 . 2]"
1 69 GLN 3.576 0.123 19 0 "[ . 1 . 2]"
1 72 GLY 2.330 0.123 19 0 "[ . 1 . 2]"
1 74 LYS 0.965 0.069 15 0 "[ . 1 . 2]"
1 75 GLY 1.053 0.079 20 0 "[ . 1 . 2]"
1 76 TYR 0.976 0.069 6 0 "[ . 1 . 2]"
1 77 VAL 0.921 0.075 3 0 "[ . 1 . 2]"
1 78 ALA 1.919 0.079 16 0 "[ . 1 . 2]"
1 79 PHE 2.055 0.104 20 0 "[ . 1 . 2]"
1 80 LEU 1.266 0.062 5 0 "[ . 1 . 2]"
1 81 GLU 0.921 0.075 3 0 "[ . 1 . 2]"
1 82 SER 1.330 0.079 16 0 "[ . 1 . 2]"
1 83 LEU 1.002 0.104 20 0 "[ . 1 . 2]"
1 84 GLU 0.695 0.062 5 0 "[ . 1 . 2]"
1 86 TYR 0.376 0.044 11 0 "[ . 1 . 2]"
1 87 TYR 0.115 0.039 9 0 "[ . 1 . 2]"
1 88 PRO 1.676 0.095 7 0 "[ . 1 . 2]"
1 89 GLN 1.806 0.128 9 0 "[ . 1 . 2]"
1 90 LEU 0.300 0.059 10 0 "[ . 1 . 2]"
1 91 TYR 0.115 0.039 9 0 "[ . 1 . 2]"
1 92 LYS 1.676 0.095 7 0 "[ . 1 . 2]"
1 93 LYS 1.806 0.128 9 0 "[ . 1 . 2]"
1 94 VAL 0.300 0.059 10 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 14 LEU O 1 17 PHE H 2.000 . 2.000 2.070 1.936 2.139 0.139 8 0 "[ . 1 . 2]" 2
2 1 14 LEU O 1 17 PHE N 3.000 . 3.000 2.921 2.875 2.997 . 0 0 "[ . 1 . 2]" 2
3 1 15 GLU O 1 18 ARG H 2.000 . 2.000 2.099 2.069 2.128 0.128 7 0 "[ . 1 . 2]" 2
4 1 15 GLU O 1 18 ARG N 3.000 . 3.000 3.019 2.903 3.071 0.071 20 0 "[ . 1 . 2]" 2
5 1 17 PHE O 1 21 LEU H 2.000 . 2.000 2.006 1.904 2.074 0.074 10 0 "[ . 1 . 2]" 2
6 1 17 PHE O 1 21 LEU N 3.000 . 3.000 2.944 2.868 3.011 0.011 10 0 "[ . 1 . 2]" 2
7 1 18 ARG O 1 22 THR H 2.000 . 2.000 2.011 1.979 2.045 0.045 15 0 "[ . 1 . 2]" 2
8 1 18 ARG O 1 22 THR N 3.000 . 3.000 2.969 2.917 3.020 0.020 15 0 "[ . 1 . 2]" 2
9 1 20 THR O 1 24 VAL H 2.000 . 2.000 2.040 1.997 2.090 0.090 12 0 "[ . 1 . 2]" 2
10 1 20 THR O 1 24 VAL N 3.000 . 3.000 2.966 2.807 3.033 0.033 15 0 "[ . 1 . 2]" 2
11 1 30 ILE O 1 34 LEU H 2.000 . 2.000 2.000 1.946 2.049 0.049 4 0 "[ . 1 . 2]" 2
12 1 30 ILE O 1 34 LEU N 3.000 . 3.000 2.922 2.848 3.011 0.011 4 0 "[ . 1 . 2]" 2
13 1 31 THR O 1 35 ARG H 2.000 . 2.000 2.078 2.049 2.121 0.121 19 0 "[ . 1 . 2]" 2
14 1 31 THR O 1 35 ARG N 3.000 . 3.000 3.043 2.983 3.103 0.103 19 0 "[ . 1 . 2]" 2
15 1 32 PRO O 1 36 GLN H 2.000 . 2.000 2.071 2.018 2.114 0.114 9 0 "[ . 1 . 2]" 2
