NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
464219 |
2kvu   |
16792 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kvu
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 1641
_Distance_constraint_stats_list.Viol_count 334
_Distance_constraint_stats_list.Viol_total 225.789
_Distance_constraint_stats_list.Viol_max 0.240
_Distance_constraint_stats_list.Viol_rms 0.0050
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0003
_Distance_constraint_stats_list.Viol_average_violations_only 0.0338
_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 12 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 THR 0.393 0.079 3 0 "[ . 1 . 2]"
1 14 PRO 0.393 0.079 3 0 "[ . 1 . 2]"
1 15 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 LYS 0.173 0.132 13 0 "[ . 1 . 2]"
1 19 PRO 0.103 0.062 19 0 "[ . 1 . 2]"
1 20 GLY 0.036 0.036 15 0 "[ . 1 . 2]"
1 21 ALA 0.269 0.076 11 0 "[ . 1 . 2]"
1 22 LEU 0.730 0.081 11 0 "[ . 1 . 2]"
1 23 PRO 0.061 0.020 16 0 "[ . 1 . 2]"
1 24 ALA 0.165 0.066 8 0 "[ . 1 . 2]"
1 25 ASN 0.310 0.066 8 0 "[ . 1 . 2]"
1 26 LEU 0.220 0.032 16 0 "[ . 1 . 2]"
1 27 ASP 0.009 0.009 18 0 "[ . 1 . 2]"
1 28 ASP 0.107 0.053 19 0 "[ . 1 . 2]"
1 29 MET 0.324 0.070 2 0 "[ . 1 . 2]"
1 30 LYS 2.690 0.240 19 0 "[ . 1 . 2]"
1 31 VAL 0.919 0.131 3 0 "[ . 1 . 2]"
1 32 ALA 0.020 0.011 5 0 "[ . 1 . 2]"
1 33 GLU 1.074 0.115 20 0 "[ . 1 . 2]"
1 34 LEU 0.078 0.032 13 0 "[ . 1 . 2]"
1 35 LYS 0.231 0.029 14 0 "[ . 1 . 2]"
1 36 GLN 0.254 0.053 11 0 "[ . 1 . 2]"
1 37 GLU 0.053 0.023 4 0 "[ . 1 . 2]"
1 38 LEU 3.031 0.139 10 0 "[ . 1 . 2]"
1 39 LYS 0.244 0.053 11 0 "[ . 1 . 2]"
1 40 LEU 0.451 0.036 11 0 "[ . 1 . 2]"
1 41 ARG 0.226 0.068 13 0 "[ . 1 . 2]"
1 42 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 LEU 2.384 0.139 10 0 "[ . 1 . 2]"
1 44 PRO 0.051 0.020 18 0 "[ . 1 . 2]"
1 45 VAL 0.336 0.049 16 0 "[ . 1 . 2]"
1 46 SER 0.149 0.086 13 0 "[ . 1 . 2]"
1 47 GLY 0.149 0.086 13 0 "[ . 1 . 2]"
1 48 THR 0.014 0.013 13 0 "[ . 1 . 2]"
1 49 LYS 0.234 0.039 11 0 "[ . 1 . 2]"
1 50 THR 0.058 0.024 4 0 "[ . 1 . 2]"
1 51 GLU 0.095 0.038 18 0 "[ . 1 . 2]"
1 52 LEU 0.114 0.032 6 0 "[ . 1 . 2]"
1 53 ILE 0.395 0.108 4 0 "[ . 1 . 2]"
1 54 GLU 0.569 0.160 4 0 "[ . 1 . 2]"
1 55 ARG 0.172 0.044 3 0 "[ . 1 . 2]"
1 56 LEU 0.092 0.046 14 0 "[ . 1 . 2]"
1 57 ARG 0.334 0.081 11 0 "[ . 1 . 2]"
1 58 ALA 0.008 0.008 20 0 "[ . 1 . 2]"
1 59 TYR 0.276 0.068 13 0 "[ . 1 . 2]"
1 60 GLN 0.903 0.089 18 0 "[ . 1 . 2]"
1 61 ASP 0.051 0.032 15 0 "[ . 1 . 2]"
1 62 GLN 0.036 0.018 13 0 "[ . 1 . 2]"
1 63 ILE 0.322 0.076 11 0 "[ . 1 . 2]"
1 64 SER 0.133 0.048 1 0 "[ . 1 . 2]"
1 65 PRO 0.163 0.048 1 0 "[ . 1 . 2]"
1 66 VAL 0.445 0.076 12 0 "[ . 1 . 2]"
1 67 PRO 0.320 0.076 12 0 "[ . 1 . 2]"
1 68 GLY 0.061 0.061 19 0 "[ . 1 . 2]"
1 69 ALA 0.185 0.061 19 0 "[ . 1 . 2]"
1 70 PRO 0.078 0.049 5 0 "[ . 1 . 2]"
1 71 LYS 0.028 0.028 13 0 "[ . 1 . 2]"
1 72 ALA 0.105 0.031 3 0 "[ . 1 . 2]"
1 73 PRO 0.105 0.031 3 0 "[ . 1 . 2]"
1 74 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 12 SER HB2 1 13 THR H 6.000 . 6.900 3.973 2.299 4.604 . 0 0 "[ . 1 . 2]" 1
2 1 14 PRO HA 1 15 LEU H 2.870 . 3.300 2.210 2.109 2.368 . 0 0 "[ . 1 . 2]" 1
3 1 15 LEU H 1 15 LEU MD1 4.970 . 5.720 4.049 2.147 4.380 . 0 0 "[ . 1 . 2]" 1
4 1 15 LEU H 1 15 LEU MD2 4.970 . 5.720 4.026 2.059 4.753 . 0 0 "[ . 1 . 2]" 1
5 1 15 LEU H 1 16 THR H 4.680 . 5.380 3.818 2.259 4.604 . 0 0 "[ . 1 . 2]" 1
6 1 15 LEU HA 1 16 THR H 3.470 . 3.990 2.512 2.129 3.561 . 0 0 "[ . 1 . 2]" 1
7 1 15 LEU HB2 1 16 THR H 5.040 . 5.800 4.052 2.816 4.629 . 0 0 "[ . 1 . 2]" 1
8 1 15 LEU HG 1 16 THR H 5.660 . 6.510 4.207 2.245 5.216 . 0 0 "[ . 1 . 2]" 1
9 1 15 LEU HB3 1 16 THR H 5.040 . 5.800 3.849 2.136 4.457 . 0 0 "[ . 1 . 2]" 1
10 1 16 THR H 1 16 THR MG 4.380 . 5.040 3.086 2.056 3.971 . 0 0 "[ . 1 . 2]" 1
11 1 16 THR H 1 17 GLY H 5.600 . 6.440 3.930 2.373 4.598 . 0 0 "[ . 1 . 2]" 1
12 1 17 GLY H 1 18 LYS H 5.340 . 6.140 3.570 2.016 4.520 . 0 0 "[ . 1 . 2]" 1
13 1 18 LYS H 1 18 LYS HB2 4.180 . 4.810 3.031 2.333 3.990 . 0 0 "[ . 1 . 2]" 1
14 1 18 LYS H 1 18 LYS HG2 4.490 . 5.160 3.503 2.352 4.626 . 0 0 "[ . 1 . 2]" 1
15 1 18 LYS H 1 18 LYS HG3 4.490 . 5.160 3.500 2.438 4.687 . 0 0 "[ . 1 . 2]" 1
16 1 18 LYS H 1 18 LYS HB3 4.180 . 4.810 3.667 2.636 4.138 . 0 0 "[ . 1 . 2]" 1
17 1 19 PRO HA 1 20 GLY H 3.070 . 3.530 2.323 2.125 3.356 . 0 0 "[ . 1 . 2]" 1
18 1 19 PRO HB2 1 20 GLY H 4.680 . 5.380 3.520 1.995 4.325 . 0 0 "[ . 1 . 2]" 1
19 1 19 PRO HB3 1 20 GLY H 4.680 . 5.380 3.729 2.728 4.452 . 0 0 "[ . 1 . 2]" 1
20 1 20 GLY H 1 21 ALA H 4.200 . 4.830 2.606 1.852 4.001 . 0 0 "[ . 1 . 2]" 1
21 1 21 ALA H 1 21 ALA MB 2.900 . 3.340 2.474 2.227 2.764 . 0 0 "[ . 1 . 2]" 1
22 1 21 ALA H 1 22 LEU H 4.610 . 5.300 4.411 4.238 4.604 . 0 0 "[ . 1 . 2]" 1
23 1 21 ALA HA 1 22 LEU H 2.810 . 3.230 2.548 2.171 2.832 . 0 0 "[ . 1 . 2]" 1
24 1 21 ALA MB 1 22 LEU H 3.070 . 3.530 2.185 1.810 2.943 . 0 0 "[ . 1 . 2]" 1
25 1 22 LEU H 1 22 LEU HB2 3.190 . 3.670 2.572 2.433 2.689 . 0 0 "[ . 1 . 2]" 1
26 1 22 LEU H 1 22 LEU HB3 3.720 . 4.280 3.717 3.621 3.794 . 0 0 "[ . 1 . 2]" 1
27 1 22 LEU H 1 22 LEU HG 3.340 . 3.840 2.884 2.369 3.371 . 0 0 "[ . 1 . 2]" 1
28 1 22 LEU H 1 22 LEU MD2 3.660 . 4.210 3.717 3.376 4.041 . 0 0 "[ . 1 . 2]" 1
29 1 22 LEU H 1 22 LEU MD1 3.730 . 4.290 3.958 3.671 4.212 . 0 0 "[ . 1 . 2]" 1
30 1 23 PRO HA 1 24 ALA H 2.780 . 3.200 2.285 2.148 2.653 . 0 0 "[ . 1 . 2]" 1
31 1 23 PRO HB3 1 24 ALA H 3.860 . 4.440 3.706 3.221 4.037 . 0 0 "[ . 1 . 2]" 1
32 1 23 PRO HB2 1 24 ALA H 3.860 . 4.440 3.062 2.109 3.609 . 0 0 "[ . 1 . 2]" 1
33 1 24 ALA H 1 24 ALA MB 2.770 . 3.190 2.262 2.225 2.308 . 0 0 "[ . 1 . 2]" 1
34 1 24 ALA H 1 25 ASN H 3.450 . 3.970 2.613 2.285 2.853 . 0 0 "[ . 1 . 2]" 1
35 1 24 ALA MB 1 25 ASN H 3.130 . 3.600 3.114 2.417 3.526 . 0 0 "[ . 1 . 2]" 1
36 1 25 ASN H 1 25 ASN HB2 3.100 . 3.570 2.482 2.332 2.686 . 0 0 "[ . 1 . 2]" 1
37 1 25 ASN H 1 26 LEU H 3.810 . 4.380 3.105 2.467 4.071 . 0 0 "[ . 1 . 2]" 1
38 1 25 ASN HA 1 25 ASN HD21 4.640 . 5.340 2.955 1.785 4.151 0.015 1 0 "[ . 1 . 2]" 1
39 1 25 ASN HA 1 25 ASN HD22 4.640 . 5.340 3.868 3.240 4.521 . 0 0 "[ . 1 . 2]" 1
40 1 25 ASN HA 1 26 LEU H 3.050 . 3.510 2.719 2.189 3.095 . 0 0 "[ . 1 . 2]" 1
41 1 25 ASN HB2 1 26 LEU H 4.840 . 5.570 4.282 3.871 4.562 . 0 0 "[ . 1 . 2]" 1
42 1 25 ASN HB3 1 26 LEU H 5.230 . 6.010 4.322 3.902 4.481 . 0 0 "[ . 1 . 2]" 1
43 1 26 LEU H 1 26 LEU HB3 3.600 . 4.140 3.596 3.585 3.632 . 0 0 "[ . 1 . 2]" 1
44 1 26 LEU H 1 26 LEU HB2 3.080 . 3.540 2.446 2.352 2.482 . 0 0 "[ . 1 . 2]" 1
45 1 26 LEU H 1 26 LEU HG 3.170 . 3.650 2.420 2.252 2.857 . 0 0 "[ . 1 . 2]" 1
46 1 26 LEU H 1 26 LEU MD1 3.940 . 4.530 3.662 3.550 3.869 . 0 0 "[ . 1 . 2]" 1
47 1 26 LEU H 1 26 LEU MD2 3.800 . 4.370 3.432 3.293 3.774 . 0 0 "[ . 1 . 2]" 1
48 1 26 LEU H 1 27 ASP H 3.430 . 3.940 2.593 2.100 2.935 . 0 0 "[ . 1 . 2]" 1
49 1 26 LEU HB3 1 27 ASP H 3.900 . 4.490 3.721 3.433 3.969 . 0 0 "[ . 1 . 2]" 1
50 1 26 LEU HB2 1 27 ASP H 3.660 . 4.210 2.804 2.519 3.168 . 0 0 "[ . 1 . 2]" 1
51 1 26 LEU HG 1 27 ASP H 4.700 . 5.400 4.479 4.346 4.701 . 0 0 "[ . 1 . 2]" 1
52 1 26 LEU MD1 1 27 ASP H 4.920 . 5.660 4.674 4.400 4.985 . 0 0 "[ . 1 . 2]" 1
53 1 27 ASP H 1 53 ILE MG 4.770 . 5.490 4.081 3.476 4.587 . 0 0 "[ . 1 . 2]" 1
54 1 27 ASP H 1 53 ILE MD 5.180 . 5.960 3.663 3.300 4.213 . 0 0 "[ . 1 . 2]" 1
55 1 27 ASP H 1 27 ASP HB2 3.500 . 4.030 2.754 2.379 3.644 . 0 0 "[ . 1 . 2]" 1
56 1 27 ASP H 1 27 ASP HB3 3.500 . 4.030 2.794 2.433 3.599 . 0 0 "[ . 1 . 2]" 1
57 1 27 ASP H 1 28 ASP H 3.260 . 3.750 2.433 2.227 2.626 . 0 0 "[ . 1 . 2]" 1
58 1 28 ASP H 1 28 ASP HB2 3.100 . 3.570 2.533 2.254 2.862 . 0 0 "[ . 1 . 2]" 1
59 1 28 ASP H 1 28 ASP HB3 3.570 . 4.110 2.982 2.367 3.613 . 0 0 "[ . 1 . 2]" 1
60 1 28 ASP H 1 29 MET H 3.040 . 3.500 2.377 2.262 2.508 . 0 0 "[ . 1 . 2]" 1
61 1 28 ASP HB2 1 29 MET H 4.040 . 4.650 3.659 2.900 4.165 . 0 0 "[ . 1 . 2]" 1
62 1 25 ASN HB3 1 29 MET H 4.750 . 5.460 4.148 3.054 4.738 . 0 0 "[ . 1 . 2]" 1
63 1 29 MET H 1 29 MET HB2 3.770 . 4.340 2.446 2.365 2.522 . 0 0 "[ . 1 . 2]" 1
64 1 29 MET H 1 29 MET HB3 3.770 . 4.340 3.603 3.567 3.647 . 0 0 "[ . 1 . 2]" 1
65 1 29 MET H 1 29 MET HG2 4.050 . 4.660 3.354 2.242 3.872 . 0 0 "[ . 1 . 2]" 1
66 1 29 MET H 1 29 MET HG3 4.050 . 4.660 2.655 2.169 3.696 . 0 0 "[ . 1 . 2]" 1
67 1 29 MET H 1 29 MET ME 4.800 . 5.520 4.525 3.560 4.883 . 0 0 "[ . 1 . 2]" 1
68 1 29 MET H 1 30 LYS H 4.690 . 5.390 4.591 4.516 4.635 . 0 0 "[ . 1 . 2]" 1
69 1 29 MET HA 1 30 LYS H 2.890 . 3.320 2.326 2.185 2.525 . 0 0 "[ . 1 . 2]" 1
70 1 29 MET HB3 1 30 LYS H 4.110 . 4.730 2.626 2.191 2.936 . 0 0 "[ . 1 . 2]" 1
71 1 29 MET ME 1 30 LYS H 4.850 . 5.580 4.114 3.143 5.018 . 0 0 "[ . 1 . 2]" 1
72 1 30 LYS H 1 30 LYS HB2 3.230 . 3.710 2.544 2.347 2.714 . 0 0 "[ . 1 . 2]" 1
73 1 30 LYS H 1 30 LYS HB3 4.100 . 4.720 3.619 3.571 3.676 . 0 0 "[ . 1 . 2]" 1
74 1 30 LYS HB3 1 32 ALA H 4.230 . 4.860 2.988 2.508 3.363 . 0 0 "[ . 1 . 2]" 1
75 1 30 LYS H 1 30 LYS HG2 4.050 . 4.660 3.589 3.132 4.428 . 0 0 "[ . 1 . 2]" 1
76 1 30 LYS H 1 30 LYS HG3 3.170 . 3.650 2.468 1.831 3.665 0.015 2 0 "[ . 1 . 2]" 1
77 1 30 LYS HA 1 31 VAL H 3.200 . 3.680 2.457 2.325 2.560 . 0 0 "[ . 1 . 2]" 1
78 1 30 LYS HB2 1 31 VAL H 4.190 . 4.820 3.395 3.028 3.693 . 0 0 "[ . 1 . 2]" 1
79 1 30 LYS HB3 1 31 VAL H 3.610 . 4.150 2.319 2.058 2.645 . 0 0 "[ . 1 . 2]" 1
80 1 30 LYS HG2 1 31 VAL H 4.630 . 5.320 4.215 3.788 4.615 . 0 0 "[ . 1 . 2]" 1
81 1 30 LYS HG3 1 31 VAL H 4.760 . 5.470 4.641 3.872 4.966 . 0 0 "[ . 1 . 2]" 1
82 1 30 LYS HE2 1 31 VAL H 6.000 . 6.900 6.792 5.974 7.031 0.131 3 0 "[ . 1 . 2]" 1
83 1 30 LYS HE3 1 31 VAL H 6.000 . 6.900 6.181 4.333 6.942 0.042 18 0 "[ . 1 . 2]" 1
84 1 31 VAL H 1 31 VAL HB 3.210 . 3.690 2.578 2.495 2.640 . 0 0 "[ . 1 . 2]" 1
85 1 31 VAL H 1 31 VAL MG1 4.130 . 4.750 3.770 3.760 3.784 . 0 0 "[ . 1 . 2]" 1
86 1 31 VAL H 1 31 VAL MG2 3.210 . 3.690 2.002 1.895 2.142 . 0 0 "[ . 1 . 2]" 1
87 1 31 VAL H 1 32 ALA H 3.660 . 4.210 2.680 2.514 2.833 . 0 0 "[ . 1 . 2]" 1
88 1 31 VAL H 1 33 GLU H 5.380 . 6.190 4.109 3.857 4.742 . 0 0 "[ . 1 . 2]" 1
89 1 29 MET HB2 1 30 LYS H 4.110 . 4.730 3.780 3.428 4.026 . 0 0 "[ . 1 . 2]" 1
90 1 31 VAL HB 1 32 ALA H 3.730 . 4.290 2.577 2.415 2.936 . 0 0 "[ . 1 . 2]" 1
91 1 31 VAL MG1 1 32 ALA H 3.810 . 4.380 3.480 3.295 3.714 . 0 0 "[ . 1 . 2]" 1
92 1 31 VAL MG2 1 32 ALA H 4.100 . 4.720 3.761 3.625 3.903 . 0 0 "[ . 1 . 2]" 1
93 1 32 ALA H 1 32 ALA MB 2.740 . 3.150 2.236 2.213 2.260 . 0 0 "[ . 1 . 2]" 1
94 1 32 ALA H 1 33 GLU H 3.430 . 3.940 2.666 2.531 2.882 . 0 0 "[ . 1 . 2]" 1
95 1 30 LYS H 1 34 LEU H 5.850 . 6.730 4.453 4.091 4.781 . 0 0 "[ . 1 . 2]" 1
96 1 32 ALA H 1 34 LEU H 6.000 . 6.900 4.190 3.920 4.323 . 0 0 "[ . 1 . 2]" 1
97 1 32 ALA MB 1 33 GLU H 3.430 . 3.940 2.589 2.177 2.884 . 0 0 "[ . 1 . 2]" 1
98 1 33 GLU H 1 33 GLU HB3 3.630 . 4.170 3.533 2.982 3.610 . 0 0 "[ . 1 . 2]" 1
99 1 33 GLU H 1 33 GLU HB2 3.240 . 3.730 2.678 2.422 3.548 . 0 0 "[ . 1 . 2]" 1
100 1 33 GLU H 1 33 GLU HG2 3.510 . 4.040 2.113 1.793 2.428 0.007 15 0 "[ . 1 . 2]" 1
101 1 33 GLU H 1 33 GLU HG3 3.510 . 4.040 3.573 3.381 3.792 . 0 0 "[ . 1 . 2]" 1
102 1 33 GLU H 1 34 LEU H 3.350 . 3.850 2.637 2.421 2.805 . 0 0 "[ . 1 . 2]" 1
103 1 32 ALA HA 1 34 LEU H 5.090 . 5.850 4.426 4.339 4.553 . 0 0 "[ . 1 . 2]" 1
104 1 33 GLU HB3 1 34 LEU H 4.160 . 4.780 3.750 3.379 4.317 . 0 0 "[ . 1 . 2]" 1
105 1 33 GLU HB2 1 34 LEU H 4.070 . 4.680 2.661 2.361 3.585 . 0 0 "[ . 1 . 2]" 1
106 1 34 LEU H 1 36 GLN HB2 5.680 . 6.530 5.065 4.803 5.523 . 0 0 "[ . 1 . 2]" 1
107 1 34 LEU H 1 34 LEU HB2 4.060 . 4.670 2.493 2.419 2.548 . 0 0 "[ . 1 . 2]" 1
108 1 34 LEU H 1 34 LEU HB3 4.060 . 4.670 3.588 3.578 3.603 . 0 0 "[ . 1 . 2]" 1
109 1 34 LEU H 1 34 LEU HG 3.550 . 4.080 2.253 2.134 2.500 . 0 0 "[ . 1 . 2]" 1
110 1 34 LEU H 1 34 LEU MD1 3.900 . 4.490 3.591 3.511 3.740 . 0 0 "[ . 1 . 2]" 1
111 1 31 VAL HA 1 35 LYS H 4.610 . 5.300 4.286 4.131 4.440 . 0 0 "[ . 1 . 2]" 1
112 1 32 ALA HA 1 35 LYS H 3.950 . 4.540 3.428 3.228 3.637 . 0 0 "[ . 1 . 2]" 1
113 1 33 GLU H 1 35 LYS H 4.730 . 5.440 4.067 3.910 4.318 . 0 0 "[ . 1 . 2]" 1
114 1 33 GLU HA 1 35 LYS H 4.930 . 5.670 4.371 4.205 4.545 . 0 0 "[ . 1 . 2]" 1
115 1 34 LEU H 1 35 LYS H 3.600 . 4.140 2.647 2.552 2.733 . 0 0 "[ . 1 . 2]" 1
116 1 34 LEU HB2 1 35 LYS H 3.900 . 4.490 2.597 2.489 2.885 . 0 0 "[ . 1 . 2]" 1
117 1 34 LEU HB3 1 35 LYS H 3.900 . 4.490 3.638 3.487 3.845 . 0 0 "[ . 1 . 2]" 1
118 1 34 LEU HG 1 35 LYS H 4.970 . 5.720 4.305 4.168 4.488 . 0 0 "[ . 1 . 2]" 1
119 1 35 LYS H 1 35 LYS HD3 5.340 . 6.140 4.834 4.711 4.920 . 0 0 "[ . 1 . 2]" 1
120 1 34 LEU MD1 1 35 LYS H 4.180 . 4.810 4.479 4.354 4.724 . 0 0 "[ . 1 . 2]" 1
121 1 35 LYS H 1 35 LYS HB2 2.950 . 3.390 2.417 2.344 2.473 . 0 0 "[ . 1 . 2]" 1
122 1 35 LYS H 1 35 LYS HG3 3.380 . 3.890 2.394 2.237 2.594 . 0 0 "[ . 1 . 2]" 1
123 1 35 LYS H 1 35 LYS HG2 3.720 . 4.280 3.533 3.383 3.674 . 0 0 "[ . 1 . 2]" 1
124 1 35 LYS H 1 35 LYS HD2 4.230 . 4.860 4.100 3.887 4.265 . 0 0 "[ . 1 . 2]" 1
125 1 35 LYS H 1 35 LYS HE3 6.000 . 6.900 4.843 4.610 5.100 . 0 0 "[ . 1 . 2]" 1
126 1 35 LYS H 1 35 LYS HE2 6.000 . 6.900 5.444 5.288 5.667 . 0 0 "[ . 1 . 2]" 1
127 1 32 ALA HA 1 36 GLN H 4.600 . 5.290 4.389 3.995 4.991 . 0 0 "[ . 1 . 2]" 1
128 1 34 LEU HA 1 36 GLN H 5.350 . 6.150 4.162 3.996 4.460 . 0 0 "[ . 1 . 2]" 1
129 1 35 LYS H 1 36 GLN H 3.380 . 3.890 2.643 2.502 2.744 . 0 0 "[ . 1 . 2]" 1
130 1 35 LYS HB2 1 36 GLN H 3.400 . 3.910 2.881 2.628 3.098 . 0 0 "[ . 1 . 2]" 1
131 1 35 LYS HG2 1 36 GLN H 5.230 . 6.010 5.094 5.031 5.167 . 0 0 "[ . 1 . 2]" 1
132 1 36 GLN H 1 36 GLN HB2 3.120 . 3.590 2.405 2.272 2.519 . 0 0 "[ . 1 . 2]" 1
133 1 36 GLN H 1 36 GLN HB3 3.460 . 3.980 3.585 3.546 3.604 . 0 0 "[ . 1 . 2]" 1
134 1 36 GLN H 1 36 GLN HG3 4.390 . 5.050 3.713 3.590 3.901 . 0 0 "[ . 1 . 2]" 1
135 1 36 GLN H 1 37 GLU H 3.290 . 3.780 2.724 2.578 2.851 . 0 0 "[ . 1 . 2]" 1