16 1 32 PRO O 1 36 GLN N 3.000 . 3.000 2.966 2.878 3.021 0.021 15 0 "[ . 1 . 2]" 2
17 1 35 ARG O 1 38 LYS H 2.000 . 2.000 2.099 2.062 2.150 0.150 5 0 "[ . 1 . 2]" 2
18 1 35 ARG O 1 38 LYS N 3.000 . 3.000 2.948 2.879 3.008 0.008 10 0 "[ . 1 . 2]" 2
19 1 41 ASN O 1 45 GLU H 2.000 . 2.000 2.017 1.961 2.079 0.079 3 0 "[ . 1 . 2]" 2
20 1 41 ASN O 1 45 GLU N 3.000 . 3.000 2.922 2.793 3.031 0.031 3 0 "[ . 1 . 2]" 2
21 1 42 PRO O 1 46 GLU H 2.000 . 2.000 2.040 2.016 2.058 0.058 16 0 "[ . 1 . 2]" 2
22 1 42 PRO O 1 46 GLU N 3.000 . 3.000 2.966 2.850 3.014 0.014 8 0 "[ . 1 . 2]" 2
23 1 45 GLU O 1 49 LEU H 2.000 . 2.000 1.995 1.901 2.062 0.062 11 0 "[ . 1 . 2]" 2
24 1 45 GLU O 1 49 LEU N 3.000 . 3.000 2.942 2.828 3.014 0.014 11 0 "[ . 1 . 2]" 2
25 1 46 GLU O 1 50 SER H 2.000 . 2.000 2.072 2.025 2.152 0.152 15 0 "[ . 1 . 2]" 2
26 1 46 GLU O 1 50 SER N 3.000 . 3.000 2.814 2.692 2.932 . 0 0 "[ . 1 . 2]" 2
27 1 56 ILE O 1 60 LYS H 2.000 . 2.000 2.045 1.988 2.101 0.101 1 0 "[ . 1 . 2]" 2
28 1 56 ILE O 1 60 LYS N 3.000 . 3.000 2.967 2.843 3.063 0.063 15 0 "[ . 1 . 2]" 2
29 1 57 ARG O 1 61 VAL H 2.000 . 2.000 2.040 1.902 2.114 0.114 7 0 "[ . 1 . 2]" 2
30 1 57 ARG O 1 61 VAL N 3.000 . 3.000 2.877 2.769 3.011 0.011 19 0 "[ . 1 . 2]" 2
31 1 59 ARG O 1 63 VAL H 2.000 . 2.000 2.053 1.986 2.118 0.118 15 0 "[ . 1 . 2]" 2
32 1 59 ARG O 1 63 VAL N 3.000 . 3.000 2.992 2.935 3.074 0.074 15 0 "[ . 1 . 2]" 2
33 1 60 LYS O 1 64 LEU H 2.000 . 2.000 2.034 1.967 2.066 0.066 8 0 "[ . 1 . 2]" 2
34 1 60 LYS O 1 64 LEU N 3.000 . 3.000 2.873 2.799 2.946 . 0 0 "[ . 1 . 2]" 2
35 1 64 LEU O 1 68 LEU H 2.000 . 2.000 1.967 1.896 2.039 0.039 2 0 "[ . 1 . 2]" 2
36 1 64 LEU O 1 68 LEU N 3.000 . 3.000 2.888 2.750 3.000 . 0 0 "[ . 1 . 2]" 2
37 1 65 LEU O 1 69 GLN H 2.000 . 2.000 2.082 2.057 2.120 0.120 7 0 "[ . 1 . 2]" 2
38 1 65 LEU O 1 69 GLN N 3.000 . 3.000 2.880 2.806 3.004 0.004 18 0 "[ . 1 . 2]" 2
39 1 69 GLN O 1 72 GLY H 2.000 . 2.000 2.096 2.070 2.123 0.123 19 0 "[ . 1 . 2]" 2
40 1 69 GLN O 1 72 GLY N 3.000 . 3.000 2.906 2.848 2.976 . 0 0 "[ . 1 . 2]" 2
41 1 72 GLY O 1 76 TYR H 2.000 . 2.000 2.011 1.940 2.069 0.069 6 0 "[ . 1 . 2]" 2
42 1 72 GLY O 1 76 TYR N 3.000 . 3.000 2.919 2.736 2.979 . 0 0 "[ . 1 . 2]" 2
43 1 74 LYS O 1 78 ALA H 2.000 . 2.000 2.033 1.955 2.069 0.069 15 0 "[ . 1 . 2]" 2
44 1 74 LYS O 1 78 ALA N 3.000 . 3.000 2.999 2.889 3.051 0.051 15 0 "[ . 1 . 2]" 2
45 1 75 GLY O 1 79 PHE H 2.000 . 2.000 2.053 2.023 2.079 0.079 20 0 "[ . 1 . 2]" 2
46 1 75 GLY O 1 79 PHE N 3.000 . 3.000 2.905 2.752 2.962 . 0 0 "[ . 1 . 2]" 2
47 1 76 TYR O 1 80 LEU H 2.000 . 2.000 2.023 1.945 2.054 0.054 8 0 "[ . 1 . 2]" 2
48 1 76 TYR O 1 80 LEU N 3.000 . 3.000 2.963 2.795 3.017 0.017 18 0 "[ . 1 . 2]" 2
49 1 77 VAL O 1 81 GLU H 2.000 . 2.000 2.035 1.986 2.075 0.075 3 0 "[ . 1 . 2]" 2
50 1 77 VAL O 1 81 GLU N 3.000 . 3.000 2.981 2.863 3.051 0.051 20 0 "[ . 1 . 2]" 2
51 1 78 ALA O 1 82 SER H 2.000 . 2.000 2.047 2.022 2.079 0.079 16 0 "[ . 1 . 2]" 2
52 1 78 ALA O 1 82 SER N 3.000 . 3.000 2.921 2.802 3.016 0.016 16 0 "[ . 1 . 2]" 2
53 1 79 PHE O 1 83 LEU H 2.000 . 2.000 2.043 2.012 2.104 0.104 20 0 "[ . 1 . 2]" 2
54 1 79 PHE O 1 83 LEU N 3.000 . 3.000 2.990 2.944 3.050 0.050 20 0 "[ . 1 . 2]" 2
55 1 80 LEU O 1 84 GLU H 2.000 . 2.000 2.034 2.008 2.062 0.062 5 0 "[ . 1 . 2]" 2
56 1 80 LEU O 1 84 GLU N 3.000 . 3.000 2.889 2.772 3.007 0.007 5 0 "[ . 1 . 2]" 2
57 1 82 SER O 1 86 TYR H 2.000 . 2.000 2.012 1.928 2.044 0.044 11 0 "[ . 1 . 2]" 2
58 1 82 SER O 1 86 TYR N 3.000 . 3.000 2.960 2.893 3.006 0.006 20 0 "[ . 1 . 2]" 2
59 1 87 TYR O 1 91 TYR H 2.000 . 2.000 1.992 1.934 2.039 0.039 9 0 "[ . 1 . 2]" 2
60 1 87 TYR O 1 91 TYR N 3.000 . 3.000 2.934 2.823 3.007 0.007 9 0 "[ . 1 . 2]" 2
61 1 88 PRO O 1 92 LYS H 2.000 . 2.000 2.063 2.041 2.095 0.095 7 0 "[ . 1 . 2]" 2
62 1 88 PRO O 1 92 LYS N 3.000 . 3.000 3.015 2.967 3.057 0.057 7 0 "[ . 1 . 2]" 2
63 1 89 GLN O 1 93 LYS H 2.000 . 2.000 2.087 2.054 2.128 0.128 9 0 "[ . 1 . 2]" 2
64 1 89 GLN O 1 93 LYS N 3.000 . 3.000 2.956 2.839 3.043 0.043 9 0 "[ . 1 . 2]" 2
65 1 90 LEU O 1 94 VAL H 2.000 . 2.000 2.006 1.963 2.059 0.059 10 0 "[ . 1 . 2]" 2
66 1 90 LEU O 1 94 VAL N 3.000 . 3.000 2.931 2.835 2.971 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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