136 1 34 LEU H 1 36 GLN H 4.590 . 5.280 4.030 3.853 4.308 . 0 0 "[ . 1 . 2]" 1
137 1 36 GLN H 1 38 LEU H 4.940 . 5.680 3.964 3.826 4.105 . 0 0 "[ . 1 . 2]" 1
138 1 36 GLN HA 1 36 GLN HE21 5.140 . 5.910 2.963 2.543 4.143 . 0 0 "[ . 1 . 2]" 1
139 1 36 GLN HA 1 36 GLN HE22 5.140 . 5.910 3.483 3.199 4.132 . 0 0 "[ . 1 . 2]" 1
140 1 36 GLN HE22 1 36 GLN HG3 3.800 . 4.370 3.731 3.493 3.794 . 0 0 "[ . 1 . 2]" 1
141 1 34 LEU HA 1 37 GLU H 4.130 . 4.750 3.473 3.237 3.799 . 0 0 "[ . 1 . 2]" 1
142 1 35 LYS H 1 37 GLU H 5.060 . 5.820 4.345 4.077 4.694 . 0 0 "[ . 1 . 2]" 1
143 1 35 LYS HA 1 37 GLU H 5.590 . 6.430 4.405 4.059 4.636 . 0 0 "[ . 1 . 2]" 1
144 1 36 GLN HB2 1 37 GLU H 3.830 . 4.400 2.554 2.416 2.768 . 0 0 "[ . 1 . 2]" 1
145 1 36 GLN HB3 1 37 GLU H 3.730 . 4.290 3.431 3.078 3.577 . 0 0 "[ . 1 . 2]" 1
146 1 36 GLN HG2 1 37 GLU H 5.090 . 5.850 4.418 4.205 4.683 . 0 0 "[ . 1 . 2]" 1
147 1 37 GLU H 1 37 GLU HB3 3.790 . 4.360 3.581 3.554 3.611 . 0 0 "[ . 1 . 2]" 1
148 1 37 GLU H 1 37 GLU HB2 3.790 . 4.360 2.404 2.295 2.511 . 0 0 "[ . 1 . 2]" 1
149 1 37 GLU H 1 37 GLU HG2 3.850 . 4.430 2.590 2.140 3.573 . 0 0 "[ . 1 . 2]" 1
150 1 37 GLU H 1 37 GLU HG3 3.850 . 4.430 3.480 2.247 3.855 . 0 0 "[ . 1 . 2]" 1
151 1 37 GLU H 1 38 LEU H 3.440 . 3.960 2.608 2.457 2.731 . 0 0 "[ . 1 . 2]" 1
152 1 37 GLU H 1 39 LYS H 5.260 . 6.050 4.441 4.333 4.619 . 0 0 "[ . 1 . 2]" 1
153 1 34 LEU HA 1 38 LEU H 5.080 . 5.840 4.357 4.085 4.530 . 0 0 "[ . 1 . 2]" 1
154 1 35 LYS HA 1 38 LEU H 4.060 . 4.670 3.202 2.907 3.437 . 0 0 "[ . 1 . 2]" 1
155 1 36 GLN HA 1 38 LEU H 4.930 . 5.670 4.345 4.096 4.649 . 0 0 "[ . 1 . 2]" 1
156 1 37 GLU HB2 1 38 LEU H 3.910 . 4.500 2.757 2.539 3.049 . 0 0 "[ . 1 . 2]" 1
157 1 37 GLU HB3 1 38 LEU H 3.910 . 4.500 3.645 3.248 3.885 . 0 0 "[ . 1 . 2]" 1
158 1 38 LEU H 1 38 LEU HB2 3.660 . 4.210 2.424 2.340 2.525 . 0 0 "[ . 1 . 2]" 1
159 1 38 LEU H 1 38 LEU HB3 3.670 . 4.220 3.580 3.557 3.595 . 0 0 "[ . 1 . 2]" 1
160 1 38 LEU H 1 38 LEU HG 3.310 . 3.810 2.393 2.180 2.555 . 0 0 "[ . 1 . 2]" 1
161 1 38 LEU H 1 38 LEU MD2 4.270 . 4.910 3.566 3.230 3.721 . 0 0 "[ . 1 . 2]" 1
162 1 38 LEU H 1 56 LEU MD1 4.670 . 5.370 4.082 3.821 4.399 . 0 0 "[ . 1 . 2]" 1
163 1 38 LEU H 1 38 LEU MD1 3.890 . 4.470 3.507 3.426 3.576 . 0 0 "[ . 1 . 2]" 1
164 1 38 LEU H 1 39 LYS H 3.400 . 3.910 2.786 2.563 2.948 . 0 0 "[ . 1 . 2]" 1
165 1 38 LEU H 1 40 LEU H 4.890 . 5.620 4.041 3.890 4.167 . 0 0 "[ . 1 . 2]" 1
166 1 36 GLN HA 1 39 LYS H 3.960 . 4.550 3.695 3.507 3.978 . 0 0 "[ . 1 . 2]" 1
167 1 37 GLU HA 1 39 LYS H 5.180 . 5.960 4.750 4.596 4.911 . 0 0 "[ . 1 . 2]" 1
168 1 38 LEU HB2 1 39 LYS H 3.870 . 4.450 2.395 2.334 2.490 . 0 0 "[ . 1 . 2]" 1
169 1 38 LEU HB3 1 39 LYS H 3.170 . 3.650 3.330 3.112 3.514 . 0 0 "[ . 1 . 2]" 1
170 1 38 LEU HG 1 39 LYS H 4.610 . 5.300 4.395 4.283 4.485 . 0 0 "[ . 1 . 2]" 1
171 1 38 LEU MD2 1 39 LYS H 4.780 . 5.500 4.663 4.607 4.723 . 0 0 "[ . 1 . 2]" 1
172 1 38 LEU MD1 1 39 LYS H 4.870 . 5.600 4.260 4.192 4.374 . 0 0 "[ . 1 . 2]" 1
173 1 39 LYS H 1 39 LYS HB3 3.000 . 3.450 2.563 2.487 2.686 . 0 0 "[ . 1 . 2]" 1
174 1 39 LYS H 1 39 LYS HG2 3.950 . 4.540 2.147 2.048 2.299 . 0 0 "[ . 1 . 2]" 1
175 1 39 LYS H 1 39 LYS HG3 3.930 . 4.520 3.393 2.768 3.554 . 0 0 "[ . 1 . 2]" 1
176 1 39 LYS H 1 39 LYS HD2 6.000 . 6.900 4.141 3.673 4.712 . 0 0 "[ . 1 . 2]" 1
177 1 39 LYS H 1 39 LYS HD3 6.000 . 6.900 4.574 4.279 4.793 . 0 0 "[ . 1 . 2]" 1
178 1 37 GLU HA 1 40 LEU H 3.890 . 4.470 3.734 3.397 3.992 . 0 0 "[ . 1 . 2]" 1
179 1 39 LYS H 1 40 LEU H 3.470 . 3.990 2.652 2.574 2.707 . 0 0 "[ . 1 . 2]" 1
180 1 39 LYS HA 1 40 LEU H 3.560 . 4.090 3.482 3.433 3.517 . 0 0 "[ . 1 . 2]" 1
181 1 39 LYS HG3 1 40 LEU H 4.680 . 5.380 2.775 2.124 3.204 . 0 0 "[ . 1 . 2]" 1
182 1 39 LYS HD2 1 40 LEU H 5.840 . 6.720 4.926 4.592 5.174 . 0 0 "[ . 1 . 2]" 1
183 1 39 LYS HD3 1 40 LEU H 5.840 . 6.720 4.905 4.306 5.170 . 0 0 "[ . 1 . 2]" 1
184 1 39 LYS HG2 1 40 LEU H 3.470 . 3.990 2.769 2.569 3.336 . 0 0 "[ . 1 . 2]" 1
185 1 40 LEU H 1 40 LEU HB2 2.890 . 3.320 2.399 2.278 2.431 . 0 0 "[ . 1 . 2]" 1
186 1 37 GLU HA 1 41 ARG H 4.880 . 5.610 4.582 3.934 5.168 . 0 0 "[ . 1 . 2]" 1
187 1 38 LEU HA 1 41 ARG H 4.500 . 5.180 3.656 3.411 3.881 . 0 0 "[ . 1 . 2]" 1
188 1 39 LYS H 1 41 ARG H 5.420 . 6.230 4.085 4.008 4.177 . 0 0 "[ . 1 . 2]" 1
189 1 39 LYS HA 1 41 ARG H 4.120 . 4.740 3.964 3.508 4.477 . 0 0 "[ . 1 . 2]" 1
190 1 40 LEU H 1 41 ARG H 3.460 . 3.980 2.446 2.310 2.596 . 0 0 "[ . 1 . 2]" 1
191 1 40 LEU HB3 1 41 ARG H 3.580 . 4.120 3.941 3.731 4.135 0.015 18 0 "[ . 1 . 2]" 1
192 1 40 LEU HB2 1 41 ARG H 3.910 . 4.500 3.117 2.799 3.364 . 0 0 "[ . 1 . 2]" 1
193 1 40 LEU MD1 1 41 ARG H 5.150 . 5.920 4.943 4.713 5.132 . 0 0 "[ . 1 . 2]" 1
194 1 40 LEU MD2 1 41 ARG H 5.470 . 6.290 4.700 4.652 4.744 . 0 0 "[ . 1 . 2]" 1
195 1 41 ARG H 1 41 ARG HB3 3.720 . 4.280 3.700 3.658 3.756 . 0 0 "[ . 1 . 2]" 1
196 1 41 ARG H 1 41 ARG HB2 3.570 . 4.110 2.539 2.449 2.631 . 0 0 "[ . 1 . 2]" 1
197 1 41 ARG H 1 41 ARG HG2 4.340 . 4.990 3.921 3.560 4.308 . 0 0 "[ . 1 . 2]" 1
198 1 41 ARG H 1 41 ARG HG3 4.340 . 4.990 2.807 2.357 3.310 . 0 0 "[ . 1 . 2]" 1
199 1 38 LEU HA 1 42 SER H 6.000 . 6.900 5.129 4.626 5.489 . 0 0 "[ . 1 . 2]" 1
200 1 39 LYS HA 1 42 SER H 4.200 . 4.830 3.700 3.206 4.348 . 0 0 "[ . 1 . 2]" 1
201 1 40 LEU H 1 42 SER H 4.220 . 4.850 4.061 3.839 4.309 . 0 0 "[ . 1 . 2]" 1
202 1 40 LEU HA 1 42 SER H 3.970 . 4.570 3.797 3.652 3.975 . 0 0 "[ . 1 . 2]" 1
203 1 41 ARG H 1 42 SER H 3.140 . 3.610 2.415 2.189 2.774 . 0 0 "[ . 1 . 2]" 1
204 1 41 ARG HB3 1 42 SER H 4.610 . 5.300 4.399 4.273 4.506 . 0 0 "[ . 1 . 2]" 1
205 1 41 ARG HB2 1 42 SER H 4.350 . 5.000 3.893 3.759 4.135 . 0 0 "[ . 1 . 2]" 1
206 1 42 SER H 1 42 SER HA 2.710 . 3.120 2.267 2.257 2.279 . 0 0 "[ . 1 . 2]" 1
207 1 41 ARG HA 1 42 SER H 3.450 . 3.970 3.064 2.903 3.144 . 0 0 "[ . 1 . 2]" 1
208 1 42 SER H 1 43 LEU H 3.420 . 3.930 2.696 2.542 3.035 . 0 0 "[ . 1 . 2]" 1
209 1 42 SER HA 1 43 LEU H 3.410 . 3.920 2.790 2.354 3.059 . 0 0 "[ . 1 . 2]" 1
210 1 39 LYS HA 1 43 LEU H 3.680 . 4.230 3.234 2.096 3.737 . 0 0 "[ . 1 . 2]" 1
211 1 42 SER HB3 1 43 LEU H 4.820 . 5.540 4.311 3.939 4.501 . 0 0 "[ . 1 . 2]" 1
212 1 43 LEU H 1 43 LEU HB3 3.980 . 4.580 3.641 3.539 3.792 . 0 0 "[ . 1 . 2]" 1
213 1 43 LEU H 1 43 LEU HB2 3.430 . 3.940 2.439 2.281 2.701 . 0 0 "[ . 1 . 2]" 1
214 1 43 LEU H 1 43 LEU HG 3.820 . 4.390 3.126 2.724 3.701 . 0 0 "[ . 1 . 2]" 1
215 1 43 LEU H 1 43 LEU MD1 4.310 . 4.960 3.747 3.395 4.200 . 0 0 "[ . 1 . 2]" 1
216 1 43 LEU H 1 43 LEU MD2 4.630 . 5.320 4.117 3.923 4.376 . 0 0 "[ . 1 . 2]" 1
217 1 44 PRO HA 1 45 VAL H 2.750 . 3.160 2.174 2.130 2.268 . 0 0 "[ . 1 . 2]" 1
218 1 44 PRO HB2 1 45 VAL H 4.210 . 4.840 3.640 3.226 4.073 . 0 0 "[ . 1 . 2]" 1
219 1 45 VAL H 1 45 VAL HB 3.770 . 4.340 3.688 3.645 3.738 . 0 0 "[ . 1 . 2]" 1
220 1 45 VAL H 1 45 VAL MG2 2.900 . 3.340 1.972 1.890 2.059 . 0 0 "[ . 1 . 2]" 1
221 1 45 VAL H 1 45 VAL MG1 3.390 . 3.900 2.509 2.315 2.685 . 0 0 "[ . 1 . 2]" 1
222 1 45 VAL H 1 46 SER H 3.180 . 3.660 2.406 2.088 2.856 . 0 0 "[ . 1 . 2]" 1
223 1 45 VAL HA 1 46 SER H 3.350 . 3.850 3.229 3.030 3.427 . 0 0 "[ . 1 . 2]" 1
224 1 44 PRO HB3 1 46 SER H 4.240 . 4.880 3.747 3.294 4.111 . 0 0 "[ . 1 . 2]" 1
225 1 45 VAL MG2 1 46 SER H 3.670 . 4.220 3.057 2.582 3.466 . 0 0 "[ . 1 . 2]" 1
226 1 45 VAL MG1 1 46 SER H 4.670 . 5.370 4.201 4.066 4.330 . 0 0 "[ . 1 . 2]" 1
227 1 46 SER H 1 46 SER HB2 3.590 . 4.130 2.837 2.487 3.577 . 0 0 "[ . 1 . 2]" 1
228 1 46 SER H 1 46 SER HB3 3.590 . 4.130 3.124 2.463 3.680 . 0 0 "[ . 1 . 2]" 1
229 1 46 SER H 1 47 GLY H 4.980 . 5.730 4.483 4.181 4.640 . 0 0 "[ . 1 . 2]" 1
230 1 46 SER HA 1 47 GLY H 2.910 . 3.350 2.196 2.133 2.389 . 0 0 "[ . 1 . 2]" 1
231 1 46 SER HB2 1 47 GLY H 3.870 . 4.450 3.961 3.171 4.396 . 0 0 "[ . 1 . 2]" 1
232 1 46 SER HB3 1 47 GLY H 3.870 . 4.450 3.719 2.625 4.383 . 0 0 "[ . 1 . 2]" 1
233 1 47 GLY H 1 48 THR H 4.780 . 5.500 4.377 4.254 4.493 . 0 0 "[ . 1 . 2]" 1
234 1 47 GLY HA2 1 48 THR H 3.360 . 3.860 2.547 2.349 2.746 . 0 0 "[ . 1 . 2]" 1
235 1 47 GLY HA3 1 48 THR H 3.360 . 3.860 2.579 2.364 2.810 . 0 0 "[ . 1 . 2]" 1
236 1 48 THR H 1 48 THR MG 3.070 . 3.530 2.571 2.309 2.955 . 0 0 "[ . 1 . 2]" 1
237 1 48 THR H 1 49 LYS H 5.470 . 6.290 4.543 4.458 4.628 . 0 0 "[ . 1 . 2]" 1
238 1 48 THR HA 1 49 LYS H 3.240 . 3.730 2.513 2.368 2.678 . 0 0 "[ . 1 . 2]" 1
239 1 48 THR HB 1 49 LYS H 3.410 . 3.920 2.213 1.906 2.515 . 0 0 "[ . 1 . 2]" 1
240 1 49 LYS H 1 49 LYS HB2 3.410 . 3.920 2.496 2.424 2.606 . 0 0 "[ . 1 . 2]" 1
241 1 49 LYS H 1 49 LYS HB3 3.480 . 4.000 2.549 2.467 2.630 . 0 0 "[ . 1 . 2]" 1
242 1 48 THR MG 1 49 LYS H 3.850 . 4.430 3.504 3.316 3.688 . 0 0 "[ . 1 . 2]" 1
243 1 49 LYS H 1 49 LYS HD2 5.840 . 6.720 4.814 4.574 5.113 . 0 0 "[ . 1 . 2]" 1
244 1 49 LYS H 1 49 LYS HD3 5.840 . 6.720 4.853 4.559 5.049 . 0 0 "[ . 1 . 2]" 1
245 1 49 LYS H 1 50 THR H 3.870 . 4.450 2.845 2.613 3.051 . 0 0 "[ . 1 . 2]" 1
246 1 49 LYS HB2 1 50 THR H 3.940 . 4.530 3.821 3.707 3.934 . 0 0 "[ . 1 . 2]" 1
247 1 49 LYS HB3 1 50 THR H 3.490 . 4.010 2.479 2.232 2.683 . 0 0 "[ . 1 . 2]" 1
248 1 49 LYS HG2 1 50 THR H 4.380 . 5.040 3.956 3.296 4.572 . 0 0 "[ . 1 . 2]" 1
249 1 49 LYS HG3 1 50 THR H 4.380 . 5.040 4.216 3.160 4.830 . 0 0 "[ . 1 . 2]" 1
250 1 50 THR H 1 50 THR HB 3.230 . 3.710 2.725 2.573 3.514 . 0 0 "[ . 1 . 2]" 1
251 1 50 THR H 1 52 LEU H 4.810 . 5.530 4.233 4.044 4.453 . 0 0 "[ . 1 . 2]" 1
252 1 49 LYS H 1 51 GLU H 5.730 . 6.590 4.252 4.151 4.499 . 0 0 "[ . 1 . 2]" 1
253 1 49 LYS HA 1 51 GLU H 5.360 . 6.160 4.484 4.256 4.720 . 0 0 "[ . 1 . 2]" 1
254 1 50 THR H 1 51 GLU H 3.320 . 3.820 2.719 2.610 2.810 . 0 0 "[ . 1 . 2]" 1
255 1 50 THR HB 1 51 GLU H 3.430 . 3.940 2.615 2.382 3.290 . 0 0 "[ . 1 . 2]" 1
256 1 50 THR MG 1 51 GLU H 4.240 . 4.880 3.679 3.422 4.106 . 0 0 "[ . 1 . 2]" 1
257 1 51 GLU H 1 51 GLU HB3 3.730 . 4.290 3.546 3.248 3.606 . 0 0 "[ . 1 . 2]" 1
258 1 51 GLU H 1 51 GLU HB2 3.260 . 3.750 2.372 2.045 2.504 . 0 0 "[ . 1 . 2]" 1
259 1 51 GLU H 1 51 GLU HG2 3.650 . 4.200 2.927 2.153 3.648 . 0 0 "[ . 1 . 2]" 1
260 1 51 GLU H 1 51 GLU HG3 3.650 . 4.200 3.265 2.192 4.237 0.037 13 0 "[ . 1 . 2]" 1
261 1 51 GLU H 1 52 LEU H 3.290 . 3.780 2.692 2.560 2.808 . 0 0 "[ . 1 . 2]" 1
262 1 49 LYS HA 1 52 LEU H 4.300 . 4.950 3.593 3.193 3.919 . 0 0 "[ . 1 . 2]" 1
263 1 50 THR HA 1 52 LEU H 5.770 . 6.640 4.488 4.250 4.608 . 0 0 "[ . 1 . 2]" 1
264 1 51 GLU HB3 1 52 LEU H 3.590 . 4.130 3.443 2.779 3.772 . 0 0 "[ . 1 . 2]" 1
265 1 51 GLU HB2 1 52 LEU H 4.140 . 4.760 2.659 2.439 3.097 . 0 0 "[ . 1 . 2]" 1
266 1 51 GLU HG2 1 52 LEU H 5.600 . 6.440 4.702 4.244 5.053 . 0 0 "[ . 1 . 2]" 1
267 1 51 GLU HG3 1 52 LEU H 5.600 . 6.440 4.738 4.284 5.108 . 0 0 "[ . 1 . 2]" 1
268 1 52 LEU H 1 52 LEU HB3 4.080 . 4.690 3.591 3.573 3.603 . 0 0 "[ . 1 . 2]" 1
269 1 52 LEU H 1 52 LEU HB2 3.630 . 4.170 2.615 2.535 2.680 . 0 0 "[ . 1 . 2]" 1
270 1 52 LEU H 1 52 LEU HG 3.150 . 3.620 2.102 2.001 2.193 . 0 0 "[ . 1 . 2]" 1
271 1 52 LEU H 1 52 LEU MD2 3.800 . 4.370 2.916 2.706 3.143 . 0 0 "[ . 1 . 2]" 1
272 1 52 LEU H 1 52 LEU MD1 3.980 . 4.580 3.644 3.594 3.700 . 0 0 "[ . 1 . 2]" 1
273 1 49 LYS HA 1 53 ILE H 5.160 . 5.930 4.242 3.747 4.753 . 0 0 "[ . 1 . 2]" 1
274 1 50 THR HA 1 53 ILE H 4.060 . 4.670 3.644 3.239 3.929 . 0 0 "[ . 1 . 2]" 1
275 1 51 GLU H 1 53 ILE H 5.230 . 6.010 4.254 4.025 4.489 . 0 0 "[ . 1 . 2]" 1
276 1 51 GLU HA 1 53 ILE H 5.020 . 5.770 4.527 4.296 4.750 . 0 0 "[ . 1 . 2]" 1
277 1 52 LEU H 1 53 ILE H 3.460 . 3.980 2.705 2.597 2.865 . 0 0 "[ . 1 . 2]" 1
278 1 52 LEU HB3 1 53 ILE H 4.070 . 4.680 3.676 3.546 3.824 . 0 0 "[ . 1 . 2]" 1
279 1 52 LEU HB2 1 53 ILE H 3.500 . 4.030 2.508 2.347 2.686 . 0 0 "[ . 1 . 2]" 1
280 1 52 LEU HG 1 53 ILE H 4.480 . 5.150 4.100 3.965 4.265 . 0 0 "[ . 1 . 2]" 1
281 1 52 LEU MD2 1 53 ILE H 4.870 . 5.600 4.523 4.449 4.609 . 0 0 "[ . 1 . 2]" 1
282 1 53 ILE H 1 53 ILE HB 3.180 . 3.660 2.541 2.510 2.574 . 0 0 "[ . 1 . 2]" 1
283 1 53 ILE H 1 53 ILE HG13 3.290 . 3.780 2.094 1.989 2.219 . 0 0 "[ . 1 . 2]" 1
284 1 53 ILE H 1 53 ILE HG12 3.690 . 4.240 3.371 3.261 3.439 . 0 0 "[ . 1 . 2]" 1
285 1 53 ILE H 1 53 ILE MD 3.670 . 4.220 3.552 3.503 3.655 . 0 0 "[ . 1 . 2]" 1
286 1 50 THR HA 1 54 GLU H 4.730 . 5.440 4.142 3.946 4.587 . 0 0 "[ . 1 . 2]" 1
287 1 51 GLU HA 1 54 GLU H 3.540 . 4.070 3.637 3.297 4.108 0.038 18 0 "[ . 1 . 2]" 1
288 1 52 LEU H 1 54 GLU H 5.130 . 5.900 4.296 4.146 4.479 . 0 0 "[ . 1 . 2]" 1
289 1 52 LEU HA 1 54 GLU H 5.310 . 6.110 4.660 4.522 4.804 . 0 0 "[ . 1 . 2]" 1
290 1 53 ILE H 1 54 GLU H 3.210 . 3.690 2.763 2.647 2.875 . 0 0 "[ . 1 . 2]" 1
291 1 53 ILE HB 1 54 GLU H 3.260 . 3.750 2.422 2.330 2.548 . 0 0 "[ . 1 . 2]" 1
292 1 53 ILE HG12 1 54 GLU H 5.150 . 5.920 4.906 4.864 4.959 . 0 0 "[ . 1 . 2]" 1
293 1 53 ILE MG 1 54 GLU H 3.580 . 4.120 3.259 3.164 3.444 . 0 0 "[ . 1 . 2]" 1
294 1 54 GLU H 1 54 GLU HB2 3.040 . 3.500 2.407 2.066 2.544 . 0 0 "[ . 1 . 2]" 1
295 1 54 GLU H 1 54 GLU HG2 3.880 . 4.460 2.919 2.115 4.494 0.034 4 0 "[ . 1 . 2]" 1
296 1 54 GLU H 1 54 GLU HG3 3.880 . 4.460 3.366 2.187 4.463 0.003 4 0 "[ . 1 . 2]" 1
297 1 54 GLU H 1 55 ARG H 3.190 . 3.670 2.620 2.442 2.732 . 0 0 "[ . 1 . 2]" 1
298 1 51 GLU HA 1 55 ARG H 3.920 . 4.510 3.960 3.757 4.346 . 0 0 "[ . 1 . 2]" 1
299 1 52 LEU HA 1 55 ARG H 4.080 . 4.690 3.574 3.346 3.804 . 0 0 "[ . 1 . 2]" 1
300 1 53 ILE HA 1 55 ARG H 5.030 . 5.780 4.413 4.180 4.624 . 0 0 "[ . 1 . 2]" 1
301 1 54 GLU HB2 1 55 ARG H 3.410 . 3.920 2.901 2.666 3.754 . 0 0 "[ . 1 . 2]" 1
302 1 54 GLU HG2 1 55 ARG H 5.450 . 6.270 4.674 4.249 5.170 . 0 0 "[ . 1 . 2]" 1
303 1 54 GLU HG3 1 55 ARG H 5.450 . 6.270 4.795 4.134 5.260 . 0 0 "[ . 1 . 2]" 1
304 1 55 ARG H 1 55 ARG HB3 3.110 . 3.580 2.621 2.472 2.879 . 0 0 "[ . 1 . 2]" 1
305 1 55 ARG H 1 55 ARG HB2 3.140 . 3.610 2.427 2.213 2.520 . 0 0 "[ . 1 . 2]" 1
306 1 55 ARG H 1 55 ARG HG2 5.120 . 5.890 4.528 4.456 4.647 . 0 0 "[ . 1 . 2]" 1
307 1 52 LEU HA 1 56 LEU H 4.780 . 5.500 4.131 3.910 4.293 . 0 0 "[ . 1 . 2]" 1
308 1 53 ILE HA 1 56 LEU H 4.110 . 4.730 3.681 3.512 3.941 . 0 0 "[ . 1 . 2]" 1
309 1 54 GLU H 1 56 LEU H 4.480 . 5.150 4.240 4.127 4.428 . 0 0 "[ . 1 . 2]" 1
310 1 55 ARG H 1 56 LEU H 3.320 . 3.820 2.658 2.595 2.716 . 0 0 "[ . 1 . 2]" 1
311 1 55 ARG HB3 1 56 LEU H 3.100 . 3.570 2.541 2.365 2.698 . 0 0 "[ . 1 . 2]" 1
312 1 55 ARG HB2 1 56 LEU H 4.030 . 4.630 3.761 3.410 3.875 . 0 0 "[ . 1 . 2]" 1
313 1 56 LEU H 1 56 LEU HB3 3.610 . 4.150 3.570 3.550 3.587 . 0 0 "[ . 1 . 2]" 1
314 1 56 LEU H 1 56 LEU HB2 2.970 . 3.420 2.370 2.311 2.432 . 0 0 "[ . 1 . 2]" 1
315 1 56 LEU H 1 56 LEU HG 3.400 . 3.910 2.493 2.344 2.589 . 0 0 "[ . 1 . 2]" 1
316 1 56 LEU H 1 56 LEU MD2 4.040 . 4.650 3.592 3.416 3.708 . 0 0 "[ . 1 . 2]" 1
317 1 38 LEU MD2 1 56 LEU H 4.300 . 4.950 3.415 2.910 3.813 . 0 0 "[ . 1 . 2]" 1
318 1 56 LEU H 1 56 LEU MD1 4.490 . 5.160 3.588 3.527 3.640 . 0 0 "[ . 1 . 2]" 1
319 1 53 ILE HA 1 57 ARG H 4.790 . 5.510 4.326 4.133 4.715 . 0 0 "[ . 1 . 2]" 1
320 1 54 GLU HA 1 57 ARG H 3.910 . 4.500 3.259 2.937 3.440 . 0 0 "[ . 1 . 2]" 1
321 1 55 ARG H 1 57 ARG H 4.910 . 5.650 4.057 3.940 4.148 . 0 0 "[ . 1 . 2]" 1
322 1 57 ARG H 1 60 GLN H 5.500 . 6.330 4.772 4.633 4.956 . 0 0 "[ . 1 . 2]" 1
323 1 55 ARG HA 1 57 ARG H 5.400 . 6.210 4.460 4.304 4.591 . 0 0 "[ . 1 . 2]" 1
324 1 56 LEU H 1 57 ARG H 3.350 . 3.850 2.687 2.606 2.773 . 0 0 "[ . 1 . 2]" 1
325 1 56 LEU HB3 1 57 ARG H 3.810 . 4.380 3.416 3.273 3.559 . 0 0 "[ . 1 . 2]" 1
326 1 57 ARG H 1 57 ARG HG2 4.060 . 4.670 3.534 2.989 4.241 . 0 0 "[ . 1 . 2]" 1
327 1 56 LEU HB2 1 57 ARG H 3.330 . 3.830 2.553 2.449 2.644 . 0 0 "[ . 1 . 2]" 1
328 1 56 LEU HG 1 57 ARG H 4.730 . 5.440 4.481 4.373 4.566 . 0 0 "[ . 1 . 2]" 1
329 1 56 LEU MD2 1 57 ARG H 4.860 . 5.590 4.666 4.637 4.702 . 0 0 "[ . 1 . 2]" 1
330 1 53 ILE MG 1 57 ARG H 4.100 . 4.720 4.099 3.918 4.354 . 0 0 "[ . 1 . 2]" 1
331 1 57 ARG H 1 57 ARG HB2 2.900 . 3.340 2.458 2.156 2.702 . 0 0 "[ . 1 . 2]" 1
332 1 57 ARG H 1 57 ARG HG3 3.070 . 3.530 2.328 2.008 3.121 . 0 0 "[ . 1 . 2]" 1
333 1 57 ARG H 1 58 ALA H 3.380 . 3.890 2.742 2.579 2.887 . 0 0 "[ . 1 . 2]" 1
334 1 57 ARG H 1 59 TYR H 4.860 . 5.590 4.076 3.887 4.280 . 0 0 "[ . 1 . 2]" 1
335 1 54 GLU HA 1 58 ALA H 4.260 . 4.900 3.926 3.691 4.178 . 0 0 "[ . 1 . 2]" 1
336 1 56 LEU HA 1 58 ALA H 4.700 . 5.400 4.540 4.384 4.733 . 0 0 "[ . 1 . 2]" 1
337 1 55 ARG HA 1 58 ALA H 4.290 . 4.930 3.494 3.291 3.654 . 0 0 "[ . 1 . 2]" 1
338 1 56 LEU H 1 58 ALA H 4.400 . 5.060 4.218 4.052 4.353 . 0 0 "[ . 1 . 2]" 1
339 1 57 ARG HB2 1 58 ALA H 3.370 . 3.880 2.588 2.344 2.881 . 0 0 "[ . 1 . 2]" 1
340 1 57 ARG HG3 1 58 ALA H 4.490 . 5.160 4.355 3.906 4.834 . 0 0 "[ . 1 . 2]" 1
341 1 58 ALA H 1 58 ALA MB 2.770 . 3.190 2.237 2.216 2.262 . 0 0 "[ . 1 . 2]" 1
342 1 58 ALA H 1 59 TYR H 3.320 . 3.820 2.629 2.448 2.738 . 0 0 "[ . 1 . 2]" 1
343 1 55 ARG HA 1 59 TYR H 5.630 . 6.470 4.147 3.892 4.456 . 0 0 "[ . 1 . 2]" 1
344 1 57 ARG HA 1 59 TYR H 5.120 . 5.890 4.325 4.118 4.647 . 0 0 "[ . 1 . 2]" 1
345 1 59 TYR H 1 59 TYR HB3 3.480 . 4.000 2.501 2.336 2.638 . 0 0 "[ . 1 . 2]" 1
346 1 59 TYR H 1 59 TYR QD 4.630 . 5.320 4.195 4.147 4.224 . 0 0 "[ . 1 . 2]" 1
347 1 58 ALA H 1 60 GLN H 4.460 . 5.130 4.252 3.873 4.524 . 0 0 "[ . 1 . 2]" 1
348 1 59 TYR H 1 60 GLN H 3.500 . 4.030 2.627 2.441 2.819 . 0 0 "[ . 1 . 2]" 1
349 1 59 TYR QD 1 60 GLN H 4.490 . 5.160 3.576 3.206 4.264 . 0 0 "[ . 1 . 2]" 1
350 1 60 GLN H 1 60 GLN HG2 4.890 . 5.620 4.208 2.507 4.631 . 0 0 "[ . 1 . 2]" 1
351 1 60 GLN HE21 1 64 SER H 6.000 . 6.900 5.108 2.944 6.413 . 0 0 "[ . 1 . 2]" 1
352 1 60 GLN HA 1 60 GLN HE21 4.840 . 5.570 4.107 2.847 4.794 . 0 0 "[ . 1 . 2]" 1
353 1 60 GLN HE22 1 64 SER H 6.000 . 6.900 5.110 3.893 6.930 0.030 12 0 "[ . 1 . 2]" 1
354 1 60 GLN HA 1 60 GLN HE22 4.840 . 5.570 4.840 3.462 5.554 . 0 0 "[ . 1 . 2]" 1
355 1 59 TYR H 1 61 ASP H 4.340 . 4.990 3.920 3.715 4.146 . 0 0 "[ . 1 . 2]" 1
356 1 58 ALA HA 1 61 ASP H 3.690 . 4.240 3.534 3.184 3.880 . 0 0 "[ . 1 . 2]" 1
357 1 60 GLN HB2 1 61 ASP H 4.080 . 4.690 3.754 2.897 4.066 . 0 0 "[ . 1 . 2]" 1
358 1 60 GLN HB3 1 61 ASP H 3.490 . 4.010 2.872 2.624 3.592 . 0 0 "[ . 1 . 2]" 1
359 1 60 GLN HE21 1 61 ASP H 6.000 . 6.900 5.331 3.540 6.370 . 0 0 "[ . 1 . 2]" 1
360 1 60 GLN HE22 1 61 ASP H 6.000 . 6.900 5.727 4.438 6.932 0.032 15 0 "[ . 1 . 2]" 1
361 1 61 ASP H 1 61 ASP HB2 2.850 . 3.280 2.530 2.348 2.701 . 0 0 "[ . 1 . 2]" 1
362 1 61 ASP H 1 61 ASP HB3 3.170 . 3.650 2.524 2.382 2.668 . 0 0 "[ . 1 . 2]" 1
363 1 61 ASP H 1 62 GLN H 3.190 . 3.670 2.711 2.568 2.881 . 0 0 "[ . 1 . 2]" 1
364 1 61 ASP HB3 1 62 GLN H 3.420 . 3.930 2.660 2.497 3.054 . 0 0 "[ . 1 . 2]" 1
365 1 62 GLN H 1 62 GLN HG3 4.090 . 4.700 3.165 1.886 3.437 . 0 0 "[ . 1 . 2]" 1
366 1 62 GLN H 1 62 GLN HG2 3.710 . 4.270 2.062 1.868 3.044 . 0 0 "[ . 1 . 2]" 1
367 1 62 GLN HB3 1 63 ILE H 4.650 . 5.350 4.298 4.024 4.494 . 0 0 "[ . 1 . 2]" 1
368 1 62 GLN HG2 1 63 ILE H 6.000 . 6.900 3.328 2.832 4.895 . 0 0 "[ . 1 . 2]" 1
369 1 63 ILE H 1 63 ILE HB 3.430 . 3.940 2.490 2.419 2.628 . 0 0 "[ . 1 . 2]" 1
370 1 63 ILE H 1 63 ILE HG12 3.640 . 4.190 3.219 2.224 3.885 . 0 0 "[ . 1 . 2]" 1
371 1 63 ILE H 1 63 ILE HG13 3.640 . 4.190 2.787 2.183 3.830 . 0 0 "[ . 1 . 2]" 1
372 1 63 ILE H 1 63 ILE MG 4.340 . 4.990 3.778 3.758 3.827 . 0 0 "[ . 1 . 2]" 1
373 1 63 ILE H 1 63 ILE MD 4.590 . 5.280 3.612 3.202 3.922 . 0 0 "[ . 1 . 2]" 1
374 1 63 ILE H 1 64 SER H 3.450 . 3.970 2.449 2.087 2.770 . 0 0 "[ . 1 . 2]" 1
375 1 63 ILE MG 1 64 SER H 3.880 . 4.460 3.402 2.754 3.986 . 0 0 "[ . 1 . 2]" 1
376 1 38 LEU HB2 1 40 LEU H 5.260 . 6.050 4.761 4.689 4.847 . 0 0 "[ . 1 . 2]" 1
377 1 63 ILE HG12 1 64 SER H 5.900 . 6.790 4.748 4.133 5.052 . 0 0 "[ . 1 . 2]" 1
378 1 60 GLN H 1 63 ILE HG13 6.000 . 6.900 4.866 4.334 5.217 . 0 0 "[ . 1 . 2]" 1
379 1 57 ARG HA 1 60 GLN H 4.310 . 4.960 3.557 3.264 3.859 . 0 0 "[ . 1 . 2]" 1
380 1 64 SER H 1 64 SER HB3 3.890 . 4.470 3.504 2.454 4.082 . 0 0 "[ . 1 . 2]" 1
381 1 65 PRO HA 1 66 VAL H 2.870 . 3.300 2.330 2.137 3.102 . 0 0 "[ . 1 . 2]" 1
382 1 65 PRO HB2 1 66 VAL H 4.560 . 5.240 3.681 1.774 4.226 0.026 12 0 "[ . 1 . 2]" 1
383 1 65 PRO HB3 1 66 VAL H 4.560 . 5.240 3.898 3.260 4.662 . 0 0 "[ . 1 . 2]" 1
384 1 66 VAL H 1 66 VAL HB 3.810 . 4.380 3.674 3.604 3.827 . 0 0 "[ . 1 . 2]" 1
385 1 68 GLY H 1 69 ALA H 4.780 . 5.500 2.892 1.739 3.881 0.061 19 0 "[ . 1 . 2]" 1
386 1 69 ALA H 1 69 ALA MB 3.160 . 3.630 2.796 2.412 2.990 . 0 0 "[ . 1 . 2]" 1
387 1 70 PRO HA 1 71 LYS H 3.020 . 3.470 2.249 2.141 2.541 . 0 0 "[ . 1 . 2]" 1
388 1 71 LYS H 1 71 LYS HG2 5.440 . 6.260 4.038 2.106 4.680 . 0 0 "[ . 1 . 2]" 1
389 1 71 LYS H 1 71 LYS HG3 5.440 . 6.260 4.100 2.277 5.002 . 0 0 "[ . 1 . 2]" 1
390 1 71 LYS H 1 71 LYS HD2 6.000 . 6.900 4.460 1.772 6.087 0.028 13 0 "[ . 1 . 2]" 1
391 1 71 LYS H 1 71 LYS HD3 6.000 . 6.900 4.535 2.353 6.269 . 0 0 "[ . 1 . 2]" 1
392 1 71 LYS HA 1 72 ALA H 3.280 . 3.770 2.466 2.143 3.549 . 0 0 "[ . 1 . 2]" 1
393 1 73 PRO HA 1 74 ALA H 3.280 . 3.770 2.381 2.131 3.171 . 0 0 "[ . 1 . 2]" 1
394 1 74 ALA H 1 75 ALA H 5.450 . 6.270 3.828 2.442 4.596 . 0 0 "[ . 1 . 2]" 1
395 1 22 LEU H 1 60 GLN HE21 5.260 . 6.050 4.332 3.161 6.078 0.028 2 0 "[ . 1 . 2]" 1
396 1 22 LEU H 1 23 PRO HD2 5.180 . 5.960 4.827 4.752 4.928 . 0 0 "[ . 1 . 2]" 1
397 1 22 LEU H 1 23 PRO HD3 5.070 . 5.830 4.979 4.787 5.173 . 0 0 "[ . 1 . 2]" 1
398 1 23 PRO HA 1 25 ASN H 4.530 . 5.210 3.916 3.674 4.830 . 0 0 "[ . 1 . 2]" 1
399 1 25 ASN HD21 1 28 ASP HB2 5.200 . 5.980 3.401 2.843 4.398 . 0 0 "[ . 1 . 2]" 1
400 1 23 PRO HB3 1 25 ASN H 4.440 . 5.110 4.070 3.739 4.617 . 0 0 "[ . 1 . 2]" 1
401 1 23 PRO HB2 1 25 ASN H 4.440 . 5.110 2.484 2.084 3.370 . 0 0 "[ . 1 . 2]" 1
402 1 25 ASN H 1 26 LEU MD2 5.410 . 6.220 4.398 3.857 4.992 . 0 0 "[ . 1 . 2]" 1
403 1 24 ALA MB 1 25 ASN HD21 4.960 . 5.700 5.116 2.925 5.766 0.066 8 0 "[ . 1 . 2]" 1
404 1 25 ASN HD22 1 28 ASP HB2 5.200 . 5.980 4.662 2.624 5.686 . 0 0 "[ . 1 . 2]" 1
405 1 24 ALA MB 1 25 ASN HD22 4.960 . 5.700 4.779 3.597 5.761 0.061 1 0 "[ . 1 . 2]" 1
406 1 27 ASP H 1 28 ASP HB3 6.000 . 6.900 5.267 4.471 6.135 . 0 0 "[ . 1 . 2]" 1
407 1 25 ASN HA 1 27 ASP H 4.140 . 4.760 3.424 2.869 3.873 . 0 0 "[ . 1 . 2]" 1
408 1 27 ASP H 1 29 MET H 4.680 . 5.380 3.923 3.594 4.169 . 0 0 "[ . 1 . 2]" 1
409 1 26 LEU HA 1 28 ASP H 4.280 . 4.920 4.064 3.761 4.370 . 0 0 "[ . 1 . 2]" 1
410 1 26 LEU MD2 1 28 ASP H 6.000 . 6.900 5.498 5.262 5.723 . 0 0 "[ . 1 . 2]" 1
411 1 25 ASN H 1 26 LEU HG 5.350 . 6.150 4.049 3.419 4.848 . 0 0 "[ . 1 . 2]" 1
412 1 24 ALA H 1 25 ASN HB2 5.900 . 6.790 4.603 4.023 5.060 . 0 0 "[ . 1 . 2]" 1
413 1 25 ASN H 1 26 LEU HA 5.270 . 6.060 4.627 4.170 5.076 . 0 0 "[ . 1 . 2]" 1
414 1 24 ALA HA 1 26 LEU H 5.000 . 5.750 3.855 3.317 5.012 . 0 0 "[ . 1 . 2]" 1
415 1 24 ALA MB 1 26 LEU H 5.060 . 5.820 4.569 4.267 5.169 . 0 0 "[ . 1 . 2]" 1
416 1 26 LEU HA 1 29 MET H 4.090 . 4.700 3.483 3.190 4.003 . 0 0 "[ . 1 . 2]" 1
417 1 26 LEU HB2 1 29 MET H 6.000 . 6.900 5.499 5.340 5.869 . 0 0 "[ . 1 . 2]" 1
418 1 29 MET H 1 30 LYS HG3 6.000 . 6.900 6.147 5.838 6.611 . 0 0 "[ . 1 . 2]" 1
419 1 29 MET H 1 34 LEU HG 6.000 . 6.900 5.270 4.941 5.637 . 0 0 "[ . 1 . 2]" 1
420 1 30 LYS H 1 34 LEU MD1 5.450 . 6.270 5.252 4.896 5.627 . 0 0 "[ . 1 . 2]" 1
421 1 32 ALA H 1 34 LEU MD1 5.950 . 6.840 5.383 5.085 5.710 . 0 0 "[ . 1 . 2]" 1
422 1 31 VAL H 1 34 LEU MD1 4.690 . 5.390 4.447 4.164 4.974 . 0 0 "[ . 1 . 2]" 1
423 1 31 VAL MG2 1 33 GLU H 5.380 . 6.190 5.322 5.080 5.901 . 0 0 "[ . 1 . 2]" 1
424 1 31 VAL MG1 1 33 GLU H 5.910 . 6.800 5.033 4.763 5.515 . 0 0 "[ . 1 . 2]" 1
425 1 33 GLU H 1 34 LEU MD1 5.080 . 5.840 5.267 5.002 5.600 . 0 0 "[ . 1 . 2]" 1
426 1 33 GLU H 1 34 LEU HG 4.680 . 5.380 4.365 4.049 4.725 . 0 0 "[ . 1 . 2]" 1
427 1 30 LYS HB2 1 33 GLU H 3.800 . 4.370 2.545 2.101 3.115 . 0 0 "[ . 1 . 2]" 1
428 1 29 MET ME 1 33 GLU H 5.390 . 6.200 4.821 4.502 5.529 . 0 0 "[ . 1 . 2]" 1
429 1 34 LEU H 1 52 LEU MD1 5.240 . 6.030 4.363 3.872 4.920 . 0 0 "[ . 1 . 2]" 1
430 1 35 LYS H 1 52 LEU MD1 4.150 . 4.770 3.424 2.933 4.035 . 0 0 "[ . 1 . 2]" 1
431 1 35 LYS H 1 52 LEU MD2 5.750 . 6.610 5.040 4.470 5.460 . 0 0 "[ . 1 . 2]" 1
432 1 31 VAL MG1 1 35 LYS H 4.250 . 4.890 4.125 3.968 4.315 . 0 0 "[ . 1 . 2]" 1
433 1 33 GLU HB2 1 35 LYS H 5.990 . 6.890 5.025 4.812 5.532 . 0 0 "[ . 1 . 2]" 1
434 1 35 LYS H 1 36 GLN HG2 6.000 . 6.900 4.519 4.238 5.023 . 0 0 "[ . 1 . 2]" 1
435 1 35 LYS H 1 45 VAL HB 6.000 . 6.900 5.368 4.943 6.005 . 0 0 "[ . 1 . 2]" 1
436 1 34 LEU MD2 1 36 GLN H 6.000 . 6.900 5.583 5.424 5.797 . 0 0 "[ . 1 . 2]" 1
437 1 36 GLN H 1 40 LEU MD1 6.000 . 6.900 5.850 5.506 6.005 . 0 0 "[ . 1 . 2]" 1
438 1 36 GLN H 1 56 LEU MD1 6.000 . 6.900 5.874 5.515 6.215 . 0 0 "[ . 1 . 2]" 1
439 1 36 GLN HE21 1 40 LEU HG 4.880 . 5.610 3.994 2.585 5.628 0.018 15 0 "[ . 1 . 2]" 1
440 1 36 GLN HE21 1 40 LEU MD1 3.930 . 4.520 3.326 2.395 4.366 . 0 0 "[ . 1 . 2]" 1
441 1 36 GLN HE22 1 40 LEU HG 4.880 . 5.610 4.511 3.142 5.380 . 0 0 "[ . 1 . 2]" 1
442 1 36 GLN HE22 1 40 LEU MD1 3.930 . 4.520 4.127 3.267 4.551 0.031 3 0 "[ . 1 . 2]" 1
443 1 60 GLN HE22 1 63 ILE MG 5.800 . 6.670 5.018 3.079 6.624 . 0 0 "[ . 1 . 2]" 1
444 1 21 ALA MB 1 60 GLN HE21 5.000 . 5.750 3.844 2.228 5.422 . 0 0 "[ . 1 . 2]" 1
445 1 60 GLN HE21 1 63 ILE MG 5.800 . 6.670 4.756 3.630 6.560 . 0 0 "[ . 1 . 2]" 1
446 1 21 ALA MB 1 60 GLN HE22 5.000 . 5.750 4.021 2.594 5.372 . 0 0 "[ . 1 . 2]" 1
447 1 21 ALA HA 1 60 GLN HE22 4.460 . 5.130 3.869 2.091 5.172 0.042 19 0 "[ . 1 . 2]" 1
448 1 35 LYS HB2 1 37 GLU H 5.450 . 6.270 5.334 5.120 5.701 . 0 0 "[ . 1 . 2]" 1
449 1 37 GLU H 1 38 LEU HG 5.180 . 5.960 4.436 4.264 4.689 . 0 0 "[ . 1 . 2]" 1
450 1 37 GLU H 1 40 LEU MD1 4.310 . 4.960 4.581 4.261 4.812 . 0 0 "[ . 1 . 2]" 1
451 1 38 LEU H 1 56 LEU MD2 4.320 . 4.970 3.361 3.101 3.646 . 0 0 "[ . 1 . 2]" 1
452 1 38 LEU H 1 45 VAL MG1 4.500 . 5.180 4.003 3.751 4.330 . 0 0 "[ . 1 . 2]" 1
453 1 38 LEU H 1 40 LEU HB2 4.540 . 5.220 5.185 4.962 5.256 0.036 11 0 "[ . 1 . 2]" 1
454 1 36 GLN H 1 39 LYS H 6.000 . 6.900 4.790 4.665 4.987 . 0 0 "[ . 1 . 2]" 1
455 1 41 ARG H 1 43 LEU H 4.470 . 5.140 3.424 3.045 4.281 . 0 0 "[ . 1 . 2]" 1
456 1 41 ARG HE 1 59 TYR QD 4.700 . 5.400 4.436 2.891 5.468 0.068 13 0 "[ . 1 . 2]" 1
457 1 41 ARG HE 1 59 TYR QE 4.260 . 4.900 3.764 1.875 4.945 0.045 10 0 "[ . 1 . 2]" 1
458 1 41 ARG H 1 43 LEU MD1 4.790 . 5.510 3.997 3.681 4.266 . 0 0 "[ . 1 . 2]" 1
459 1 22 LEU MD2 1 41 ARG HE 4.360 . 5.010 3.917 2.941 4.968 . 0 0 "[ . 1 . 2]" 1
460 1 41 ARG HE 1 56 LEU MD2 5.830 . 6.700 4.571 3.289 5.582 . 0 0 "[ . 1 . 2]" 1
461 1 40 LEU HB2 1 42 SER H 5.200 . 5.980 5.071 4.828 5.264 . 0 0 "[ . 1 . 2]" 1
462 1 38 LEU HB3 1 42 SER H 6.000 . 6.900 5.961 5.783 6.300 . 0 0 "[ . 1 . 2]" 1
463 1 40 LEU MD2 1 42 SER H 5.210 . 5.990 5.259 5.095 5.398 . 0 0 "[ . 1 . 2]" 1
464 1 38 LEU HB3 1 43 LEU H 5.690 . 6.540 3.857 3.654 4.092 . 0 0 "[ . 1 . 2]" 1
465 1 43 LEU H 1 44 PRO HD3 5.090 . 5.850 4.788 4.463 5.086 . 0 0 "[ . 1 . 2]" 1
466 1 44 PRO HB2 1 46 SER H 4.240 . 4.880 3.061 2.561 3.760 . 0 0 "[ . 1 . 2]" 1
467 1 46 SER H 1 52 LEU MD2 4.770 . 5.490 4.099 3.754 4.937 . 0 0 "[ . 1 . 2]" 1
468 1 47 GLY H 1 52 LEU MD2 4.910 . 5.650 3.576 2.899 4.262 . 0 0 "[ . 1 . 2]" 1
469 1 48 THR H 1 52 LEU MD2 5.040 . 5.800 4.231 3.635 4.525 . 0 0 "[ . 1 . 2]" 1
470 1 48 THR H 1 51 GLU HG3 4.370 . 5.030 2.867 2.021 3.420 . 0 0 "[ . 1 . 2]" 1
471 1 48 THR H 1 51 GLU HG2 4.370 . 5.030 3.584 2.514 4.397 . 0 0 "[ . 1 . 2]" 1
472 1 48 THR H 1 51 GLU HB2 3.610 . 4.150 2.320 1.787 2.766 0.013 13 0 "[ . 1 . 2]" 1
473 1 48 THR H 1 50 THR HB 6.000 . 6.900 5.574 4.684 6.401 . 0 0 "[ . 1 . 2]" 1
474 1 48 THR H 1 51 GLU HA 6.000 . 6.900 5.073 4.553 5.431 . 0 0 "[ . 1 . 2]" 1
475 1 31 VAL MG2 1 49 LYS H 4.390 . 5.050 3.801 2.852 4.385 . 0 0 "[ . 1 . 2]" 1
476 1 31 VAL MG1 1 49 LYS H 5.800 . 6.670 4.266 3.259 5.041 . 0 0 "[ . 1 . 2]" 1
477 1 34 LEU MD1 1 49 LYS H 6.000 . 6.900 5.241 4.820 5.647 . 0 0 "[ . 1 . 2]" 1
478 1 49 LYS H 1 53 ILE MD 6.000 . 6.900 5.934 5.527 6.368 . 0 0 "[ . 1 . 2]" 1
479 1 49 LYS H 1 52 LEU MD1 5.790 . 6.660 4.364 3.907 4.805 . 0 0 "[ . 1 . 2]" 1
480 1 48 THR HB 1 50 THR H 3.870 . 4.450 3.043 2.615 3.648 . 0 0 "[ . 1 . 2]" 1
481 1 51 GLU H 1 53 ILE MD 5.480 . 6.300 5.429 5.106 5.843 . 0 0 "[ . 1 . 2]" 1
482 1 51 GLU H 1 52 LEU MD1 5.970 . 6.870 5.367 5.120 5.568 . 0 0 "[ . 1 . 2]" 1
483 1 48 THR MG 1 51 GLU H 4.480 . 5.150 4.490 4.197 4.782 . 0 0 "[ . 1 . 2]" 1
484 1 48 THR HA 1 51 GLU H 5.570 . 6.410 4.685 4.515 4.872 . 0 0 "[ . 1 . 2]" 1
485 1 48 THR HB 1 51 GLU H 4.660 . 5.360 3.797 3.499 4.166 . 0 0 "[ . 1 . 2]" 1
486 1 34 LEU MD1 1 52 LEU H 4.660 . 5.360 4.211 3.870 4.648 . 0 0 "[ . 1 . 2]" 1
487 1 38 LEU MD1 1 52 LEU H 5.420 . 6.230 4.742 4.469 5.083 . 0 0 "[ . 1 . 2]" 1
488 1 50 THR MG 1 54 GLU H 4.860 . 5.590 4.125 3.728 5.197 . 0 0 "[ . 1 . 2]" 1
489 1 54 GLU H 1 58 ALA MB 6.000 . 6.900 6.219 6.008 6.404 . 0 0 "[ . 1 . 2]" 1
490 1 54 GLU H 1 55 ARG HB2 5.200 . 5.980 4.850 4.513 5.033 . 0 0 "[ . 1 . 2]" 1
491 1 38 LEU MD2 1 55 ARG H 5.700 . 6.560 4.669 4.181 5.182 . 0 0 "[ . 1 . 2]" 1
492 1 53 ILE MG 1 55 ARG H 6.000 . 6.900 4.881 4.689 5.040 . 0 0 "[ . 1 . 2]" 1
493 1 55 ARG H 1 56 LEU HG 5.640 . 6.490 4.754 4.573 4.981 . 0 0 "[ . 1 . 2]" 1
494 1 22 LEU MD1 1 56 LEU H 4.690 . 5.390 4.620 4.393 5.044 . 0 0 "[ . 1 . 2]" 1
495 1 22 LEU MD1 1 57 ARG H 3.620 . 4.160 3.431 3.072 3.784 . 0 0 "[ . 1 . 2]" 1
496 1 54 GLU HA 1 57 ARG HE 5.910 . 6.800 4.354 2.186 5.286 . 0 0 "[ . 1 . 2]" 1
497 1 57 ARG HB2 1 57 ARG HE 4.540 . 5.220 3.402 2.031 4.557 . 0 0 "[ . 1 . 2]" 1
498 1 57 ARG HB3 1 57 ARG HE 4.810 . 5.530 2.802 2.022 4.304 . 0 0 "[ . 1 . 2]" 1
499 1 57 ARG HE 1 57 ARG HG2 4.090 . 4.700 2.651 2.278 3.636 . 0 0 "[ . 1 . 2]" 1
500 1 53 ILE MG 1 57 ARG HE 4.260 . 4.900 4.170 2.772 4.846 . 0 0 "[ . 1 . 2]" 1
501 1 22 LEU MD1 1 58 ALA H 4.960 . 5.700 4.815 4.495 5.204 . 0 0 "[ . 1 . 2]" 1
502 1 22 LEU MD2 1 59 TYR H 6.000 . 6.900 5.940 5.008 6.911 0.011 11 0 "[ . 1 . 2]" 1
503 1 38 LEU MD2 1 59 TYR H 6.000 . 6.900 5.789 5.381 6.133 . 0 0 "[ . 1 . 2]" 1
504 1 43 LEU MD1 1 59 TYR H 5.210 . 5.990 4.421 3.690 5.444 . 0 0 "[ . 1 . 2]" 1
505 1 55 ARG HG3 1 59 TYR H 6.000 . 6.900 5.079 4.485 5.427 . 0 0 "[ . 1 . 2]" 1
506 1 55 ARG HB2 1 59 TYR H 6.000 . 6.900 6.269 6.037 6.504 . 0 0 "[ . 1 . 2]" 1
507 1 22 LEU MD1 1 60 GLN H 5.210 . 5.990 3.308 3.015 3.906 . 0 0 "[ . 1 . 2]" 1
508 1 22 LEU H 1 60 GLN HE22 5.260 . 6.050 4.776 3.860 5.838 . 0 0 "[ . 1 . 2]" 1
509 1 58 ALA MB 1 61 ASP H 4.760 . 5.470 4.643 4.392 4.858 . 0 0 "[ . 1 . 2]" 1
510 1 62 GLN H 1 63 ILE MD 4.980 . 5.730 4.979 4.739 5.160 . 0 0 "[ . 1 . 2]" 1
511 1 58 ALA MB 1 62 GLN HE21 5.570 . 6.410 3.757 2.946 5.997 . 0 0 "[ . 1 . 2]" 1
512 1 58 ALA MB 1 62 GLN HE22 5.570 . 6.410 4.294 3.561 5.578 . 0 0 "[ . 1 . 2]" 1
513 1 60 GLN HA 1 63 ILE H 4.810 . 5.530 3.451 3.174 3.895 . 0 0 "[ . 1 . 2]" 1
514 1 61 ASP HA 1 63 ILE H 5.570 . 6.410 3.913 3.561 4.201 . 0 0 "[ . 1 . 2]" 1
515 1 60 GLN H 1 61 ASP HA 5.940 . 6.830 5.144 4.908 5.345 . 0 0 "[ . 1 . 2]" 1
516 1 61 ASP HA 1 64 SER H 6.000 . 6.900 3.802 2.949 4.379 . 0 0 "[ . 1 . 2]" 1
517 1 66 VAL MG2 1 69 ALA H 5.040 . 5.800 2.972 2.255 4.397 . 0 0 "[ . 1 . 2]" 1
518 1 66 VAL HA 1 69 ALA H 5.360 . 6.160 5.207 3.613 6.187 0.027 3 0 "[ . 1 . 2]" 1
519 1 30 LYS H 1 33 GLU HB2 3.740 . 4.300 2.717 2.072 4.382 0.082 4 0 "[ . 1 . 2]" 1
520 1 30 LYS H 1 33 GLU HG3 4.420 . 5.080 2.282 1.810 3.269 . 0 0 "[ . 1 . 2]" 1
521 1 30 LYS H 1 33 GLU HG2 4.420 . 5.080 2.647 2.141 3.786 . 0 0 "[ . 1 . 2]" 1
522 1 30 LYS H 1 33 GLU HB3 4.080 . 4.690 3.771 3.335 4.519 . 0 0 "[ . 1 . 2]" 1
523 1 33 GLU H 1 36 GLN H 5.530 . 6.360 4.753 4.535 5.252 . 0 0 "[ . 1 . 2]" 1
524 1 48 THR H 1 51 GLU H 4.250 . 4.890 3.611 3.175 4.071 . 0 0 "[ . 1 . 2]" 1
525 1 31 VAL H 1 32 ALA MB 5.230 . 6.010 4.344 4.191 4.525 . 0 0 "[ . 1 . 2]" 1
526 1 13 THR HA 1 13 THR MG 3.540 . 4.070 2.277 2.178 2.410 . 0 0 "[ . 1 . 2]" 1
527 1 15 LEU HA 1 15 LEU HG 4.220 . 4.850 3.146 2.448 3.716 . 0 0 "[ . 1 . 2]" 1
528 1 15 LEU HA 1 15 LEU MD1 4.020 . 4.620 2.794 1.897 3.865 . 0 0 "[ . 1 . 2]" 1
529 1 15 LEU H 1 15 LEU HG 4.970 . 5.720 4.245 1.926 5.014 . 0 0 "[ . 1 . 2]" 1
530 1 38 LEU HG 1 56 LEU HG 3.630 . 4.170 3.389 2.978 4.093 . 0 0 "[ . 1 . 2]" 1
531 1 15 LEU MD1 1 16 THR H 4.730 . 5.440 3.664 1.998 5.373 . 0 0 "[ . 1 . 2]" 1
532 1 15 LEU HA 1 15 LEU MD2 4.020 . 4.620 3.019 1.821 4.041 . 0 0 "[ . 1 . 2]" 1
533 1 15 LEU MD2 1 16 THR H 4.730 . 5.440 3.970 2.374 5.163 . 0 0 "[ . 1 . 2]" 1
534 1 16 THR HA 1 16 THR MG 3.320 . 3.820 2.567 2.183 3.229 . 0 0 "[ . 1 . 2]" 1
535 1 16 THR HB 1 17 GLY H 4.290 . 4.930 3.821 2.486 4.383 . 0 0 "[ . 1 . 2]" 1
536 1 16 THR MG 1 17 GLY H 5.850 . 6.730 3.617 2.221 4.297 . 0 0 "[ . 1 . 2]" 1
537 1 18 LYS HA 1 18 LYS HG2 4.090 . 4.700 3.042 2.338 3.858 . 0 0 "[ . 1 . 2]" 1
538 1 18 LYS HA 1 18 LYS HG3 4.090 . 4.700 3.277 2.392 4.259 . 0 0 "[ . 1 . 2]" 1
539 1 18 LYS HA 1 18 LYS HE2 5.150 . 5.920 4.825 4.032 5.756 . 0 0 "[ . 1 . 2]" 1
540 1 18 LYS HA 1 18 LYS HE3 5.150 . 5.920 4.755 4.019 6.052 0.132 13 0 "[ . 1 . 2]" 1
541 1 18 LYS HA 1 19 PRO HD2 3.180 . 3.660 2.485 1.867 3.116 . 0 0 "[ . 1 . 2]" 1
542 1 18 LYS HA 1 19 PRO HD3 3.180 . 3.660 2.109 1.810 2.669 . 0 0 "[ . 1 . 2]" 1
543 1 22 LEU HA 1 22 LEU HG 4.230 . 4.860 3.124 2.992 3.244 . 0 0 "[ . 1 . 2]" 1
544 1 22 LEU HA 1 22 LEU MD1 4.430 . 5.090 3.866 3.832 3.896 . 0 0 "[ . 1 . 2]" 1
545 1 22 LEU HA 1 26 LEU MD1 4.770 . 5.490 4.675 3.599 5.220 . 0 0 "[ . 1 . 2]" 1
546 1 22 LEU HB2 1 26 LEU MD1 3.440 . 3.960 3.198 2.895 3.475 . 0 0 "[ . 1 . 2]" 1
547 1 22 LEU HB3 1 26 LEU MD2 3.710 . 4.270 2.428 2.033 3.254 . 0 0 "[ . 1 . 2]" 1
548 1 22 LEU HB3 1 26 LEU MD1 3.790 . 4.360 2.497 1.788 3.064 0.012 15 0 "[ . 1 . 2]" 1
549 1 39 LYS HG3 1 40 LEU HG 4.540 . 5.220 2.585 2.214 3.057 . 0 0 "[ . 1 . 2]" 1
550 1 22 LEU HA 1 22 LEU MD2 3.060 . 3.520 2.052 1.963 2.135 . 0 0 "[ . 1 . 2]" 1
551 1 22 LEU HB3 1 22 LEU MD2 3.330 . 3.830 2.365 2.336 2.405 . 0 0 "[ . 1 . 2]" 1
552 1 22 LEU HA 1 23 PRO HD2 3.190 . 3.670 2.236 1.995 2.388 . 0 0 "[ . 1 . 2]" 1
553 1 22 LEU HA 1 23 PRO HD3 3.070 . 3.530 2.413 2.257 2.564 . 0 0 "[ . 1 . 2]" 1
554 1 35 LYS HG3 1 45 VAL HA 5.300 . 6.100 4.806 4.531 5.162 . 0 0 "[ . 1 . 2]" 1
555 1 24 ALA HA 1 25 ASN H 3.470 . 3.990 3.304 3.064 3.561 . 0 0 "[ . 1 . 2]" 1
556 1 25 ASN HB3 1 28 ASP H 4.770 . 5.490 3.387 2.523 4.542 . 0 0 "[ . 1 . 2]" 1
557 1 56 LEU HA 1 56 LEU HG 3.760 . 4.320 2.924 2.866 3.033 . 0 0 "[ . 1 . 2]" 1
558 1 26 LEU HA 1 26 LEU HG 3.790 . 4.360 3.044 2.973 3.097 . 0 0 "[ . 1 . 2]" 1
559 1 22 LEU MD1 1 56 LEU HA 3.660 . 4.210 3.496 3.018 4.149 . 0 0 "[ . 1 . 2]" 1
560 1 56 LEU HA 1 60 GLN H 4.670 . 5.370 4.076 3.834 4.311 . 0 0 "[ . 1 . 2]" 1
561 1 26 LEU HB3 1 26 LEU MD1 3.340 . 3.840 2.378 2.332 2.400 . 0 0 "[ . 1 . 2]" 1
562 1 26 LEU HB3 1 26 LEU MD2 3.160 . 3.630 2.366 2.324 2.411 . 0 0 "[ . 1 . 2]" 1
563 1 26 LEU HB2 1 53 ILE MG 3.900 . 4.490 2.524 1.784 3.164 0.016 14 0 "[ . 1 . 2]" 1
564 1 26 LEU HB2 1 26 LEU HG 2.560 . 2.940 2.472 2.432 2.490 . 0 0 "[ . 1 . 2]" 1
565 1 26 LEU HA 1 26 LEU MD1 4.070 . 4.680 3.847 3.807 3.882 . 0 0 "[ . 1 . 2]" 1
566 1 26 LEU HB2 1 26 LEU MD1 3.220 . 3.700 2.324 2.289 2.370 . 0 0 "[ . 1 . 2]" 1
567 1 38 LEU MD2 1 43 LEU H 5.090 . 5.850 4.407 4.201 4.731 . 0 0 "[ . 1 . 2]" 1
568 1 38 LEU MD2 1 43 LEU HB2 3.540 . 4.070 2.400 2.287 2.511 . 0 0 "[ . 1 . 2]" 1
569 1 28 ASP HB3 1 29 MET H 4.880 . 5.610 3.388 2.729 4.137 . 0 0 "[ . 1 . 2]" 1
570 1 29 MET HA 1 29 MET HG2 3.840 . 4.420 2.636 2.371 3.085 . 0 0 "[ . 1 . 2]" 1
571 1 29 MET HA 1 29 MET HG3 3.840 . 4.420 3.167 2.761 3.803 . 0 0 "[ . 1 . 2]" 1
572 1 29 MET HA 1 29 MET ME 4.470 . 5.140 3.970 3.086 4.449 . 0 0 "[ . 1 . 2]" 1
573 1 29 MET HB2 1 29 MET ME 4.060 . 4.670 2.818 2.043 3.488 . 0 0 "[ . 1 . 2]" 1
574 1 29 MET HB3 1 29 MET ME 4.060 . 4.670 2.210 1.995 2.810 . 0 0 "[ . 1 . 2]" 1
575 1 29 MET ME 1 29 MET HG2 3.680 . 4.230 2.868 2.497 3.410 . 0 0 "[ . 1 . 2]" 1
576 1 29 MET ME 1 29 MET HG3 3.680 . 4.230 3.038 2.369 3.408 . 0 0 "[ . 1 . 2]" 1
577 1 30 LYS HA 1 30 LYS HG2 3.860 . 4.440 2.887 2.549 3.674 . 0 0 "[ . 1 . 2]" 1
578 1 30 LYS HA 1 30 LYS HG3 3.770 . 4.340 2.970 2.291 3.350 . 0 0 "[ . 1 . 2]" 1
579 1 30 LYS HB2 1 30 LYS HG3 2.960 . 3.400 2.581 2.412 3.005 . 0 0 "[ . 1 . 2]" 1
580 1 30 LYS H 1 30 LYS HD2 5.400 . 6.210 3.646 1.776 4.356 0.024 5 0 "[ . 1 . 2]" 1
581 1 30 LYS H 1 30 LYS HD3 5.400 . 6.210 4.360 2.753 4.884 . 0 0 "[ . 1 . 2]" 1
582 1 30 LYS HB2 1 30 LYS HD2 2.780 . 3.200 2.532 1.976 3.440 0.240 19 0 "[ . 1 . 2]" 1
583 1 30 LYS HB2 1 30 LYS HD3 2.780 . 3.200 2.908 2.196 3.414 0.214 1 0 "[ . 1 . 2]" 1
584 1 30 LYS HD2 1 31 VAL H 6.000 . 6.900 5.319 4.850 6.296 . 0 0 "[ . 1 . 2]" 1
585 1 30 LYS HD3 1 31 VAL H 6.000 . 6.900 5.079 4.595 6.174 . 0 0 "[ . 1 . 2]" 1
586 1 30 LYS HA 1 30 LYS HE2 6.000 . 6.900 5.752 3.904 6.317 . 0 0 "[ . 1 . 2]" 1
587 1 30 LYS HA 1 30 LYS HE3 6.000 . 6.900 4.911 3.687 5.462 . 0 0 "[ . 1 . 2]" 1
588 1 30 LYS HB2 1 30 LYS HE2 4.490 . 5.160 4.511 3.682 4.804 . 0 0 "[ . 1 . 2]" 1
589 1 30 LYS HB2 1 30 LYS HE3 4.490 . 5.160 4.229 2.557 4.624 . 0 0 "[ . 1 . 2]" 1
590 1 30 LYS HB3 1 30 LYS HE2 5.320 . 6.120 4.636 3.841 4.948 . 0 0 "[ . 1 . 2]" 1
591 1 30 LYS HB3 1 30 LYS HE3 5.320 . 6.120 4.211 2.321 4.875 . 0 0 "[ . 1 . 2]" 1
592 1 31 VAL HA 1 34 LEU H 4.530 . 5.210 3.531 3.338 3.763 . 0 0 "[ . 1 . 2]" 1
593 1 31 VAL HA 1 31 VAL MG1 3.510 . 4.040 2.394 2.343 2.457 . 0 0 "[ . 1 . 2]" 1
594 1 31 VAL HA 1 31 VAL MG2 3.160 . 3.630 2.406 2.344 2.458 . 0 0 "[ . 1 . 2]" 1
595 1 32 ALA HA 1 35 LYS HB2 3.480 . 4.000 2.682 2.297 3.024 . 0 0 "[ . 1 . 2]" 1
596 1 33 GLU HA 1 33 GLU HG2 4.060 . 4.670 3.215 2.886 3.630 . 0 0 "[ . 1 . 2]" 1
597 1 33 GLU HB2 1 33 GLU HG2 2.750 . 3.160 2.458 2.393 2.648 . 0 0 "[ . 1 . 2]" 1
598 1 33 GLU HA 1 33 GLU HG3 4.060 . 4.670 3.833 3.709 4.230 . 0 0 "[ . 1 . 2]" 1
599 1 33 GLU HB2 1 33 GLU HG3 2.750 . 3.160 2.398 2.242 2.464 . 0 0 "[ . 1 . 2]" 1
600 1 34 LEU HA 1 34 LEU HG 3.970 . 4.570 3.096 3.023 3.194 . 0 0 "[ . 1 . 2]" 1
601 1 34 LEU HA 1 34 LEU MD2 3.170 . 3.650 2.026 1.907 2.079 . 0 0 "[ . 1 . 2]" 1
602 1 34 LEU H 1 34 LEU MD2 4.390 . 5.050 3.302 3.151 3.440 . 0 0 "[ . 1 . 2]" 1
603 1 34 LEU HB2 1 34 LEU MD2 3.410 . 3.920 3.198 3.190 3.204 . 0 0 "[ . 1 . 2]" 1
604 1 34 LEU HB3 1 34 LEU MD2 3.410 . 3.920 2.361 2.330 2.400 . 0 0 "[ . 1 . 2]" 1
605 1 34 LEU HA 1 34 LEU MD1 4.120 . 4.740 3.865 3.824 3.889 . 0 0 "[ . 1 . 2]" 1
606 1 34 LEU HB2 1 34 LEU MD1 3.230 . 3.710 2.315 2.283 2.362 . 0 0 "[ . 1 . 2]" 1
607 1 34 LEU HB3 1 34 LEU MD1 3.230 . 3.710 2.387 2.350 2.415 . 0 0 "[ . 1 . 2]" 1
608 1 35 LYS HA 1 35 LYS HG3 3.680 . 4.230 3.022 2.897 3.133 . 0 0 "[ . 1 . 2]" 1
609 1 35 LYS HA 1 35 LYS HG2 3.560 . 4.090 2.464 2.383 2.564 . 0 0 "[ . 1 . 2]" 1
610 1 35 LYS HA 1 38 LEU HG 4.260 . 4.900 3.147 2.565 3.532 . 0 0 "[ . 1 . 2]" 1
611 1 35 LYS HA 1 35 LYS HD2 4.790 . 5.510 4.654 4.629 4.689 . 0 0 "[ . 1 . 2]" 1
612 1 35 LYS HA 1 38 LEU HB2 3.870 . 4.450 2.308 1.976 2.653 . 0 0 "[ . 1 . 2]" 1
613 1 35 LYS HA 1 38 LEU HB3 4.280 . 4.920 3.861 3.497 4.225 . 0 0 "[ . 1 . 2]" 1
614 1 35 LYS HB2 1 35 LYS HD2 3.080 . 3.540 2.556 2.469 2.622 . 0 0 "[ . 1 . 2]" 1
615 1 35 LYS HB2 1 35 LYS HG3 2.700 . 3.110 2.424 2.380 2.478 . 0 0 "[ . 1 . 2]" 1
616 1 35 LYS HA 1 35 LYS HD3 5.300 . 6.100 4.291 4.178 4.407 . 0 0 "[ . 1 . 2]" 1
617 1 35 LYS HB3 1 35 LYS HD3 4.110 . 4.730 2.442 2.350 2.535 . 0 0 "[ . 1 . 2]" 1
618 1 35 LYS HB2 1 35 LYS HD3 3.550 . 4.080 3.045 2.945 3.140 . 0 0 "[ . 1 . 2]" 1
619 1 35 LYS HA 1 35 LYS HE3 5.380 . 6.190 5.269 5.143 5.423 . 0 0 "[ . 1 . 2]" 1
620 1 35 LYS HE3 1 35 LYS HG3 4.070 . 4.680 2.553 2.447 2.666 . 0 0 "[ . 1 . 2]" 1
621 1 35 LYS HB2 1 35 LYS HE3 4.840 . 5.570 4.353 4.282 4.404 . 0 0 "[ . 1 . 2]" 1
622 1 35 LYS HB3 1 35 LYS HE3 5.230 . 6.010 4.632 4.602 4.665 . 0 0 "[ . 1 . 2]" 1
623 1 35 LYS HA 1 35 LYS HE2 6.000 . 6.900 4.921 4.765 5.130 . 0 0 "[ . 1 . 2]" 1
624 1 35 LYS HB3 1 35 LYS HE2 4.230 . 4.860 4.240 4.162 4.303 . 0 0 "[ . 1 . 2]" 1
625 1 35 LYS HE2 1 35 LYS HG3 3.820 . 4.390 3.086 2.933 3.193 . 0 0 "[ . 1 . 2]" 1
626 1 33 GLU HA 1 36 GLN HB2 3.280 . 3.770 2.896 2.218 3.782 0.012 10 0 "[ . 1 . 2]" 1
627 1 36 GLN HA 1 36 GLN HG2 3.400 . 3.910 2.920 2.814 3.090 . 0 0 "[ . 1 . 2]" 1
628 1 36 GLN HA 1 36 GLN HG3 3.730 . 4.290 3.713 3.650 3.770 . 0 0 "[ . 1 . 2]" 1
629 1 36 GLN HG3 1 37 GLU H 5.110 . 5.880 4.886 4.733 5.095 . 0 0 "[ . 1 . 2]" 1
630 1 36 GLN H 1 36 GLN HG2 3.930 . 4.520 2.408 2.168 2.721 . 0 0 "[ . 1 . 2]" 1
631 1 36 GLN HB2 1 36 GLN HG2 2.920 . 3.360 2.466 2.432 2.490 . 0 0 "[ . 1 . 2]" 1
632 1 37 GLU HA 1 37 GLU HG2 4.110 . 4.730 2.848 2.293 3.144 . 0 0 "[ . 1 . 2]" 1
633 1 37 GLU HA 1 37 GLU HG3 4.110 . 4.730 3.613 3.149 3.768 . 0 0 "[ . 1 . 2]" 1
634 1 37 GLU HA 1 40 LEU HB3 4.180 . 4.810 4.558 4.196 4.833 0.023 4 0 "[ . 1 . 2]" 1
635 1 37 GLU HA 1 40 LEU HB2 3.670 . 4.220 2.945 2.555 3.220 . 0 0 "[ . 1 . 2]" 1
636 1 34 LEU HA 1 37 GLU HB2 5.230 . 6.010 3.106 2.522 3.827 . 0 0 "[ . 1 . 2]" 1
637 1 34 LEU HA 1 37 GLU HB3 5.230 . 6.010 4.766 4.110 5.552 . 0 0 "[ . 1 . 2]" 1
638 1 38 LEU HA 1 38 LEU HG 3.760 . 4.320 2.944 2.833 3.090 . 0 0 "[ . 1 . 2]" 1
639 1 38 LEU HA 1 38 LEU MD2 3.120 . 3.590 2.095 2.044 2.198 . 0 0 "[ . 1 . 2]" 1
640 1 38 LEU HA 1 41 ARG HB3 4.780 . 5.500 4.944 4.615 5.234 . 0 0 "[ . 1 . 2]" 1
641 1 38 LEU HA 1 41 ARG HB2 4.030 . 4.630 3.268 2.901 3.497 . 0 0 "[ . 1 . 2]" 1
642 1 38 LEU HA 1 38 LEU MD1 4.080 . 4.690 3.872 3.852 3.897 . 0 0 "[ . 1 . 2]" 1
643 1 38 LEU HB3 1 38 LEU MD1 3.490 . 4.010 2.446 2.367 2.494 . 0 0 "[ . 1 . 2]" 1
644 1 39 LYS HA 1 39 LYS HG2 3.980 . 4.580 3.741 3.694 3.850 . 0 0 "[ . 1 . 2]" 1
645 1 39 LYS HA 1 39 LYS HG3 3.860 . 4.440 3.790 3.668 3.859 . 0 0 "[ . 1 . 2]" 1
646 1 35 LYS HB3 1 36 GLN HA 4.870 . 5.600 4.459 4.274 4.640 . 0 0 "[ . 1 . 2]" 1
647 1 36 GLN HA 1 39 LYS HB3 5.200 . 5.980 4.369 4.034 4.919 . 0 0 "[ . 1 . 2]" 1
648 1 35 LYS HB2 1 36 GLN HA 5.280 . 6.070 4.491 4.342 4.607 . 0 0 "[ . 1 . 2]" 1
649 1 39 LYS HB2 1 40 LEU H 4.400 . 5.060 3.982 3.780 4.128 . 0 0 "[ . 1 . 2]" 1
650 1 39 LYS HB3 1 40 LEU H 4.720 . 5.430 4.101 3.987 4.167 . 0 0 "[ . 1 . 2]" 1
651 1 39 LYS H 1 39 LYS HE2 6.000 . 6.900 4.799 3.752 5.592 . 0 0 "[ . 1 . 2]" 1
652 1 39 LYS H 1 39 LYS HE3 6.000 . 6.900 4.448 3.541 5.786 . 0 0 "[ . 1 . 2]" 1
653 1 39 LYS HA 1 39 LYS HE2 6.000 . 6.900 4.857 4.277 5.506 . 0 0 "[ . 1 . 2]" 1
654 1 39 LYS HA 1 39 LYS HE3 6.000 . 6.900 4.836 4.230 5.959 . 0 0 "[ . 1 . 2]" 1
655 1 39 LYS HE2 1 40 LEU H 6.000 . 6.900 5.463 5.088 5.759 . 0 0 "[ . 1 . 2]" 1
656 1 39 LYS HE3 1 40 LEU H 6.000 . 6.900 5.477 5.046 6.563 . 0 0 "[ . 1 . 2]" 1
657 1 40 LEU HA 1 40 LEU HG 3.700 . 4.260 3.050 2.840 3.099 . 0 0 "[ . 1 . 2]" 1
658 1 40 LEU HA 1 40 LEU MD2 2.890 . 3.320 1.951 1.891 2.004 . 0 0 "[ . 1 . 2]" 1
659 1 40 LEU H 1 40 LEU HB3 4.060 . 4.670 3.597 3.545 3.614 . 0 0 "[ . 1 . 2]" 1
660 1 40 LEU H 1 40 LEU HG 3.560 . 4.090 2.570 2.426 2.764 . 0 0 "[ . 1 . 2]" 1
661 1 40 LEU H 1 40 LEU MD2 4.370 . 5.030 3.519 3.405 3.760 . 0 0 "[ . 1 . 2]" 1
662 1 22 LEU MD2 1 60 GLN H 4.790 . 5.510 4.609 3.684 5.407 . 0 0 "[ . 1 . 2]" 1
663 1 40 LEU HB3 1 40 LEU MD2 3.140 . 3.610 2.382 2.318 2.410 . 0 0 "[ . 1 . 2]" 1
664 1 40 LEU H 1 40 LEU MD1 4.120 . 4.740 3.742 3.664 3.848 . 0 0 "[ . 1 . 2]" 1
665 1 40 LEU HA 1 40 LEU MD1 4.020 . 4.620 3.833 3.814 3.853 . 0 0 "[ . 1 . 2]" 1
666 1 40 LEU HB3 1 40 LEU MD1 3.170 . 3.650 2.368 2.327 2.433 . 0 0 "[ . 1 . 2]" 1
667 1 23 PRO HG2 1 26 LEU MD2 3.770 . 4.340 2.168 1.791 2.562 0.009 16 0 "[ . 1 . 2]" 1
668 1 40 LEU HB2 1 40 LEU MD1 3.330 . 3.830 2.337 2.294 2.369 . 0 0 "[ . 1 . 2]" 1
669 1 41 ARG HA 1 41 ARG HG2 3.760 . 4.320 2.568 2.475 2.677 . 0 0 "[ . 1 . 2]" 1
670 1 41 ARG HA 1 41 ARG HG3 3.760 . 4.320 3.031 2.823 3.324 . 0 0 "[ . 1 . 2]" 1
671 1 41 ARG HB3 1 59 TYR QE 4.870 . 5.600 2.788 2.204 3.809 . 0 0 "[ . 1 . 2]" 1
672 1 42 SER H 1 42 SER HB2 4.030 . 4.630 3.484 3.105 3.694 . 0 0 "[ . 1 . 2]" 1
673 1 42 SER HB2 1 43 LEU H 4.820 . 5.540 4.333 4.063 4.577 . 0 0 "[ . 1 . 2]" 1
674 1 42 SER H 1 42 SER HB3 4.030 . 4.630 3.937 3.606 4.074 . 0 0 "[ . 1 . 2]" 1
675 1 43 LEU HB2 1 43 LEU MD1 3.170 . 3.650 2.225 2.202 2.247 . 0 0 "[ . 1 . 2]" 1
676 1 43 LEU HA 1 43 LEU MD2 3.010 . 3.460 2.169 2.039 2.260 . 0 0 "[ . 1 . 2]" 1
677 1 43 LEU HB3 1 43 LEU MD2 3.360 . 3.860 2.223 2.208 2.255 . 0 0 "[ . 1 . 2]" 1
678 1 43 LEU MD2 1 55 ARG HG2 3.400 . 3.910 2.352 1.863 3.068 . 0 0 "[ . 1 . 2]" 1
679 1 43 LEU HA 1 44 PRO HD2 3.360 . 3.860 2.519 2.073 2.991 . 0 0 "[ . 1 . 2]" 1
680 1 43 LEU HA 1 44 PRO HD3 3.200 . 3.680 2.130 1.825 2.444 . 0 0 "[ . 1 . 2]" 1
681 1 18 LYS HB3 1 19 PRO HD3 5.250 . 6.040 4.108 3.246 4.914 . 0 0 "[ . 1 . 2]" 1
682 1 44 PRO HB3 1 45 VAL H 4.210 . 4.840 3.693 3.161 4.005 . 0 0 "[ . 1 . 2]" 1
683 1 45 VAL HB 1 46 SER H 5.180 . 5.960 4.303 4.089 4.432 . 0 0 "[ . 1 . 2]" 1
684 1 45 VAL HA 1 45 VAL MG2 3.530 . 4.060 3.212 3.205 3.217 . 0 0 "[ . 1 . 2]" 1
685 1 45 VAL HA 1 45 VAL MG1 3.050 . 3.510 2.349 2.314 2.402 . 0 0 "[ . 1 . 2]" 1
686 1 48 THR HA 1 48 THR MG 3.130 . 3.600 2.304 2.253 2.353 . 0 0 "[ . 1 . 2]" 1
687 1 49 LYS HA 1 52 LEU HG 4.160 . 4.780 3.025 2.198 3.574 . 0 0 "[ . 1 . 2]" 1
688 1 49 LYS HA 1 49 LYS HG2 4.080 . 4.690 3.387 2.926 3.848 . 0 0 "[ . 1 . 2]" 1
689 1 49 LYS HA 1 49 LYS HG3 4.080 . 4.690 2.798 2.499 3.155 . 0 0 "[ . 1 . 2]" 1
690 1 49 LYS HA 1 49 LYS HD2 5.130 . 5.900 3.513 2.098 4.517 . 0 0 "[ . 1 . 2]" 1
691 1 49 LYS HA 1 49 LYS HD3 5.130 . 5.900 4.052 2.854 4.710 . 0 0 "[ . 1 . 2]" 1
692 1 49 LYS HA 1 49 LYS HE3 6.000 . 6.900 4.979 4.469 6.079 . 0 0 "[ . 1 . 2]" 1
693 1 49 LYS HA 1 52 LEU HB3 4.610 . 5.300 4.611 3.970 5.115 . 0 0 "[ . 1 . 2]" 1
694 1 49 LYS HA 1 52 LEU HB2 4.050 . 4.660 3.102 2.462 3.562 . 0 0 "[ . 1 . 2]" 1
695 1 49 LYS HD2 1 50 THR H 6.000 . 6.900 5.245 4.769 5.713 . 0 0 "[ . 1 . 2]" 1
696 1 49 LYS HD3 1 50 THR H 6.000 . 6.900 4.990 4.177 5.650 . 0 0 "[ . 1 . 2]" 1
697 1 31 VAL H 1 49 LYS HE2 6.000 . 6.900 5.946 3.522 6.880 . 0 0 "[ . 1 . 2]" 1
698 1 31 VAL H 1 49 LYS HE3 6.000 . 6.900 4.595 4.062 5.426 . 0 0 "[ . 1 . 2]" 1
699 1 49 LYS HA 1 49 LYS HE2 6.000 . 6.900 4.966 4.288 5.484 . 0 0 "[ . 1 . 2]" 1
700 1 49 LYS HB2 1 49 LYS HE2 5.300 . 6.100 4.619 4.208 4.722 . 0 0 "[ . 1 . 2]" 1
701 1 49 LYS HB2 1 49 LYS HE3 5.300 . 6.100 4.477 4.132 4.804 . 0 0 "[ . 1 . 2]" 1
702 1 50 THR HA 1 53 ILE HG13 4.230 . 4.860 3.522 2.882 4.002 . 0 0 "[ . 1 . 2]" 1
703 1 50 THR H 1 50 THR MG 3.670 . 4.220 3.684 2.704 3.769 . 0 0 "[ . 1 . 2]" 1
704 1 50 THR HA 1 50 THR MG 3.180 . 3.660 2.311 2.199 2.381 . 0 0 "[ . 1 . 2]" 1
705 1 51 GLU HA 1 51 GLU HG2 3.720 . 4.280 2.740 2.444 3.074 . 0 0 "[ . 1 . 2]" 1
706 1 51 GLU HA 1 51 GLU HG3 3.720 . 4.280 3.442 2.869 3.770 . 0 0 "[ . 1 . 2]" 1
707 1 52 LEU HA 1 52 LEU MD1 4.180 . 4.810 3.847 3.812 3.881 . 0 0 "[ . 1 . 2]" 1
708 1 52 LEU HA 1 55 ARG HB3 3.930 . 4.520 2.807 2.459 3.204 . 0 0 "[ . 1 . 2]" 1
709 1 52 LEU HA 1 55 ARG HB2 4.210 . 4.840 3.327 2.585 3.884 . 0 0 "[ . 1 . 2]" 1
710 1 50 THR H 1 52 LEU HG 5.880 . 6.760 5.080 4.535 5.440 . 0 0 "[ . 1 . 2]" 1
711 1 52 LEU HA 1 52 LEU MD2 3.060 . 3.520 2.080 1.990 2.134 . 0 0 "[ . 1 . 2]" 1
712 1 52 LEU HB3 1 52 LEU MD1 3.450 . 3.970 2.334 2.301 2.365 . 0 0 "[ . 1 . 2]" 1
713 1 52 LEU HB2 1 52 LEU MD1 3.380 . 3.890 2.372 2.340 2.403 . 0 0 "[ . 1 . 2]" 1
714 1 52 LEU MD1 1 53 ILE H 5.010 . 5.760 4.449 4.326 4.651 . 0 0 "[ . 1 . 2]" 1
715 1 53 ILE HA 1 53 ILE HG12 3.430 . 3.940 2.541 2.467 2.585 . 0 0 "[ . 1 . 2]" 1
716 1 53 ILE HA 1 53 ILE MG 2.970 . 3.420 2.415 2.380 2.451 . 0 0 "[ . 1 . 2]" 1
717 1 53 ILE HA 1 57 ARG HG2 5.980 . 6.880 5.805 5.354 6.655 . 0 0 "[ . 1 . 2]" 1
718 1 53 ILE HA 1 53 ILE HG13 3.560 . 4.090 2.998 2.948 3.060 . 0 0 "[ . 1 . 2]" 1
719 1 53 ILE HA 1 56 LEU HB2 3.840 . 4.420 3.012 2.643 3.426 . 0 0 "[ . 1 . 2]" 1
720 1 50 THR HA 1 53 ILE HB 3.740 . 4.300 3.019 2.582 3.590 . 0 0 "[ . 1 . 2]" 1
721 1 53 ILE H 1 53 ILE MG 3.930 . 4.520 3.769 3.753 3.780 . 0 0 "[ . 1 . 2]" 1
722 1 53 ILE HG12 1 53 ILE MG 3.130 . 3.600 2.375 2.358 2.401 . 0 0 "[ . 1 . 2]" 1
723 1 53 ILE HG13 1 54 GLU H 5.460 . 6.280 4.172 4.065 4.272 . 0 0 "[ . 1 . 2]" 1
724 1 53 ILE HA 1 53 ILE MD 4.360 . 5.010 3.837 3.799 3.860 . 0 0 "[ . 1 . 2]" 1
725 1 53 ILE HB 1 53 ILE MD 3.260 . 3.750 2.416 2.385 2.450 . 0 0 "[ . 1 . 2]" 1
726 1 53 ILE MD 1 54 GLU H 5.350 . 6.150 4.424 4.328 4.518 . 0 0 "[ . 1 . 2]" 1
727 1 54 GLU HA 1 57 ARG HB2 3.470 . 3.990 2.472 2.210 2.912 . 0 0 "[ . 1 . 2]" 1
728 1 51 GLU HA 1 54 GLU HB2 3.350 . 3.850 2.985 2.476 3.842 . 0 0 "[ . 1 . 2]" 1
729 1 54 GLU HA 1 54 GLU HG2 4.020 . 4.620 2.917 2.340 3.651 . 0 0 "[ . 1 . 2]" 1
730 1 54 GLU HA 1 54 GLU HG3 4.020 . 4.620 3.407 2.533 3.781 . 0 0 "[ . 1 . 2]" 1
731 1 55 ARG HA 1 55 ARG HG3 3.290 . 3.780 2.472 2.288 2.742 . 0 0 "[ . 1 . 2]" 1
732 1 55 ARG HA 1 55 ARG HG2 3.600 . 4.140 3.255 2.862 3.773 . 0 0 "[ . 1 . 2]" 1
733 1 55 ARG HG2 1 56 LEU H 5.120 . 5.890 4.009 3.740 4.565 . 0 0 "[ . 1 . 2]" 1
734 1 55 ARG H 1 55 ARG HG3 4.870 . 5.600 4.405 4.306 4.468 . 0 0 "[ . 1 . 2]" 1
735 1 55 ARG HG3 1 56 LEU H 5.920 . 6.810 4.649 3.955 4.892 . 0 0 "[ . 1 . 2]" 1
736 1 55 ARG H 1 55 ARG HD2 6.000 . 6.900 4.890 4.373 5.066 . 0 0 "[ . 1 . 2]" 1
737 1 55 ARG H 1 55 ARG HD3 6.000 . 6.900 5.813 5.053 5.983 . 0 0 "[ . 1 . 2]" 1
738 1 26 LEU HA 1 26 LEU MD2 2.820 . 3.240 1.978 1.917 2.068 . 0 0 "[ . 1 . 2]" 1
739 1 56 LEU HA 1 59 TYR H 4.010 . 4.610 3.512 3.321 3.688 . 0 0 "[ . 1 . 2]" 1
740 1 56 LEU HA 1 59 TYR HB3 4.260 . 4.900 2.775 2.391 2.956 . 0 0 "[ . 1 . 2]" 1
741 1 53 ILE HA 1 56 LEU HB3 5.040 . 5.800 4.608 4.206 5.004 . 0 0 "[ . 1 . 2]" 1
742 1 56 LEU HB3 1 56 LEU MD1 3.200 . 3.680 2.419 2.371 2.452 . 0 0 "[ . 1 . 2]" 1
743 1 56 LEU HB2 1 56 LEU MD1 3.400 . 3.910 2.291 2.264 2.330 . 0 0 "[ . 1 . 2]" 1
744 1 56 LEU HA 1 56 LEU MD2 3.140 . 3.610 1.997 1.949 2.045 . 0 0 "[ . 1 . 2]" 1
745 1 56 LEU HB3 1 56 LEU MD2 3.210 . 3.690 2.323 2.298 2.361 . 0 0 "[ . 1 . 2]" 1
746 1 38 LEU MD2 1 55 ARG HG2 3.420 . 3.930 2.863 2.267 3.707 . 0 0 "[ . 1 . 2]" 1
747 1 38 LEU HB3 1 38 LEU MD2 3.390 . 3.900 2.308 2.276 2.366 . 0 0 "[ . 1 . 2]" 1
748 1 56 LEU MD1 1 57 ARG H 5.750 . 6.610 4.440 4.326 4.536 . 0 0 "[ . 1 . 2]" 1
749 1 57 ARG HA 1 57 ARG HG2 3.500 . 4.030 2.628 2.481 3.108 . 0 0 "[ . 1 . 2]" 1
750 1 57 ARG HA 1 57 ARG HG3 3.580 . 4.120 2.922 2.180 3.321 . 0 0 "[ . 1 . 2]" 1
751 1 57 ARG HA 1 57 ARG HD2 5.390 . 6.200 4.748 4.162 4.962 . 0 0 "[ . 1 . 2]" 1
752 1 57 ARG HA 1 57 ARG HD3 5.390 . 6.200 4.533 3.958 4.810 . 0 0 "[ . 1 . 2]" 1
753 1 57 ARG HA 1 61 ASP H 4.980 . 5.730 4.002 3.707 4.254 . 0 0 "[ . 1 . 2]" 1
754 1 57 ARG HA 1 60 GLN HB2 4.310 . 4.960 3.729 2.681 4.593 . 0 0 "[ . 1 . 2]" 1
755 1 57 ARG HB2 1 57 ARG HG3 2.740 . 3.150 2.500 2.361 2.816 . 0 0 "[ . 1 . 2]" 1
756 1 57 ARG HG2 1 58 ALA H 6.000 . 6.900 4.990 4.730 5.275 . 0 0 "[ . 1 . 2]" 1
757 1 57 ARG H 1 57 ARG HD2 5.480 . 6.300 4.409 3.916 4.864 . 0 0 "[ . 1 . 2]" 1
758 1 57 ARG H 1 57 ARG HD3 5.480 . 6.300 3.965 2.782 4.800 . 0 0 "[ . 1 . 2]" 1
759 1 57 ARG HD2 1 58 ALA H 6.000 . 6.900 5.914 4.966 6.349 . 0 0 "[ . 1 . 2]" 1
760 1 57 ARG HD3 1 58 ALA H 6.000 . 6.900 5.023 4.706 6.348 . 0 0 "[ . 1 . 2]" 1
761 1 55 ARG HA 1 58 ALA MB 3.480 . 4.000 2.764 2.519 3.014 . 0 0 "[ . 1 . 2]" 1
762 1 58 ALA MB 1 59 TYR H 3.440 . 3.960 2.647 2.409 2.812 . 0 0 "[ . 1 . 2]" 1
763 1 59 TYR HA 1 59 TYR QD 3.720 . 4.280 2.657 2.387 2.849 . 0 0 "[ . 1 . 2]" 1
764 1 59 TYR HA 1 59 TYR QE 5.500 . 6.330 4.601 4.532 4.725 . 0 0 "[ . 1 . 2]" 1
765 1 59 TYR HA 1 62 GLN H 4.430 . 5.090 3.748 3.437 4.062 . 0 0 "[ . 1 . 2]" 1
766 1 56 LEU HA 1 59 TYR HB2 4.260 . 4.900 3.565 3.065 4.072 . 0 0 "[ . 1 . 2]" 1
767 1 59 TYR H 1 59 TYR HB2 3.480 . 4.000 2.578 2.435 2.755 . 0 0 "[ . 1 . 2]" 1
768 1 59 TYR HB2 1 60 GLN H 4.160 . 4.780 3.855 3.717 3.955 . 0 0 "[ . 1 . 2]" 1
769 1 59 TYR HB3 1 60 GLN H 4.160 . 4.780 2.557 2.346 3.005 . 0 0 "[ . 1 . 2]" 1
770 1 59 TYR QE 1 60 GLN HA 5.470 . 6.290 4.861 4.302 5.666 . 0 0 "[ . 1 . 2]" 1
771 1 60 GLN H 1 60 GLN HB2 3.510 . 4.040 2.422 2.186 2.692 . 0 0 "[ . 1 . 2]" 1
772 1 59 TYR QE 1 60 GLN HB2 6.000 . 6.900 5.788 4.750 6.778 . 0 0 "[ . 1 . 2]" 1
773 1 60 GLN H 1 60 GLN HB3 3.640 . 4.190 2.724 2.354 3.553 . 0 0 "[ . 1 . 2]" 1
774 1 57 ARG HA 1 60 GLN HB3 3.970 . 4.570 3.253 2.471 4.602 0.032 15 0 "[ . 1 . 2]" 1
775 1 60 GLN H 1 60 GLN HG3 4.890 . 5.620 4.470 3.702 4.655 . 0 0 "[ . 1 . 2]" 1
776 1 61 ASP H 1 62 GLN HG2 5.060 . 5.820 4.128 3.837 5.424 . 0 0 "[ . 1 . 2]" 1
777 1 58 ALA HA 1 61 ASP HB2 3.600 . 4.140 3.330 2.706 4.118 . 0 0 "[ . 1 . 2]" 1
778 1 58 ALA HA 1 61 ASP HB3 3.860 . 4.440 2.685 2.257 3.255 . 0 0 "[ . 1 . 2]" 1
779 1 62 GLN HA 1 62 GLN HG3 3.850 . 4.430 3.761 3.239 3.840 . 0 0 "[ . 1 . 2]" 1
780 1 62 GLN HB2 1 63 ILE H 4.650 . 5.350 4.146 2.893 4.370 . 0 0 "[ . 1 . 2]" 1
781 1 59 TYR HA 1 62 GLN HG3 3.920 . 4.510 3.570 3.079 4.005 . 0 0 "[ . 1 . 2]" 1
782 1 62 GLN HG3 1 63 ILE H 4.780 . 5.500 3.321 2.902 4.018 . 0 0 "[ . 1 . 2]" 1
783 1 63 ILE HA 1 63 ILE HG12 4.220 . 4.850 2.673 2.455 3.092 . 0 0 "[ . 1 . 2]" 1
784 1 63 ILE HA 1 63 ILE HG13 4.220 . 4.850 3.220 2.950 3.742 . 0 0 "[ . 1 . 2]" 1
785 1 63 ILE HA 1 63 ILE MG 3.140 . 3.610 2.445 2.335 2.521 . 0 0 "[ . 1 . 2]" 1
786 1 63 ILE HB 1 63 ILE MD 3.320 . 3.820 2.671 2.402 3.238 . 0 0 "[ . 1 . 2]" 1
787 1 63 ILE HB 1 64 SER H 4.490 . 5.160 2.651 1.945 3.156 . 0 0 "[ . 1 . 2]" 1
788 1 60 GLN H 1 63 ILE HG12 6.000 . 6.900 5.775 4.093 6.904 0.004 1 0 "[ . 1 . 2]" 1
789 1 63 ILE HG13 1 64 SER H 5.900 . 6.790 4.468 3.951 5.296 . 0 0 "[ . 1 . 2]" 1
790 1 63 ILE HA 1 63 ILE MD 3.960 . 4.550 3.270 1.906 3.904 . 0 0 "[ . 1 . 2]" 1
791 1 60 GLN H 1 63 ILE MD 5.270 . 6.060 4.590 3.911 5.704 . 0 0 "[ . 1 . 2]" 1
792 1 63 ILE MD 1 64 SER H 5.980 . 6.880 4.598 4.048 4.854 . 0 0 "[ . 1 . 2]" 1
793 1 64 SER H 1 64 SER HB2 3.890 . 4.470 2.892 2.483 3.708 . 0 0 "[ . 1 . 2]" 1
794 1 64 SER HA 1 65 PRO HD2 3.470 . 3.990 2.492 1.816 3.013 . 0 0 "[ . 1 . 2]" 1
795 1 64 SER HA 1 65 PRO HD3 3.470 . 3.990 2.176 1.768 2.649 0.032 1 0 "[ . 1 . 2]" 1
796 1 66 VAL HA 1 67 PRO HD2 3.170 . 3.650 2.654 2.255 3.130 . 0 0 "[ . 1 . 2]" 1
797 1 66 VAL HA 1 67 PRO HD3 3.170 . 3.650 1.925 1.764 2.576 0.036 2 0 "[ . 1 . 2]" 1
798 1 69 ALA HA 1 70 PRO HD3 3.280 . 3.770 2.130 1.794 2.811 0.006 11 0 "[ . 1 . 2]" 1
799 1 71 LYS HB2 1 72 ALA H 5.330 . 6.130 4.212 2.516 4.648 . 0 0 "[ . 1 . 2]" 1
800 1 71 LYS HB3 1 72 ALA H 5.330 . 6.130 3.960 1.960 4.462 . 0 0 "[ . 1 . 2]" 1
801 1 71 LYS HA 1 71 LYS HE2 6.000 . 6.900 5.010 4.103 6.161 . 0 0 "[ . 1 . 2]" 1
802 1 71 LYS HA 1 71 LYS HE3 6.000 . 6.900 4.913 3.900 6.010 . 0 0 "[ . 1 . 2]" 1
803 1 69 ALA HA 1 70 PRO HD2 3.280 . 3.770 2.527 1.985 3.192 . 0 0 "[ . 1 . 2]" 1
804 1 20 GLY HA2 1 21 ALA MB 5.080 . 5.840 4.715 4.280 5.006 . 0 0 "[ . 1 . 2]" 1
805 1 20 GLY HA2 1 63 ILE MG 6.000 . 6.900 4.606 3.087 6.936 0.036 15 0 "[ . 1 . 2]" 1
806 1 20 GLY HA2 1 63 ILE MD 6.000 . 6.900 4.495 2.438 6.863 . 0 0 "[ . 1 . 2]" 1
807 1 20 GLY HA3 1 21 ALA MB 5.080 . 5.840 4.262 3.797 4.735 . 0 0 "[ . 1 . 2]" 1
808 1 20 GLY HA3 1 63 ILE MG 6.000 . 6.900 4.317 2.874 6.278 . 0 0 "[ . 1 . 2]" 1
809 1 20 GLY HA3 1 63 ILE MD 6.000 . 6.900 4.792 2.560 6.619 . 0 0 "[ . 1 . 2]" 1
810 1 21 ALA HA 1 22 LEU HB2 5.510 . 6.340 4.714 4.529 4.924 . 0 0 "[ . 1 . 2]" 1
811 1 19 PRO HA 1 20 GLY HA2 5.290 . 6.080 4.409 4.321 4.775 . 0 0 "[ . 1 . 2]" 1
812 1 20 GLY HA2 1 21 ALA HA 5.730 . 6.590 4.525 4.340 4.808 . 0 0 "[ . 1 . 2]" 1
813 1 19 PRO HA 1 20 GLY HA3 5.290 . 6.080 4.481 4.345 5.229 . 0 0 "[ . 1 . 2]" 1
814 1 21 ALA HA 1 60 GLN HE21 4.460 . 5.130 3.305 1.868 4.846 . 0 0 "[ . 1 . 2]" 1
815 1 20 GLY HA3 1 21 ALA HA 5.730 . 6.590 4.490 4.264 4.721 . 0 0 "[ . 1 . 2]" 1
816 1 22 LEU HB2 1 23 PRO HD2 4.130 . 4.750 3.851 3.554 4.216 . 0 0 "[ . 1 . 2]" 1
817 1 22 LEU HB2 1 23 PRO HD3 5.030 . 5.780 4.874 4.671 5.071 . 0 0 "[ . 1 . 2]" 1
818 1 22 LEU HG 1 23 PRO HD2 5.670 . 6.520 4.615 4.430 4.880 . 0 0 "[ . 1 . 2]" 1
819 1 22 LEU HG 1 23 PRO HD3 5.910 . 6.800 5.457 5.256 5.620 . 0 0 "[ . 1 . 2]" 1
820 1 22 LEU MD2 1 23 PRO HD2 3.770 . 4.340 2.730 2.450 3.019 . 0 0 "[ . 1 . 2]" 1
821 1 22 LEU MD2 1 23 PRO HD3 4.670 . 5.370 3.548 3.343 3.885 . 0 0 "[ . 1 . 2]" 1
822 1 22 LEU MD1 1 23 PRO HD2 4.770 . 5.490 4.096 3.835 4.635 . 0 0 "[ . 1 . 2]" 1
823 1 22 LEU MD1 1 23 PRO HD3 5.580 . 6.420 5.353 5.148 5.757 . 0 0 "[ . 1 . 2]" 1
824 1 22 LEU HG 1 60 GLN HB3 4.530 . 5.210 3.387 2.740 3.737 . 0 0 "[ . 1 . 2]" 1
825 1 21 ALA HA 1 22 LEU HG 4.850 . 5.580 3.627 3.431 3.954 . 0 0 "[ . 1 . 2]" 1
826 1 22 LEU HB3 1 23 PRO HA 5.340 . 6.140 4.873 4.722 5.009 . 0 0 "[ . 1 . 2]" 1
827 1 23 PRO HA 1 26 LEU H 6.000 . 6.900 6.081 5.397 6.915 0.015 18 0 "[ . 1 . 2]" 1
828 1 22 LEU HB3 1 23 PRO HD2 3.580 . 4.120 2.377 2.041 2.941 . 0 0 "[ . 1 . 2]" 1
829 1 23 PRO HD2 1 26 LEU MD2 3.340 . 3.840 2.336 1.909 2.807 . 0 0 "[ . 1 . 2]" 1
830 1 22 LEU HB3 1 23 PRO HD3 4.120 . 4.740 3.802 3.521 4.274 . 0 0 "[ . 1 . 2]" 1
831 1 23 PRO HD3 1 26 LEU MD2 3.700 . 4.260 3.801 3.397 4.248 . 0 0 "[ . 1 . 2]" 1
832 1 23 PRO HA 1 24 ALA MB 4.010 . 4.610 4.019 3.966 4.123 . 0 0 "[ . 1 . 2]" 1
833 1 23 PRO HA 1 26 LEU MD2 5.300 . 6.100 4.911 4.713 5.281 . 0 0 "[ . 1 . 2]" 1
834 1 23 PRO HB2 1 26 LEU MD2 4.640 . 5.340 3.873 3.311 4.398 . 0 0 "[ . 1 . 2]" 1
835 1 34 LEU MD1 1 49 LYS HB2 4.800 . 5.520 4.129 3.544 4.661 . 0 0 "[ . 1 . 2]" 1
836 1 23 PRO HB3 1 26 LEU MD2 4.640 . 5.340 4.639 4.238 5.022 . 0 0 "[ . 1 . 2]" 1
837 1 73 PRO HA 1 74 ALA MB 5.520 . 6.350 4.123 3.886 4.819 . 0 0 "[ . 1 . 2]" 1
838 1 25 ASN HB2 1 27 ASP H 6.000 . 6.900 5.532 4.912 6.153 . 0 0 "[ . 1 . 2]" 1
839 1 25 ASN HB3 1 27 ASP H 6.000 . 6.900 4.745 3.586 5.532 . 0 0 "[ . 1 . 2]" 1
840 1 25 ASN HB3 1 28 ASP HB2 4.030 . 4.630 2.652 1.747 4.069 0.053 19 0 "[ . 1 . 2]" 1
841 1 24 ALA MB 1 25 ASN HB2 4.510 . 5.190 4.600 3.795 5.074 . 0 0 "[ . 1 . 2]" 1
842 1 24 ALA MB 1 25 ASN HA 3.940 . 4.530 4.026 3.838 4.217 . 0 0 "[ . 1 . 2]" 1
843 1 26 LEU MD1 1 53 ILE HA 4.920 . 5.660 3.179 2.480 4.167 . 0 0 "[ . 1 . 2]" 1
844 1 27 ASP HA 1 29 MET H 5.030 . 5.780 3.940 3.540 4.378 . 0 0 "[ . 1 . 2]" 1
845 1 31 VAL HB 1 35 LYS HE2 6.000 . 6.900 6.112 5.629 6.492 . 0 0 "[ . 1 . 2]" 1
846 1 12 SER HB3 1 13 THR H 6.000 . 6.900 3.895 2.597 4.492 . 0 0 "[ . 1 . 2]" 1
847 1 13 THR HA 1 14 PRO HD2 3.180 . 3.660 2.534 2.183 2.860 . 0 0 "[ . 1 . 2]" 1
848 1 13 THR HB 1 14 PRO HD2 4.060 . 4.670 3.587 1.983 4.688 0.018 3 0 "[ . 1 . 2]" 1
849 1 24 ALA HA 1 26 LEU MD2 5.600 . 6.440 5.037 4.719 5.569 . 0 0 "[ . 1 . 2]" 1
850 1 25 ASN HB3 1 28 ASP HA 5.530 . 6.360 4.905 4.215 6.397 0.037 1 0 "[ . 1 . 2]" 1
851 1 24 ALA HA 1 25 ASN HB2 6.000 . 6.900 5.651 5.121 5.882 . 0 0 "[ . 1 . 2]" 1
852 1 13 THR HA 1 14 PRO HD3 3.180 . 3.660 2.039 1.805 2.660 . 0 0 "[ . 1 . 2]" 1
853 1 49 LYS HB3 1 50 THR HA 4.940 . 5.680 4.262 4.158 4.339 . 0 0 "[ . 1 . 2]" 1
854 1 27 ASP HA 1 53 ILE MD 3.130 . 3.600 2.173 1.791 2.783 0.009 18 0 "[ . 1 . 2]" 1
855 1 27 ASP HA 1 53 ILE HG12 4.860 . 5.590 3.740 2.843 4.260 . 0 0 "[ . 1 . 2]" 1
856 1 27 ASP HA 1 53 ILE HB 6.000 . 6.900 5.559 4.746 6.250 . 0 0 "[ . 1 . 2]" 1
857 1 27 ASP HA 1 53 ILE HG13 6.000 . 6.900 4.534 4.001 4.988 . 0 0 "[ . 1 . 2]" 1
858 1 27 ASP HB2 1 53 ILE MG 5.260 . 6.050 4.268 3.153 5.419 . 0 0 "[ . 1 . 2]" 1
859 1 27 ASP HB2 1 53 ILE MD 5.380 . 6.190 3.136 2.125 4.487 . 0 0 "[ . 1 . 2]" 1
860 1 27 ASP HB3 1 53 ILE MG 5.260 . 6.050 4.901 2.876 5.668 . 0 0 "[ . 1 . 2]" 1
861 1 29 MET HA 1 30 LYS HG3 4.220 . 4.850 3.824 3.421 4.920 0.070 2 0 "[ . 1 . 2]" 1
862 1 29 MET HA 1 30 LYS HG2 5.850 . 6.730 5.008 4.395 5.725 . 0 0 "[ . 1 . 2]" 1
863 1 29 MET HA 1 34 LEU HG 6.000 . 6.900 5.287 4.844 5.792 . 0 0 "[ . 1 . 2]" 1
864 1 29 MET HA 1 34 LEU MD1 6.000 . 6.900 5.714 5.374 6.145 . 0 0 "[ . 1 . 2]" 1
865 1 29 MET HA 1 34 LEU MD2 6.000 . 6.900 4.890 4.540 5.437 . 0 0 "[ . 1 . 2]" 1
866 1 29 MET HB2 1 34 LEU HG 4.820 . 5.540 3.266 2.942 3.626 . 0 0 "[ . 1 . 2]" 1
867 1 29 MET HB2 1 34 LEU MD2 5.530 . 6.360 2.389 2.040 2.888 . 0 0 "[ . 1 . 2]" 1
868 1 29 MET HB3 1 34 LEU HG 4.820 . 5.540 3.442 2.886 4.065 . 0 0 "[ . 1 . 2]" 1
869 1 29 MET HB3 1 34 LEU MD2 5.530 . 6.360 3.195 2.639 3.858 . 0 0 "[ . 1 . 2]" 1
870 1 26 LEU MD2 1 29 MET HG3 5.130 . 5.900 3.832 2.352 5.106 . 0 0 "[ . 1 . 2]" 1
871 1 26 LEU MD2 1 29 MET ME 3.310 . 3.810 3.185 1.797 3.842 0.032 16 0 "[ . 1 . 2]" 1
872 1 29 MET ME 1 34 LEU MD2 3.540 . 4.070 2.529 1.791 3.699 0.009 1 0 "[ . 1 . 2]" 1
873 1 29 MET ME 1 34 LEU HA 3.780 . 4.350 3.222 2.485 4.270 . 0 0 "[ . 1 . 2]" 1
874 1 29 MET ME 1 34 LEU H 4.660 . 5.360 3.775 3.350 4.350 . 0 0 "[ . 1 . 2]" 1
875 1 30 LYS HA 1 34 LEU MD1 5.220 . 6.000 4.644 4.180 5.171 . 0 0 "[ . 1 . 2]" 1
876 1 29 MET HA 1 30 LYS HB3 6.000 . 6.900 5.705 5.610 5.771 . 0 0 "[ . 1 . 2]" 1
877 1 30 LYS HB3 1 33 GLU H 4.580 . 5.270 3.681 3.119 4.503 . 0 0 "[ . 1 . 2]" 1
878 1 30 LYS HG3 1 33 GLU H 6.000 . 6.900 4.870 4.179 5.744 . 0 0 "[ . 1 . 2]" 1
879 1 30 LYS HE2 1 33 GLU H 6.000 . 6.900 6.667 6.148 6.944 0.044 17 0 "[ . 1 . 2]" 1
880 1 30 LYS HE3 1 33 GLU H 6.000 . 6.900 6.445 4.763 7.015 0.115 20 0 "[ . 1 . 2]" 1
881 1 31 VAL HA 1 33 GLU H 5.310 . 6.110 4.373 3.918 5.030 . 0 0 "[ . 1 . 2]" 1
882 1 30 LYS HA 1 31 VAL HA 5.500 . 6.330 4.313 4.236 4.366 . 0 0 "[ . 1 . 2]" 1
883 1 30 LYS HA 1 31 VAL HB 5.320 . 6.120 5.029 4.883 5.127 . 0 0 "[ . 1 . 2]" 1
884 1 31 VAL MG2 1 34 LEU H 5.290 . 6.080 5.287 5.156 5.449 . 0 0 "[ . 1 . 2]" 1
885 1 30 LYS HA 1 31 VAL MG2 4.400 . 5.060 3.668 3.554 3.798 . 0 0 "[ . 1 . 2]" 1
886 1 31 VAL HA 1 34 LEU MD1 3.400 . 3.910 2.434 2.096 2.798 . 0 0 "[ . 1 . 2]" 1
887 1 31 VAL HA 1 52 LEU MD1 4.100 . 4.720 2.892 2.377 3.371 . 0 0 "[ . 1 . 2]" 1
888 1 31 VAL HB 1 52 LEU MD1 5.370 . 6.180 4.417 4.132 4.774 . 0 0 "[ . 1 . 2]" 1
889 1 31 VAL MG1 1 52 LEU MD1 3.270 . 3.760 2.021 1.811 2.290 . 0 0 "[ . 1 . 2]" 1
890 1 31 VAL MG2 1 34 LEU MD1 3.320 . 3.820 3.446 3.118 3.852 0.032 13 0 "[ . 1 . 2]" 1
891 1 31 VAL MG2 1 52 LEU MD2 5.790 . 6.660 5.497 4.636 6.018 . 0 0 "[ . 1 . 2]" 1
892 1 31 VAL MG1 1 52 LEU MD2 4.560 . 5.240 3.978 3.583 4.429 . 0 0 "[ . 1 . 2]" 1
893 1 31 VAL HA 1 52 LEU HB3 5.390 . 6.200 5.311 4.786 5.614 . 0 0 "[ . 1 . 2]" 1
894 1 31 VAL HA 1 34 LEU HG 4.610 . 5.300 3.337 2.984 3.730 . 0 0 "[ . 1 . 2]" 1
895 1 31 VAL HA 1 49 LYS HD2 6.000 . 6.900 4.074 3.119 5.402 . 0 0 "[ . 1 . 2]" 1
896 1 31 VAL HA 1 49 LYS HD3 6.000 . 6.900 4.956 2.860 6.582 . 0 0 "[ . 1 . 2]" 1
897 1 31 VAL HA 1 35 LYS HG3 5.320 . 6.120 4.268 4.117 4.493 . 0 0 "[ . 1 . 2]" 1
898 1 31 VAL HB 1 32 ALA MB 5.050 . 5.810 3.931 3.814 4.120 . 0 0 "[ . 1 . 2]" 1
899 1 31 VAL HB 1 35 LYS HE3 6.000 . 6.900 4.385 3.975 4.745 . 0 0 "[ . 1 . 2]" 1
900 1 31 VAL MG1 1 35 LYS HE3 4.170 . 4.800 2.014 1.788 2.289 0.012 20 0 "[ . 1 . 2]" 1
901 1 31 VAL MG2 1 49 LYS HA 3.840 . 4.420 3.131 2.507 3.690 . 0 0 "[ . 1 . 2]" 1
902 1 31 VAL MG2 1 49 LYS HE3 4.830 . 5.550 3.937 3.199 4.705 . 0 0 "[ . 1 . 2]" 1
903 1 30 LYS HB3 1 31 VAL MG2 4.860 . 5.590 3.939 3.662 4.216 . 0 0 "[ . 1 . 2]" 1
904 1 31 VAL MG2 1 49 LYS HB3 3.850 . 4.430 3.879 3.322 4.455 0.025 4 0 "[ . 1 . 2]" 1
905 1 31 VAL MG2 1 49 LYS HB2 3.470 . 3.990 2.386 1.791 3.012 0.009 7 0 "[ . 1 . 2]" 1
906 1 30 LYS HG2 1 31 VAL MG2 5.880 . 6.760 5.352 4.927 5.811 . 0 0 "[ . 1 . 2]" 1
907 1 31 VAL MG2 1 34 LEU HG 6.000 . 6.900 4.903 4.628 5.172 . 0 0 "[ . 1 . 2]" 1
908 1 31 VAL MG1 1 32 ALA HA 4.030 . 4.630 3.539 3.297 3.691 . 0 0 "[ . 1 . 2]" 1
909 1 32 ALA HA 1 35 LYS HD3 4.180 . 4.810 4.299 3.755 4.821 0.011 5 0 "[ . 1 . 2]" 1
910 1 32 ALA HA 1 35 LYS HD2 3.920 . 4.510 2.730 2.095 3.329 . 0 0 "[ . 1 . 2]" 1
911 1 31 VAL HB 1 32 ALA HA 5.070 . 5.830 4.241 4.153 4.301 . 0 0 "[ . 1 . 2]" 1
912 1 32 ALA MB 1 33 GLU HG3 4.950 . 5.690 4.915 4.745 5.034 . 0 0 "[ . 1 . 2]" 1
913 1 30 LYS HB2 1 32 ALA MB 4.260 . 4.900 3.323 2.918 4.088 . 0 0 "[ . 1 . 2]" 1
914 1 32 ALA MB 1 35 LYS HD2 4.890 . 5.620 4.032 3.429 4.619 . 0 0 "[ . 1 . 2]" 1
915 1 31 VAL MG1 1 32 ALA MB 4.400 . 5.060 4.152 3.852 4.335 . 0 0 "[ . 1 . 2]" 1
916 1 32 ALA MB 1 34 LEU MD1 5.860 . 6.740 6.127 5.946 6.316 . 0 0 "[ . 1 . 2]" 1
917 1 35 LYS H 1 36 GLN HA 6.000 . 6.900 5.243 5.137 5.332 . 0 0 "[ . 1 . 2]" 1
918 1 33 GLU HB2 1 34 LEU MD1 6.000 . 6.900 4.955 4.685 6.010 . 0 0 "[ . 1 . 2]" 1
919 1 33 GLU HB2 1 34 LEU MD2 6.000 . 6.900 3.890 3.528 4.382 . 0 0 "[ . 1 . 2]" 1
920 1 32 ALA MB 1 36 GLN H 5.470 . 6.290 4.759 4.423 5.337 . 0 0 "[ . 1 . 2]" 1
921 1 32 ALA MB 1 34 LEU H 5.640 . 6.490 4.563 4.278 4.751 . 0 0 "[ . 1 . 2]" 1
922 1 32 ALA MB 1 35 LYS H 5.270 . 6.060 4.576 4.454 4.811 . 0 0 "[ . 1 . 2]" 1
923 1 33 GLU H 1 34 LEU HA 5.480 . 6.300 5.254 5.066 5.385 . 0 0 "[ . 1 . 2]" 1
924 1 33 GLU H 1 34 LEU HB2 6.000 . 6.900 4.796 4.566 4.956 . 0 0 "[ . 1 . 2]" 1
925 1 33 GLU H 1 34 LEU HB3 6.000 . 6.900 6.168 5.927 6.329 . 0 0 "[ . 1 . 2]" 1
926 1 34 LEU MD1 1 53 ILE H 4.810 . 5.530 3.072 2.768 3.554 . 0 0 "[ . 1 . 2]" 1
927 1 34 LEU MD1 1 53 ILE HA 4.980 . 5.730 3.409 2.944 3.709 . 0 0 "[ . 1 . 2]" 1
928 1 34 LEU MD2 1 53 ILE HA 4.090 . 4.700 3.171 2.557 3.806 . 0 0 "[ . 1 . 2]" 1
929 1 31 VAL HA 1 34 LEU MD2 5.250 . 6.040 4.683 4.384 4.960 . 0 0 "[ . 1 . 2]" 1
930 1 35 LYS HA 1 39 LYS H 4.940 . 5.680 3.799 3.601 3.994 . 0 0 "[ . 1 . 2]" 1
931 1 35 LYS HB3 1 37 GLU H 6.000 . 6.900 5.725 5.576 5.965 . 0 0 "[ . 1 . 2]" 1
932 1 35 LYS HA 1 38 LEU MD1 3.510 . 4.040 1.861 1.771 2.127 0.029 14 0 "[ . 1 . 2]" 1
933 1 35 LYS HA 1 38 LEU MD2 4.740 . 5.450 4.328 4.086 4.658 . 0 0 "[ . 1 . 2]" 1
934 1 35 LYS HA 1 45 VAL HB 4.610 . 5.300 3.470 2.886 4.145 . 0 0 "[ . 1 . 2]" 1
935 1 35 LYS HD3 1 45 VAL HB 4.820 . 5.540 2.594 2.136 3.388 . 0 0 "[ . 1 . 2]" 1
936 1 35 LYS HD2 1 45 VAL HB 5.410 . 6.220 4.058 3.750 4.662 . 0 0 "[ . 1 . 2]" 1
937 1 35 LYS HE2 1 45 VAL HB 4.160 . 4.780 3.061 1.957 3.902 . 0 0 "[ . 1 . 2]" 1
938 1 35 LYS HD3 1 45 VAL MG1 4.810 . 5.530 3.646 3.015 4.133 . 0 0 "[ . 1 . 2]" 1
939 1 35 LYS HD3 1 52 LEU MD1 5.700 . 6.560 4.483 4.095 5.630 . 0 0 "[ . 1 . 2]" 1
940 1 35 LYS HG2 1 45 VAL MG1 4.920 . 5.660 3.116 2.486 3.619 . 0 0 "[ . 1 . 2]" 1
941 1 23 PRO HG2 1 26 LEU HA 5.010 . 5.760 3.685 3.447 3.992 . 0 0 "[ . 1 . 2]" 1
942 1 32 ALA HA 1 35 LYS HG3 5.490 . 6.310 3.380 2.966 4.030 . 0 0 "[ . 1 . 2]" 1
943 1 32 ALA HA 1 35 LYS HE3 5.190 . 5.970 4.336 3.776 4.997 . 0 0 "[ . 1 . 2]" 1
944 1 32 ALA HA 1 35 LYS HE2 6.000 . 6.900 5.453 4.890 6.084 . 0 0 "[ . 1 . 2]" 1
945 1 35 LYS HE2 1 45 VAL HA 5.630 . 6.470 4.299 3.642 5.338 . 0 0 "[ . 1 . 2]" 1
946 1 36 GLN HA 1 39 LYS HD2 4.940 . 5.680 2.923 2.417 3.855 . 0 0 "[ . 1 . 2]" 1
947 1 36 GLN HA 1 39 LYS HD3 4.940 . 5.680 3.258 2.162 4.388 . 0 0 "[ . 1 . 2]" 1
948 1 36 GLN HA 1 39 LYS HG2 4.610 . 5.300 2.247 1.971 2.602 . 0 0 "[ . 1 . 2]" 1
949 1 32 ALA MB 1 33 GLU HA 5.270 . 6.060 3.843 3.765 3.950 . 0 0 "[ . 1 . 2]" 1
950 1 36 GLN HA 1 39 LYS HG3 5.470 . 6.290 3.434 3.038 3.863 . 0 0 "[ . 1 . 2]" 1
951 1 36 GLN HA 1 45 VAL MG1 5.780 . 6.650 4.698 4.271 5.280 . 0 0 "[ . 1 . 2]" 1
952 1 36 GLN HA 1 40 LEU MD1 4.660 . 5.360 4.231 3.994 4.463 . 0 0 "[ . 1 . 2]" 1
953 1 32 ALA MB 1 36 GLN HB2 5.780 . 6.650 5.539 5.085 6.264 . 0 0 "[ . 1 . 2]" 1
954 1 36 GLN HB2 1 40 LEU MD1 5.150 . 5.920 4.521 4.141 4.884 . 0 0 "[ . 1 . 2]" 1
955 1 36 GLN HB3 1 39 LYS HG3 6.000 . 6.900 5.114 4.736 5.587 . 0 0 "[ . 1 . 2]" 1
956 1 32 ALA MB 1 36 GLN HG3 5.730 . 6.590 4.703 4.246 5.801 . 0 0 "[ . 1 . 2]" 1
957 1 36 GLN HG3 1 40 LEU MD1 4.820 . 5.540 5.194 4.420 5.572 0.032 11 0 "[ . 1 . 2]" 1
958 1 36 GLN HG2 1 39 LYS HG3 5.970 . 6.870 6.205 5.596 6.735 . 0 0 "[ . 1 . 2]" 1
959 1 36 GLN HB2 1 37 GLU HA 5.440 . 6.260 4.461 4.244 4.685 . 0 0 "[ . 1 . 2]" 1
960 1 37 GLU HA 1 40 LEU MD1 3.350 . 3.850 3.021 2.528 3.485 . 0 0 "[ . 1 . 2]" 1
961 1 37 GLU HA 1 56 LEU MD2 5.280 . 6.070 4.380 3.919 4.899 . 0 0 "[ . 1 . 2]" 1
962 1 37 GLU HB2 1 56 LEU MD1 4.700 . 5.400 2.686 2.169 3.159 . 0 0 "[ . 1 . 2]" 1
963 1 37 GLU HB3 1 56 LEU MD1 4.700 . 5.400 3.318 2.620 4.158 . 0 0 "[ . 1 . 2]" 1
964 1 37 GLU HG2 1 40 LEU HB2 6.000 . 6.900 5.628 4.343 6.177 . 0 0 "[ . 1 . 2]" 1
965 1 37 GLU HG2 1 56 LEU MD1 5.520 . 6.350 4.401 3.672 5.432 . 0 0 "[ . 1 . 2]" 1
966 1 37 GLU HG3 1 40 LEU HB2 6.000 . 6.900 6.474 5.636 6.908 0.008 18 0 "[ . 1 . 2]" 1
967 1 37 GLU HG3 1 56 LEU MD1 5.520 . 6.350 3.515 2.710 4.575 . 0 0 "[ . 1 . 2]" 1
968 1 34 LEU HA 1 37 GLU HG3 5.220 . 6.000 3.858 3.093 4.398 . 0 0 "[ . 1 . 2]" 1
969 1 34 LEU HA 1 37 GLU HG2 5.220 . 6.000 4.043 3.243 5.923 . 0 0 "[ . 1 . 2]" 1
970 1 34 LEU HA 1 37 GLU HA 6.000 . 6.900 5.680 5.208 6.246 . 0 0 "[ . 1 . 2]" 1
971 1 38 LEU HA 1 43 LEU H 5.050 . 5.810 3.718 3.447 4.340 . 0 0 "[ . 1 . 2]" 1
972 1 38 LEU HB2 1 43 LEU H 6.000 . 6.900 5.042 4.852 5.272 . 0 0 "[ . 1 . 2]" 1
973 1 38 LEU HA 1 43 LEU MD1 3.890 . 4.470 2.293 1.956 2.714 . 0 0 "[ . 1 . 2]" 1
974 1 38 LEU HB2 1 43 LEU MD1 5.600 . 6.440 4.709 4.434 5.023 . 0 0 "[ . 1 . 2]" 1
975 1 38 LEU HB3 1 56 LEU MD2 6.000 . 6.900 4.380 4.114 4.720 . 0 0 "[ . 1 . 2]" 1
976 1 38 LEU HB3 1 43 LEU MD1 6.000 . 6.900 3.810 3.524 4.159 . 0 0 "[ . 1 . 2]" 1
977 1 38 LEU HG 1 45 VAL MG1 5.200 . 5.980 4.084 3.826 4.287 . 0 0 "[ . 1 . 2]" 1
978 1 38 LEU HG 1 56 LEU MD2 4.120 . 4.740 2.706 2.372 3.045 . 0 0 "[ . 1 . 2]" 1
979 1 38 LEU MD1 1 56 LEU MD2 4.610 . 5.300 3.878 3.674 4.022 . 0 0 "[ . 1 . 2]" 1
980 1 35 LYS HG3 1 38 LEU MD1 4.540 . 5.220 3.512 3.133 3.942 . 0 0 "[ . 1 . 2]" 1
981 1 38 LEU MD1 1 52 LEU HB3 3.690 . 4.240 2.209 1.800 2.935 0.000 20 0 "[ . 1 . 2]" 1
982 1 38 LEU MD1 1 52 LEU HB2 4.080 . 4.690 3.746 3.391 4.343 . 0 0 "[ . 1 . 2]" 1
983 1 38 LEU MD1 1 45 VAL HB 4.730 . 5.440 3.372 3.182 3.634 . 0 0 "[ . 1 . 2]" 1
984 1 38 LEU MD1 1 55 ARG HD3 4.850 . 5.580 4.686 3.871 5.485 . 0 0 "[ . 1 . 2]" 1
985 1 26 LEU MD2 1 29 MET HG2 5.130 . 5.900 4.726 3.250 5.833 . 0 0 "[ . 1 . 2]" 1
986 1 25 ASN HB2 1 26 LEU MD2 5.680 . 6.530 5.262 4.754 5.848 . 0 0 "[ . 1 . 2]" 1
987 1 39 LYS HB2 1 41 ARG H 6.000 . 6.900 5.453 5.092 5.848 . 0 0 "[ . 1 . 2]" 1
988 1 39 LYS HB3 1 41 ARG H 6.000 . 6.900 5.654 5.372 5.981 . 0 0 "[ . 1 . 2]" 1
989 1 38 LEU MD2 1 39 LYS HA 5.450 . 6.270 5.546 5.299 5.696 . 0 0 "[ . 1 . 2]" 1
990 1 39 LYS HG3 1 40 LEU HA 4.700 . 5.400 3.588 3.365 3.818 . 0 0 "[ . 1 . 2]" 1
991 1 37 GLU HA 1 40 LEU HG 5.240 . 6.030 4.058 3.572 4.490 . 0 0 "[ . 1 . 2]" 1
992 1 22 LEU MD2 1 56 LEU HA 4.270 . 4.910 4.038 3.304 4.956 0.046 14 0 "[ . 1 . 2]" 1
993 1 36 GLN HG2 1 40 LEU MD1 6.000 . 6.900 5.740 5.173 6.024 . 0 0 "[ . 1 . 2]" 1
994 1 22 LEU MD2 1 59 TYR QD 4.550 . 5.230 4.124 3.121 4.818 . 0 0 "[ . 1 . 2]" 1
995 1 41 ARG HB3 1 43 LEU MD1 4.630 . 5.320 3.096 2.726 3.487 . 0 0 "[ . 1 . 2]" 1
996 1 22 LEU MD2 1 41 ARG HD2 5.010 . 5.760 3.823 3.168 4.694 . 0 0 "[ . 1 . 2]" 1
997 1 41 ARG HD2 1 43 LEU MD1 4.980 . 5.730 3.367 2.269 4.929 . 0 0 "[ . 1 . 2]" 1
998 1 22 LEU MD2 1 41 ARG HD3 5.010 . 5.760 3.947 3.177 5.407 . 0 0 "[ . 1 . 2]" 1
999 1 41 ARG HD3 1 43 LEU MD1 4.980 . 5.730 3.376 2.963 4.083 . 0 0 "[ . 1 . 2]" 1
1000 1 38 LEU HA 1 41 ARG HD3 6.000 . 6.900 5.188 4.204 5.929 . 0 0 "[ . 1 . 2]" 1
1001 1 38 LEU HA 1 41 ARG HD2 6.000 . 6.900 4.495 3.717 5.889 . 0 0 "[ . 1 . 2]" 1
1002 1 40 LEU HB2 1 41 ARG HA 5.180 . 5.960 4.648 4.441 4.838 . 0 0 "[ . 1 . 2]" 1
1003 1 40 LEU MD2 1 41 ARG HA 5.160 . 5.930 5.647 5.442 5.734 . 0 0 "[ . 1 . 2]" 1
1004 1 43 LEU HB3 1 55 ARG HD2 5.280 . 6.070 3.719 2.670 5.170 . 0 0 "[ . 1 . 2]" 1
1005 1 43 LEU HB3 1 55 ARG HD3 5.280 . 6.070 3.508 2.688 4.652 . 0 0 "[ . 1 . 2]" 1
1006 1 38 LEU HB3 1 43 LEU HB3 5.370 . 6.180 2.962 2.780 3.323 . 0 0 "[ . 1 . 2]" 1
1007 1 38 LEU HB2 1 43 LEU HB3 4.760 . 5.470 4.633 4.492 4.923 . 0 0 "[ . 1 . 2]" 1
1008 1 38 LEU HB3 1 43 LEU HB2 5.230 . 6.010 2.471 2.229 2.822 . 0 0 "[ . 1 . 2]" 1
1009 1 43 LEU MD1 1 55 ARG HB3 5.500 . 6.330 4.181 3.278 5.041 . 0 0 "[ . 1 . 2]" 1
1010 1 43 LEU MD1 1 55 ARG HG3 5.960 . 6.850 4.411 3.124 5.326 . 0 0 "[ . 1 . 2]" 1
1011 1 43 LEU MD2 1 55 ARG HA 4.750 . 5.460 4.634 3.715 5.486 0.026 13 0 "[ . 1 . 2]" 1
1012 1 38 LEU HA 1 43 LEU MD2 4.570 . 5.260 4.439 4.271 4.694 . 0 0 "[ . 1 . 2]" 1
1013 1 43 LEU MD2 1 59 TYR HB3 5.010 . 5.760 3.582 2.945 4.075 . 0 0 "[ . 1 . 2]" 1
1014 1 43 LEU MD2 1 55 ARG HD3 5.140 . 5.910 3.014 2.323 3.713 . 0 0 "[ . 1 . 2]" 1
1015 1 38 LEU HB3 1 43 LEU MD2 6.000 . 6.900 4.696 4.551 4.939 . 0 0 "[ . 1 . 2]" 1
1016 1 43 LEU MD1 1 59 TYR QD 3.970 . 4.570 2.839 2.254 3.076 . 0 0 "[ . 1 . 2]" 1
1017 1 43 LEU MD2 1 59 TYR QD 3.770 . 4.340 2.565 1.937 3.183 . 0 0 "[ . 1 . 2]" 1
1018 1 43 LEU MD2 1 59 TYR QE 4.280 . 4.920 3.708 3.213 4.316 . 0 0 "[ . 1 . 2]" 1
1019 1 43 LEU MD1 1 56 LEU H 5.930 . 6.820 4.359 3.618 5.322 . 0 0 "[ . 1 . 2]" 1
1020 1 44 PRO HA 1 46 SER H 5.110 . 5.880 3.630 3.153 3.848 . 0 0 "[ . 1 . 2]" 1
1021 1 43 LEU HB2 1 44 PRO HD2 4.160 . 4.780 4.129 3.889 4.406 . 0 0 "[ . 1 . 2]" 1
1022 1 43 LEU HB3 1 44 PRO HD2 3.690 . 4.240 2.621 2.392 2.886 . 0 0 "[ . 1 . 2]" 1
1023 1 43 LEU MD2 1 44 PRO HD2 3.660 . 4.210 2.555 2.206 2.892 . 0 0 "[ . 1 . 2]" 1
1024 1 44 PRO HD2 1 55 ARG HD2 4.640 . 5.340 3.530 2.771 4.560 . 0 0 "[ . 1 . 2]" 1
1025 1 18 LYS HG2 1 19 PRO HD3 6.000 . 6.900 4.818 3.454 6.246 . 0 0 "[ . 1 . 2]" 1
1026 1 43 LEU HG 1 44 PRO HD3 4.960 . 5.700 4.723 4.293 5.145 . 0 0 "[ . 1 . 2]" 1
1027 1 43 LEU HB3 1 44 PRO HD3 4.130 . 4.750 3.654 3.089 4.212 . 0 0 "[ . 1 . 2]" 1
1028 1 43 LEU MD2 1 44 PRO HD3 3.420 . 3.930 3.017 2.563 3.536 . 0 0 "[ . 1 . 2]" 1
1029 1 44 PRO HA 1 45 VAL MG2 4.360 . 5.010 3.725 3.641 3.825 . 0 0 "[ . 1 . 2]" 1
1030 1 44 PRO HA 1 45 VAL MG1 4.560 . 5.240 3.615 3.419 3.852 . 0 0 "[ . 1 . 2]" 1
1031 1 43 LEU MD1 1 44 PRO HD3 6.000 . 6.900 5.202 4.736 5.667 . 0 0 "[ . 1 . 2]" 1
1032 1 43 LEU H 1 44 PRO HD2 5.940 . 6.830 5.044 4.776 5.308 . 0 0 "[ . 1 . 2]" 1
1033 1 39 LYS H 1 45 VAL MG1 3.710 . 4.270 2.857 2.523 3.390 . 0 0 "[ . 1 . 2]" 1
1034 1 38 LEU MD1 1 45 VAL HA 3.310 . 3.810 1.913 1.751 2.052 0.049 16 0 "[ . 1 . 2]" 1
1035 1 38 LEU HB2 1 45 VAL HA 4.390 . 5.050 3.445 2.929 4.051 . 0 0 "[ . 1 . 2]" 1
1036 1 35 LYS HG2 1 45 VAL HB 3.840 . 4.420 2.203 1.790 3.256 0.010 10 0 "[ . 1 . 2]" 1
1037 1 45 VAL HA 1 52 LEU MD2 3.770 . 4.340 2.851 2.346 3.621 . 0 0 "[ . 1 . 2]" 1
1038 1 45 VAL MG2 1 52 LEU MD2 6.000 . 6.900 4.593 4.254 5.234 . 0 0 "[ . 1 . 2]" 1
1039 1 45 VAL MG1 1 52 LEU MD2 4.850 . 5.580 4.164 3.680 4.595 . 0 0 "[ . 1 . 2]" 1
1040 1 38 LEU HB2 1 45 VAL MG1 3.170 . 3.650 2.013 1.770 2.322 0.030 18 0 "[ . 1 . 2]" 1
1041 1 39 LYS HG2 1 45 VAL MG1 3.990 . 4.590 3.745 3.208 4.407 . 0 0 "[ . 1 . 2]" 1
1042 1 35 LYS HB3 1 45 VAL MG1 3.500 . 4.030 2.595 2.294 2.787 . 0 0 "[ . 1 . 2]" 1
1043 1 39 LYS HB3 1 45 VAL MG1 3.660 . 4.210 2.374 1.797 3.055 0.003 8 0 "[ . 1 . 2]" 1
1044 1 38 LEU HB3 1 45 VAL MG1 3.240 . 3.730 2.637 2.293 2.892 . 0 0 "[ . 1 . 2]" 1
1045 1 35 LYS HE2 1 45 VAL MG1 4.880 . 5.610 4.539 3.601 5.121 . 0 0 "[ . 1 . 2]" 1
1046 1 38 LEU HA 1 45 VAL MG1 5.160 . 5.930 4.425 4.180 4.736 . 0 0 "[ . 1 . 2]" 1
1047 1 35 LYS HA 1 45 VAL MG1 3.730 . 4.290 2.558 2.219 3.054 . 0 0 "[ . 1 . 2]" 1
1048 1 39 LYS HA 1 45 VAL MG1 3.950 . 4.540 3.246 2.806 3.688 . 0 0 "[ . 1 . 2]" 1
1049 1 35 LYS HB3 1 45 VAL MG2 4.700 . 5.400 3.738 3.352 4.126 . 0 0 "[ . 1 . 2]" 1
1050 1 39 LYS HB3 1 45 VAL MG2 5.060 . 5.820 4.136 3.680 4.934 . 0 0 "[ . 1 . 2]" 1
1051 1 35 LYS HD3 1 45 VAL MG2 4.590 . 5.280 3.226 2.776 3.615 . 0 0 "[ . 1 . 2]" 1
1052 1 35 LYS HG2 1 45 VAL MG2 4.440 . 5.110 3.810 3.440 4.737 . 0 0 "[ . 1 . 2]" 1
1053 1 35 LYS HE3 1 45 VAL HB 5.400 . 6.210 4.375 3.559 5.041 . 0 0 "[ . 1 . 2]" 1
1054 1 45 VAL H 1 46 SER HA 5.250 . 6.040 4.796 4.618 5.048 . 0 0 "[ . 1 . 2]" 1
1055 1 45 VAL MG2 1 46 SER HA 4.430 . 5.090 3.490 3.210 3.784 . 0 0 "[ . 1 . 2]" 1
1056 1 46 SER HA 1 52 LEU MD2 4.440 . 5.110 3.995 3.692 4.669 . 0 0 "[ . 1 . 2]" 1
1057 1 47 GLY HA2 1 51 GLU HB2 4.600 . 5.290 4.003 3.478 4.630 . 0 0 "[ . 1 . 2]" 1
1058 1 47 GLY HA2 1 51 GLU HB3 5.280 . 6.070 4.538 3.835 5.425 . 0 0 "[ . 1 . 2]" 1
1059 1 47 GLY HA2 1 52 LEU MD2 5.000 . 5.750 4.232 3.827 4.791 . 0 0 "[ . 1 . 2]" 1
1060 1 47 GLY HA3 1 51 GLU HB2 4.600 . 5.290 2.980 2.399 3.880 . 0 0 "[ . 1 . 2]" 1
1061 1 47 GLY HA3 1 48 THR MG 4.260 . 4.900 4.534 4.285 4.734 . 0 0 "[ . 1 . 2]" 1
1062 1 48 THR HA 1 49 LYS HB3 5.080 . 5.840 5.050 4.929 5.186 . 0 0 "[ . 1 . 2]" 1
1063 1 48 THR HA 1 49 LYS HB2 5.030 . 5.780 4.752 4.606 4.898 . 0 0 "[ . 1 . 2]" 1
1064 1 48 THR HA 1 52 LEU MD2 5.260 . 6.050 4.736 4.264 5.172 . 0 0 "[ . 1 . 2]" 1
1065 1 47 GLY HA2 1 48 THR MG 4.260 . 4.900 3.724 3.542 3.840 . 0 0 "[ . 1 . 2]" 1
1066 1 48 THR MG 1 50 THR H 5.730 . 6.590 4.548 4.182 5.004 . 0 0 "[ . 1 . 2]" 1
1067 1 31 VAL MG1 1 49 LYS HA 4.770 . 5.490 3.370 2.750 4.167 . 0 0 "[ . 1 . 2]" 1
1068 1 34 LEU MD1 1 49 LYS HA 3.840 . 4.420 2.972 2.586 3.419 . 0 0 "[ . 1 . 2]" 1
1069 1 49 LYS HA 1 52 LEU MD1 3.560 . 4.090 2.606 2.095 3.232 . 0 0 "[ . 1 . 2]" 1
1070 1 31 VAL MG1 1 49 LYS HB2 4.330 . 4.980 3.899 3.089 4.770 . 0 0 "[ . 1 . 2]" 1
1071 1 49 LYS HB2 1 52 LEU MD1 5.290 . 6.080 4.313 3.483 5.017 . 0 0 "[ . 1 . 2]" 1
1072 1 34 LEU MD1 1 49 LYS HB3 5.320 . 6.120 4.676 4.230 5.304 . 0 0 "[ . 1 . 2]" 1
1073 1 49 LYS HB3 1 53 ILE MD 5.620 . 6.460 4.337 3.803 4.950 . 0 0 "[ . 1 . 2]" 1
1074 1 34 LEU MD1 1 49 LYS HG3 4.010 . 4.610 2.753 1.934 3.985 . 0 0 "[ . 1 . 2]" 1
1075 1 34 LEU MD1 1 49 LYS HD2 4.300 . 4.950 3.209 1.964 4.374 . 0 0 "[ . 1 . 2]" 1
1076 1 34 LEU MD1 1 49 LYS HD3 4.300 . 4.950 3.966 3.106 4.844 . 0 0 "[ . 1 . 2]" 1
1077 1 48 THR HB 1 50 THR HB 5.720 . 6.580 4.369 3.578 5.415 . 0 0 "[ . 1 . 2]" 1
1078 1 50 THR HA 1 53 ILE MD 3.580 . 4.120 2.597 2.134 3.214 . 0 0 "[ . 1 . 2]" 1
1079 1 50 THR HB 1 53 ILE MD 5.200 . 5.980 5.245 4.715 5.865 . 0 0 "[ . 1 . 2]" 1
1080 1 50 THR HB 1 53 ILE HB 5.930 . 6.820 5.584 4.918 6.163 . 0 0 "[ . 1 . 2]" 1
1081 1 49 LYS HB3 1 50 THR HB 5.420 . 6.230 5.081 4.729 5.669 . 0 0 "[ . 1 . 2]" 1
1082 1 50 THR HB 1 51 GLU HB2 5.030 . 5.780 4.786 4.301 5.371 . 0 0 "[ . 1 . 2]" 1
1083 1 50 THR MG 1 54 GLU HG3 4.540 . 5.220 3.400 2.458 5.244 0.024 4 0 "[ . 1 . 2]" 1
1084 1 50 THR MG 1 54 GLU HG2 4.540 . 5.220 3.470 2.605 4.459 . 0 0 "[ . 1 . 2]" 1
1085 1 50 THR MG 1 53 ILE HB 4.480 . 5.150 3.898 3.245 4.546 . 0 0 "[ . 1 . 2]" 1
1086 1 50 THR MG 1 53 ILE MD 3.860 . 4.440 3.709 2.955 4.454 0.014 10 0 "[ . 1 . 2]" 1
1087 1 50 THR MG 1 51 GLU HA 4.690 . 5.390 3.858 3.460 5.331 . 0 0 "[ . 1 . 2]" 1
1088 1 47 GLY HA3 1 51 GLU HB3 5.280 . 6.070 3.327 2.770 4.318 . 0 0 "[ . 1 . 2]" 1
1089 1 48 THR HB 1 51 GLU HB2 5.760 . 6.620 4.666 3.929 5.101 . 0 0 "[ . 1 . 2]" 1
1090 1 51 GLU HB3 1 52 LEU MD2 5.450 . 6.270 3.658 2.713 4.176 . 0 0 "[ . 1 . 2]" 1
1091 1 50 THR H 1 51 GLU HB2 6.000 . 6.900 4.779 4.467 4.960 . 0 0 "[ . 1 . 2]" 1
1092 1 51 GLU HB2 1 53 ILE H 6.000 . 6.900 5.133 4.993 5.356 . 0 0 "[ . 1 . 2]" 1
1093 1 34 LEU H 1 52 LEU MD2 6.000 . 6.900 6.399 5.797 6.836 . 0 0 "[ . 1 . 2]" 1
1094 1 38 LEU H 1 52 LEU MD2 6.000 . 6.900 5.802 5.365 6.126 . 0 0 "[ . 1 . 2]" 1
1095 1 31 VAL H 1 52 LEU MD1 6.000 . 6.900 5.187 4.619 5.651 . 0 0 "[ . 1 . 2]" 1
1096 1 51 GLU H 1 52 LEU MD2 5.880 . 6.760 4.841 4.519 5.113 . 0 0 "[ . 1 . 2]" 1
1097 1 47 GLY HA3 1 52 LEU MD2 5.000 . 5.750 2.944 2.475 3.578 . 0 0 "[ . 1 . 2]" 1
1098 1 45 VAL HA 1 52 LEU MD1 6.000 . 6.900 4.181 3.560 5.242 . 0 0 "[ . 1 . 2]" 1
1099 1 48 THR HA 1 52 LEU MD1 6.000 . 6.900 4.335 4.067 4.874 . 0 0 "[ . 1 . 2]" 1
1100 1 34 LEU HG 1 52 LEU HB3 5.870 . 6.750 5.073 4.748 5.538 . 0 0 "[ . 1 . 2]" 1
1101 1 38 LEU HG 1 52 LEU HB3 6.000 . 6.900 3.888 3.335 4.338 . 0 0 "[ . 1 . 2]" 1
1102 1 52 LEU HB3 1 53 ILE HG13 4.870 . 5.600 4.660 4.424 4.986 . 0 0 "[ . 1 . 2]" 1
1103 1 52 LEU HB2 1 53 ILE HG13 4.840 . 5.570 3.265 3.063 3.517 . 0 0 "[ . 1 . 2]" 1
1104 1 49 LYS HA 1 52 LEU MD2 5.070 . 5.830 4.521 3.850 5.019 . 0 0 "[ . 1 . 2]" 1
1105 1 35 LYS HE3 1 52 LEU MD1 4.710 . 5.420 2.775 2.322 3.939 . 0 0 "[ . 1 . 2]" 1
1106 1 45 VAL HB 1 52 LEU MD1 6.000 . 6.900 4.410 3.808 5.555 . 0 0 "[ . 1 . 2]" 1
1107 1 51 GLU HB2 1 52 LEU MD1 6.000 . 6.900 4.984 4.707 5.394 . 0 0 "[ . 1 . 2]" 1
1108 1 35 LYS HG3 1 52 LEU MD1 3.520 . 4.050 2.497 2.094 3.437 . 0 0 "[ . 1 . 2]" 1
1109 1 35 LYS HD2 1 52 LEU MD1 5.230 . 6.010 4.205 3.745 5.231 . 0 0 "[ . 1 . 2]" 1
1110 1 35 LYS HG2 1 52 LEU MD1 4.040 . 4.650 2.851 2.453 3.846 . 0 0 "[ . 1 . 2]" 1
1111 1 38 LEU MD1 1 52 LEU MD1 3.310 . 3.810 2.703 2.294 3.279 . 0 0 "[ . 1 . 2]" 1
1112 1 38 LEU MD1 1 52 LEU MD2 2.980 . 3.430 1.831 1.768 1.929 0.032 6 0 "[ . 1 . 2]" 1
1113 1 35 LYS HG2 1 52 LEU MD2 5.100 . 5.870 3.327 2.515 4.069 . 0 0 "[ . 1 . 2]" 1
1114 1 35 LYS HD3 1 52 LEU MD2 6.000 . 6.900 5.108 4.185 6.041 . 0 0 "[ . 1 . 2]" 1
1115 1 38 LEU HG 1 52 LEU MD2 6.000 . 6.900 4.107 3.682 4.325 . 0 0 "[ . 1 . 2]" 1
1116 1 35 LYS HG3 1 52 LEU MD2 3.970 . 4.570 3.964 3.203 4.566 . 0 0 "[ . 1 . 2]" 1
1117 1 45 VAL HB 1 52 LEU MD2 5.070 . 5.830 4.086 3.456 4.660 . 0 0 "[ . 1 . 2]" 1
1118 1 51 GLU HB2 1 52 LEU MD2 5.350 . 6.150 3.519 3.086 4.150 . 0 0 "[ . 1 . 2]" 1
1119 1 35 LYS HE3 1 52 LEU MD2 5.010 . 5.760 4.139 3.277 5.089 . 0 0 "[ . 1 . 2]" 1
1120 1 52 LEU MD2 1 55 ARG HD3 5.800 . 6.670 5.065 4.131 5.970 . 0 0 "[ . 1 . 2]" 1
1121 1 38 LEU MD1 1 52 LEU HA 3.730 . 4.290 2.801 2.319 3.279 . 0 0 "[ . 1 . 2]" 1
1122 1 38 LEU MD1 1 52 LEU HG 5.430 . 6.240 4.022 3.790 4.226 . 0 0 "[ . 1 . 2]" 1
1123 1 28 ASP H 1 53 ILE MD 5.740 . 6.600 4.882 4.526 5.484 . 0 0 "[ . 1 . 2]" 1
1124 1 53 ILE MG 1 56 LEU H 5.140 . 5.910 4.779 4.628 4.970 . 0 0 "[ . 1 . 2]" 1
1125 1 27 ASP HA 1 53 ILE MG 4.980 . 5.730 4.040 3.080 4.725 . 0 0 "[ . 1 . 2]" 1
1126 1 53 ILE HA 1 56 LEU MD2 5.240 . 6.030 5.030 4.748 5.326 . 0 0 "[ . 1 . 2]" 1
1127 1 52 LEU HB3 1 53 ILE HA 5.690 . 6.540 4.537 4.400 4.673 . 0 0 "[ . 1 . 2]" 1
1128 1 52 LEU HB2 1 53 ILE HA 5.790 . 6.660 4.162 4.014 4.274 . 0 0 "[ . 1 . 2]" 1
1129 1 52 LEU HA 1 53 ILE HA 5.680 . 6.530 4.812 4.774 4.847 . 0 0 "[ . 1 . 2]" 1
1130 1 53 ILE HA 1 54 GLU HA 5.120 . 5.890 4.745 4.626 4.808 . 0 0 "[ . 1 . 2]" 1
1131 1 53 ILE HB 1 54 GLU HA 5.610 . 6.450 4.222 4.031 4.322 . 0 0 "[ . 1 . 2]" 1
1132 1 52 LEU HA 1 53 ILE MG 6.000 . 6.900 6.147 6.127 6.165 . 0 0 "[ . 1 . 2]" 1
1133 1 26 LEU HB3 1 53 ILE MG 4.110 . 4.730 2.362 1.978 3.000 . 0 0 "[ . 1 . 2]" 1
1134 1 50 THR MG 1 53 ILE MG 4.570 . 5.260 4.475 3.820 5.186 . 0 0 "[ . 1 . 2]" 1
1135 1 49 LYS HG2 1 53 ILE HG13 6.000 . 6.900 3.800 2.596 5.585 . 0 0 "[ . 1 . 2]" 1
1136 1 49 LYS HG3 1 53 ILE HG13 6.000 . 6.900 3.553 2.923 3.933 . 0 0 "[ . 1 . 2]" 1
1137 1 49 LYS HG2 1 53 ILE MD 3.790 . 4.360 2.903 1.974 4.279 . 0 0 "[ . 1 . 2]" 1
1138 1 49 LYS HG3 1 53 ILE MD 3.790 . 4.360 3.041 2.319 3.698 . 0 0 "[ . 1 . 2]" 1
1139 1 26 LEU HB3 1 53 ILE MD 4.670 . 5.370 3.532 3.163 4.340 . 0 0 "[ . 1 . 2]" 1
1140 1 26 LEU HB2 1 53 ILE MD 5.440 . 6.260 3.673 3.037 4.496 . 0 0 "[ . 1 . 2]" 1
1141 1 52 LEU HB2 1 53 ILE MD 5.280 . 6.070 4.697 4.512 4.934 . 0 0 "[ . 1 . 2]" 1
1142 1 27 ASP HB3 1 53 ILE MD 5.380 . 6.190 3.764 2.551 4.508 . 0 0 "[ . 1 . 2]" 1
1143 1 26 LEU HA 1 53 ILE MD 6.000 . 6.900 4.815 4.398 5.507 . 0 0 "[ . 1 . 2]" 1
1144 1 53 ILE MG 1 54 GLU HA 4.160 . 4.780 3.270 3.074 3.482 . 0 0 "[ . 1 . 2]" 1
1145 1 54 GLU HG2 1 58 ALA MB 6.000 . 6.900 6.235 5.062 6.810 . 0 0 "[ . 1 . 2]" 1
1146 1 53 ILE MG 1 54 GLU HG2 5.520 . 6.350 3.994 3.233 5.954 . 0 0 "[ . 1 . 2]" 1
1147 1 54 GLU HG3 1 58 ALA MB 6.000 . 6.900 6.091 3.583 6.908 0.008 20 0 "[ . 1 . 2]" 1
1148 1 53 ILE MG 1 54 GLU HG3 5.520 . 6.350 4.730 3.195 5.793 . 0 0 "[ . 1 . 2]" 1
1149 1 50 THR MG 1 54 GLU HB2 5.590 . 6.430 4.133 2.841 5.790 . 0 0 "[ . 1 . 2]" 1
1150 1 53 ILE MG 1 54 GLU HB2 5.200 . 5.980 4.869 4.226 5.255 . 0 0 "[ . 1 . 2]" 1
1151 1 52 LEU H 1 54 GLU HB2 6.000 . 6.900 5.421 4.987 5.936 . 0 0 "[ . 1 . 2]" 1
1152 1 35 LYS HG3 1 36 GLN H 5.840 . 6.720 4.517 4.360 4.708 . 0 0 "[ . 1 . 2]" 1
1153 1 43 LEU MD1 1 55 ARG HG2 4.390 . 5.050 3.219 2.455 3.898 . 0 0 "[ . 1 . 2]" 1
1154 1 38 LEU MD1 1 55 ARG HD2 4.850 . 5.580 3.626 2.767 5.390 . 0 0 "[ . 1 . 2]" 1
1155 1 38 LEU MD2 1 55 ARG HD2 3.870 . 4.450 2.880 1.831 4.462 0.012 15 0 "[ . 1 . 2]" 1
1156 1 43 LEU MD1 1 55 ARG HD2 5.830 . 6.700 4.543 3.433 5.747 . 0 0 "[ . 1 . 2]" 1
1157 1 52 LEU MD2 1 55 ARG HD2 5.800 . 6.670 3.820 2.943 4.766 . 0 0 "[ . 1 . 2]" 1
1158 1 38 LEU MD2 1 55 ARG HD3 3.870 . 4.450 3.585 2.898 4.494 0.044 3 0 "[ . 1 . 2]" 1
1159 1 43 LEU MD1 1 55 ARG HD3 5.830 . 6.700 4.569 3.710 5.390 . 0 0 "[ . 1 . 2]" 1
1160 1 44 PRO HD2 1 55 ARG HD3 4.640 . 5.340 2.368 1.795 3.387 0.005 8 0 "[ . 1 . 2]" 1
1161 1 38 LEU HA 1 55 ARG HG2 6.000 . 6.900 5.705 5.206 6.568 . 0 0 "[ . 1 . 2]" 1
1162 1 52 LEU HA 1 55 ARG HG2 6.000 . 6.900 4.788 4.093 5.617 . 0 0 "[ . 1 . 2]" 1
1163 1 38 LEU MD2 1 55 ARG HB2 4.890 . 5.620 4.012 3.266 4.539 . 0 0 "[ . 1 . 2]" 1
1164 1 37 GLU H 1 56 LEU MD2 5.440 . 6.260 4.592 4.252 4.981 . 0 0 "[ . 1 . 2]" 1
1165 1 56 LEU MD2 1 59 TYR QD 5.450 . 6.270 3.951 3.058 4.313 . 0 0 "[ . 1 . 2]" 1
1166 1 41 ARG H 1 56 LEU MD2 5.960 . 6.850 5.211 4.838 5.696 . 0 0 "[ . 1 . 2]" 1
1167 1 56 LEU MD2 1 59 TYR QE 6.000 . 6.900 5.164 4.261 5.590 . 0 0 "[ . 1 . 2]" 1
1168 1 37 GLU H 1 56 LEU MD1 4.910 . 5.650 4.463 4.055 4.852 . 0 0 "[ . 1 . 2]" 1
1169 1 38 LEU MD2 1 46 SER H 5.670 . 6.520 5.778 5.381 6.173 . 0 0 "[ . 1 . 2]" 1
1170 1 38 LEU MD2 1 59 TYR QD 6.000 . 6.900 5.219 4.518 5.515 . 0 0 "[ . 1 . 2]" 1
1171 1 38 LEU MD2 1 41 ARG H 5.640 . 6.490 5.222 4.960 5.371 . 0 0 "[ . 1 . 2]" 1
1172 1 55 ARG H 1 56 LEU HB2 6.000 . 6.900 4.654 4.577 4.787 . 0 0 "[ . 1 . 2]" 1
1173 1 37 GLU HB2 1 56 LEU MD2 4.000 . 4.600 2.776 2.376 3.219 . 0 0 "[ . 1 . 2]" 1
1174 1 37 GLU HB3 1 56 LEU MD2 4.000 . 4.600 2.611 2.197 3.284 . 0 0 "[ . 1 . 2]" 1
1175 1 41 ARG HD2 1 56 LEU MD2 4.190 . 4.820 3.259 2.321 4.570 . 0 0 "[ . 1 . 2]" 1
1176 1 41 ARG HD3 1 56 LEU MD2 4.190 . 4.820 3.749 2.859 4.847 0.027 13 0 "[ . 1 . 2]" 1
1177 1 38 LEU HA 1 56 LEU MD2 3.710 . 4.270 2.851 2.331 3.425 . 0 0 "[ . 1 . 2]" 1
1178 1 53 ILE HA 1 56 LEU MD1 4.910 . 5.650 2.633 2.246 2.969 . 0 0 "[ . 1 . 2]" 1
1179 1 43 LEU MD1 1 56 LEU HA 4.130 . 4.750 2.801 2.154 3.658 . 0 0 "[ . 1 . 2]" 1
1180 1 56 LEU HA 1 59 TYR QD 5.130 . 5.900 4.117 3.348 4.581 . 0 0 "[ . 1 . 2]" 1
1181 1 22 LEU MD1 1 57 ARG HA 3.380 . 3.890 2.394 1.864 2.942 . 0 0 "[ . 1 . 2]" 1
1182 1 56 LEU MD1 1 57 ARG HA 5.780 . 6.650 5.696 5.616 5.774 . 0 0 "[ . 1 . 2]" 1
1183 1 53 ILE MG 1 57 ARG HB2 4.580 . 5.270 4.295 3.552 4.890 . 0 0 "[ . 1 . 2]" 1
1184 1 53 ILE MG 1 57 ARG HG2 3.720 . 4.280 3.872 3.503 4.337 0.057 6 0 "[ . 1 . 2]" 1
1185 1 53 ILE MG 1 57 ARG HG3 3.570 . 4.110 2.952 2.552 3.819 . 0 0 "[ . 1 . 2]" 1
1186 1 53 ILE MG 1 57 ARG HD2 4.330 . 4.980 2.516 2.048 3.968 . 0 0 "[ . 1 . 2]" 1
1187 1 53 ILE MG 1 57 ARG HD3 4.330 . 4.980 2.952 1.823 4.129 . 0 0 "[ . 1 . 2]" 1
1188 1 57 ARG HB2 1 58 ALA HA 5.650 . 6.500 4.379 4.036 4.809 . 0 0 "[ . 1 . 2]" 1
1189 1 57 ARG HB3 1 58 ALA HA 6.000 . 6.900 4.344 4.033 4.671 . 0 0 "[ . 1 . 2]" 1
1190 1 57 ARG HB2 1 58 ALA MB 4.100 . 4.720 3.975 3.719 4.330 . 0 0 "[ . 1 . 2]" 1
1191 1 43 LEU MD2 1 58 ALA MB 5.320 . 6.120 4.754 3.884 5.656 . 0 0 "[ . 1 . 2]" 1
1192 1 58 ALA MB 1 61 ASP HB2 5.120 . 5.890 4.832 4.309 5.478 . 0 0 "[ . 1 . 2]" 1
1193 1 58 ALA MB 1 61 ASP HB3 5.380 . 6.190 4.100 3.698 4.600 . 0 0 "[ . 1 . 2]" 1
1194 1 54 GLU HA 1 58 ALA MB 4.520 . 5.200 4.661 4.337 4.886 . 0 0 "[ . 1 . 2]" 1
1195 1 55 ARG H 1 58 ALA MB 5.360 . 6.160 4.773 4.573 4.920 . 0 0 "[ . 1 . 2]" 1
1196 1 58 ALA MB 1 60 GLN H 5.960 . 6.850 4.658 4.286 4.897 . 0 0 "[ . 1 . 2]" 1
1197 1 57 ARG H 1 58 ALA MB 4.790 . 5.510 4.409 4.291 4.521 . 0 0 "[ . 1 . 2]" 1
1198 1 58 ALA H 1 59 TYR HB3 6.000 . 6.900 4.865 4.606 5.046 . 0 0 "[ . 1 . 2]" 1
1199 1 58 ALA H 1 59 TYR HB2 6.000 . 6.900 5.019 4.848 5.227 . 0 0 "[ . 1 . 2]" 1
1200 1 55 ARG HG2 1 59 TYR HB3 5.790 . 6.660 5.196 4.232 6.688 0.028 3 0 "[ . 1 . 2]" 1
1201 1 55 ARG HG2 1 59 TYR HB2 5.790 . 6.660 4.231 3.420 5.568 . 0 0 "[ . 1 . 2]" 1
1202 1 43 LEU MD2 1 59 TYR HB2 5.010 . 5.760 2.399 1.776 3.108 0.024 17 0 "[ . 1 . 2]" 1
1203 1 59 TYR HA 1 62 GLN HG2 4.730 . 5.440 2.543 2.092 4.673 . 0 0 "[ . 1 . 2]" 1
1204 1 58 ALA MB 1 59 TYR HA 4.670 . 5.370 3.865 3.768 3.932 . 0 0 "[ . 1 . 2]" 1
1205 1 43 LEU MD2 1 59 TYR HA 5.760 . 6.620 4.101 3.645 4.888 . 0 0 "[ . 1 . 2]" 1
1206 1 43 LEU MD1 1 59 TYR HA 5.220 . 6.000 4.681 4.351 5.734 . 0 0 "[ . 1 . 2]" 1
1207 1 41 ARG HB2 1 59 TYR QE 5.140 . 5.910 4.092 3.585 4.656 . 0 0 "[ . 1 . 2]" 1
1208 1 43 LEU HG 1 59 TYR QE 5.190 . 5.970 4.089 3.419 4.772 . 0 0 "[ . 1 . 2]" 1
1209 1 59 TYR QE 1 63 ILE MD 3.990 . 4.590 2.724 2.279 3.857 . 0 0 "[ . 1 . 2]" 1
1210 1 43 LEU MD1 1 59 TYR QE 4.930 . 5.670 3.684 3.156 4.203 . 0 0 "[ . 1 . 2]" 1
1211 1 60 GLN HA 1 63 ILE HG13 4.470 . 5.140 2.743 2.285 3.474 . 0 0 "[ . 1 . 2]" 1
1212 1 60 GLN HA 1 63 ILE MD 3.820 . 4.390 2.595 1.775 4.058 0.025 14 0 "[ . 1 . 2]" 1
1213 1 22 LEU MD1 1 60 GLN HB2 4.400 . 5.060 2.326 2.004 3.050 . 0 0 "[ . 1 . 2]" 1
1214 1 22 LEU MD2 1 60 GLN HB3 3.990 . 4.590 4.454 3.797 4.641 0.051 12 0 "[ . 1 . 2]" 1
1215 1 59 TYR QD 1 60 GLN HA 4.190 . 4.820 3.663 3.360 4.063 . 0 0 "[ . 1 . 2]" 1
1216 1 60 GLN HA 1 62 GLN H 4.720 . 5.430 4.302 3.928 4.502 . 0 0 "[ . 1 . 2]" 1
1217 1 59 TYR QD 1 60 GLN HB2 6.000 . 6.900 3.996 3.311 4.829 . 0 0 "[ . 1 . 2]" 1
1218 1 59 TYR QD 1 60 GLN HB3 5.780 . 6.650 5.269 4.663 5.990 . 0 0 "[ . 1 . 2]" 1
1219 1 61 ASP HB3 1 62 GLN HG2 4.030 . 4.630 4.256 3.894 4.648 0.018 13 0 "[ . 1 . 2]" 1
1220 1 61 ASP HA 1 62 GLN HG2 5.730 . 6.590 5.503 5.256 5.950 . 0 0 "[ . 1 . 2]" 1
1221 1 57 ARG HA 1 61 ASP HB2 5.240 . 6.030 4.667 4.181 5.078 . 0 0 "[ . 1 . 2]" 1
1222 1 61 ASP HB3 1 62 GLN HA 5.340 . 6.140 4.326 4.076 4.562 . 0 0 "[ . 1 . 2]" 1
1223 1 58 ALA MB 1 62 GLN HG3 6.000 . 6.900 5.974 4.466 6.428 . 0 0 "[ . 1 . 2]" 1
1224 1 62 GLN HG3 1 63 ILE MG 6.000 . 6.900 5.342 4.807 6.917 0.017 8 0 "[ . 1 . 2]" 1
1225 1 62 GLN HG3 1 63 ILE MD 6.000 . 6.900 4.216 3.022 5.812 . 0 0 "[ . 1 . 2]" 1
1226 1 60 GLN HA 1 62 GLN HG3 5.870 . 6.750 5.296 4.409 5.689 . 0 0 "[ . 1 . 2]" 1
1227 1 58 ALA MB 1 62 GLN HG2 5.100 . 5.870 4.727 4.353 5.186 . 0 0 "[ . 1 . 2]" 1
1228 1 59 TYR QE 1 63 ILE MG 5.920 . 6.810 5.173 4.570 6.581 . 0 0 "[ . 1 . 2]" 1
1229 1 59 TYR QE 1 63 ILE HG12 5.950 . 6.840 4.509 3.524 5.929 . 0 0 "[ . 1 . 2]" 1
1230 1 59 TYR QE 1 63 ILE HG13 5.950 . 6.840 4.408 3.547 5.712 . 0 0 "[ . 1 . 2]" 1
1231 1 59 TYR QD 1 63 ILE MD 4.660 . 5.360 3.208 2.504 4.230 . 0 0 "[ . 1 . 2]" 1
1232 1 60 GLN HA 1 63 ILE HG12 4.470 . 5.140 3.653 1.894 4.897 . 0 0 "[ . 1 . 2]" 1
1233 1 60 GLN HA 1 63 ILE MG 6.000 . 6.900 4.076 3.709 4.615 . 0 0 "[ . 1 . 2]" 1
1234 1 60 GLN HA 1 63 ILE HB 4.380 . 5.040 2.968 2.456 3.783 . 0 0 "[ . 1 . 2]" 1
1235 1 62 GLN HB2 1 63 ILE HA 6.000 . 6.900 4.772 4.249 4.938 . 0 0 "[ . 1 . 2]" 1
1236 1 62 GLN HB3 1 63 ILE HA 6.000 . 6.900 5.769 4.773 5.883 . 0 0 "[ . 1 . 2]" 1
1237 1 64 SER H 1 65 PRO HD2 6.000 . 6.900 4.819 3.398 5.414 . 0 0 "[ . 1 . 2]" 1
1238 1 64 SER H 1 65 PRO HD3 6.000 . 6.900 4.221 2.114 5.213 . 0 0 "[ . 1 . 2]" 1
1239 1 66 VAL HB 1 69 ALA MB 4.410 . 5.070 3.624 1.872 5.086 0.016 5 0 "[ . 1 . 2]" 1
1240 1 69 ALA MB 1 70 PRO HD3 3.650 . 4.200 3.370 2.574 4.021 . 0 0 "[ . 1 . 2]" 1
1241 1 13 THR HB 1 14 PRO HD3 4.060 . 4.670 4.172 3.406 4.742 0.072 8 0 "[ . 1 . 2]" 1
1242 1 18 LYS HB2 1 19 PRO HD3 5.250 . 6.040 4.487 2.696 5.200 . 0 0 "[ . 1 . 2]" 1
1243 1 18 LYS HB2 1 19 PRO HD2 5.250 . 6.040 4.202 2.188 5.160 . 0 0 "[ . 1 . 2]" 1
1244 1 18 LYS HB3 1 19 PRO HD2 5.250 . 6.040 3.532 2.416 4.848 . 0 0 "[ . 1 . 2]" 1
1245 1 18 LYS HG2 1 19 PRO HD2 6.000 . 6.900 4.539 3.463 5.919 . 0 0 "[ . 1 . 2]" 1
1246 1 18 LYS HG3 1 19 PRO HD3 6.000 . 6.900 4.973 3.579 6.441 . 0 0 "[ . 1 . 2]" 1
1247 1 18 LYS HG3 1 19 PRO HD2 6.000 . 6.900 4.700 3.078 5.840 . 0 0 "[ . 1 . 2]" 1
1248 1 22 LEU MD2 1 57 ARG HA 5.790 . 6.660 4.801 3.891 5.687 . 0 0 "[ . 1 . 2]" 1
1249 1 22 LEU MD2 1 60 GLN HA 6.000 . 6.900 4.952 4.508 5.317 . 0 0 "[ . 1 . 2]" 1
1250 1 22 LEU MD1 1 60 GLN HB3 4.810 . 5.530 2.788 2.326 3.800 . 0 0 "[ . 1 . 2]" 1
1251 1 22 LEU MD2 1 60 GLN HB2 4.070 . 4.680 3.315 2.794 4.520 . 0 0 "[ . 1 . 2]" 1
1252 1 22 LEU HG 1 60 GLN HB2 4.540 . 5.220 2.530 2.072 3.868 . 0 0 "[ . 1 . 2]" 1
1253 1 23 PRO HG3 1 26 LEU HA 5.010 . 5.760 5.108 4.781 5.500 . 0 0 "[ . 1 . 2]" 1
1254 1 26 LEU HB3 1 53 ILE HG12 4.260 . 4.900 2.719 2.124 3.380 . 0 0 "[ . 1 . 2]" 1
1255 1 26 LEU HB2 1 53 ILE HG12 5.140 . 5.910 3.818 3.033 4.767 . 0 0 "[ . 1 . 2]" 1
1256 1 23 PRO HG3 1 26 LEU MD2 3.770 . 4.340 3.423 3.062 3.833 . 0 0 "[ . 1 . 2]" 1
1257 1 26 LEU HA 1 29 MET ME 4.180 . 4.810 3.748 1.994 4.609 . 0 0 "[ . 1 . 2]" 1
1258 1 30 LYS HB2 1 33 GLU HG2 4.450 . 5.120 1.977 1.780 3.247 0.020 18 0 "[ . 1 . 2]" 1
1259 1 30 LYS HB3 1 32 ALA MB 4.780 . 5.500 3.734 3.148 4.137 . 0 0 "[ . 1 . 2]" 1
1260 1 30 LYS HB2 1 31 VAL MG2 6.000 . 6.900 5.019 4.749 5.272 . 0 0 "[ . 1 . 2]" 1
1261 1 29 MET ME 1 33 GLU HB2 4.680 . 5.380 2.689 1.979 3.305 . 0 0 "[ . 1 . 2]" 1
1262 1 30 LYS HB2 1 33 GLU HG3 4.450 . 5.120 3.108 2.565 4.238 . 0 0 "[ . 1 . 2]" 1
1263 1 30 LYS HG2 1 33 GLU HG3 5.810 . 6.680 4.805 4.032 5.599 . 0 0 "[ . 1 . 2]" 1
1264 1 30 LYS HG2 1 33 GLU HG2 5.810 . 6.680 4.441 3.915 5.311 . 0 0 "[ . 1 . 2]" 1
1265 1 32 ALA MB 1 33 GLU HG2 4.950 . 5.690 3.451 3.231 3.987 . 0 0 "[ . 1 . 2]" 1
1266 1 30 LYS HB2 1 33 GLU HB2 4.840 . 5.570 3.573 2.339 5.598 0.028 4 0 "[ . 1 . 2]" 1
1267 1 33 GLU HB2 1 34 LEU HG 5.410 . 6.220 3.529 3.181 4.748 . 0 0 "[ . 1 . 2]" 1
1268 1 32 ALA MB 1 33 GLU HB2 5.760 . 6.620 4.810 4.594 5.142 . 0 0 "[ . 1 . 2]" 1
1269 1 30 LYS HB2 1 33 GLU HB3 5.060 . 5.820 4.549 3.745 5.038 . 0 0 "[ . 1 . 2]" 1
1270 1 29 MET ME 1 33 GLU HG3 4.630 . 5.320 3.694 2.707 4.885 . 0 0 "[ . 1 . 2]" 1
1271 1 29 MET ME 1 33 GLU HG2 4.630 . 5.320 4.427 3.117 5.370 0.050 17 0 "[ . 1 . 2]" 1
1272 1 33 GLU HA 1 34 LEU HA 4.770 . 5.490 4.791 4.741 4.821 . 0 0 "[ . 1 . 2]" 1
1273 1 34 LEU HB2 1 52 LEU HB3 4.580 . 5.270 3.283 2.894 3.752 . 0 0 "[ . 1 . 2]" 1
1274 1 34 LEU HB3 1 52 LEU HB3 4.580 . 5.270 2.512 2.157 3.042 . 0 0 "[ . 1 . 2]" 1
1275 1 34 LEU HB2 1 35 LYS HG3 5.290 . 6.080 3.527 3.328 4.027 . 0 0 "[ . 1 . 2]" 1
1276 1 34 LEU HB3 1 35 LYS HG3 5.290 . 6.080 4.705 4.370 5.247 . 0 0 "[ . 1 . 2]" 1
1277 1 34 LEU MD1 1 53 ILE HG13 3.700 . 4.260 2.325 2.127 2.911 . 0 0 "[ . 1 . 2]" 1
1278 1 29 MET ME 1 34 LEU MD1 4.780 . 5.500 4.621 4.015 5.475 . 0 0 "[ . 1 . 2]" 1
1279 1 34 LEU MD1 1 52 LEU HG 5.080 . 5.840 3.954 3.587 4.523 . 0 0 "[ . 1 . 2]" 1
1280 1 34 LEU MD1 1 49 LYS HG2 4.010 . 4.610 3.535 2.690 4.618 0.008 8 0 "[ . 1 . 2]" 1
1281 1 34 LEU MD1 1 52 LEU HB3 3.830 . 4.400 2.967 2.587 3.319 . 0 0 "[ . 1 . 2]" 1
1282 1 34 LEU MD1 1 52 LEU HB2 3.850 . 4.430 2.170 1.856 2.622 . 0 0 "[ . 1 . 2]" 1
1283 1 34 LEU MD2 1 52 LEU HB3 3.870 . 4.450 4.016 3.722 4.441 . 0 0 "[ . 1 . 2]" 1
1284 1 35 LYS HB2 1 52 LEU MD1 5.000 . 5.750 4.442 4.017 5.269 . 0 0 "[ . 1 . 2]" 1
1285 1 35 LYS HB3 1 52 LEU MD1 5.470 . 6.290 4.695 4.233 5.641 . 0 0 "[ . 1 . 2]" 1
1286 1 38 LEU HA 1 43 LEU HB2 4.010 . 4.610 2.050 1.788 2.350 0.012 8 0 "[ . 1 . 2]" 1
1287 1 38 LEU HA 1 43 LEU HB3 4.370 . 5.030 3.386 3.122 3.603 . 0 0 "[ . 1 . 2]" 1
1288 1 36 GLN HA 1 39 LYS HE2 5.580 . 6.420 4.495 3.803 5.222 . 0 0 "[ . 1 . 2]" 1
1289 1 36 GLN HA 1 39 LYS HE3 5.580 . 6.420 3.965 2.251 5.666 . 0 0 "[ . 1 . 2]" 1
1290 1 39 LYS HG3 1 40 LEU MD2 3.990 . 4.590 2.984 2.670 3.611 . 0 0 "[ . 1 . 2]" 1
1291 1 36 GLN HG2 1 39 LYS HD2 5.630 . 6.470 4.834 4.266 5.979 . 0 0 "[ . 1 . 2]" 1
1292 1 36 GLN HG2 1 39 LYS HD3 5.630 . 6.470 5.274 3.850 6.523 0.053 11 0 "[ . 1 . 2]" 1
1293 1 36 GLN HB3 1 40 LEU MD1 4.670 . 5.370 3.312 2.784 3.610 . 0 0 "[ . 1 . 2]" 1
1294 1 40 LEU MD2 1 41 ARG HG2 6.000 . 6.900 6.209 5.701 6.677 . 0 0 "[ . 1 . 2]" 1
1295 1 40 LEU MD2 1 41 ARG HG3 6.000 . 6.900 5.437 5.030 5.664 . 0 0 "[ . 1 . 2]" 1
1296 1 41 ARG HG3 1 43 LEU MD1 6.000 . 6.900 4.161 3.515 4.572 . 0 0 "[ . 1 . 2]" 1
1297 1 41 ARG HG2 1 43 LEU MD1 6.000 . 6.900 4.607 4.221 5.061 . 0 0 "[ . 1 . 2]" 1
1298 1 38 LEU MD2 1 43 LEU HB3 3.580 . 4.120 1.968 1.849 2.123 . 0 0 "[ . 1 . 2]" 1
1299 1 38 LEU MD1 1 43 LEU HB3 4.210 . 4.840 3.848 3.664 4.091 . 0 0 "[ . 1 . 2]" 1
1300 1 38 LEU MD1 1 43 LEU HB2 5.070 . 5.830 4.162 4.027 4.362 . 0 0 "[ . 1 . 2]" 1
1301 1 38 LEU HB2 1 43 LEU HB2 4.350 . 5.000 3.907 3.720 4.192 . 0 0 "[ . 1 . 2]" 1
1302 1 38 LEU MD2 1 43 LEU MD1 2.990 . 3.440 1.900 1.798 2.064 0.002 13 0 "[ . 1 . 2]" 1
1303 1 38 LEU MD2 1 43 LEU MD2 2.550 . 2.930 3.044 3.013 3.069 0.139 10 0 "[ . 1 . 2]" 1
1304 1 48 THR MG 1 51 GLU HB2 4.840 . 5.570 4.351 3.864 4.740 . 0 0 "[ . 1 . 2]" 1
1305 1 48 THR H 1 51 GLU HB3 4.050 . 4.660 3.607 2.535 4.087 . 0 0 "[ . 1 . 2]" 1
1306 1 34 LEU HB2 1 52 LEU HB2 4.690 . 5.390 3.598 3.129 4.085 . 0 0 "[ . 1 . 2]" 1
1307 1 34 LEU HB3 1 52 LEU HB2 4.690 . 5.390 3.180 2.647 3.812 . 0 0 "[ . 1 . 2]" 1
1308 1 35 LYS HA 1 52 LEU MD1 4.530 . 5.210 3.651 3.117 4.281 . 0 0 "[ . 1 . 2]" 1
1309 1 35 LYS HA 1 52 LEU MD2 4.320 . 4.970 4.000 3.506 4.444 . 0 0 "[ . 1 . 2]" 1
1310 1 34 LEU HB3 1 52 LEU MD1 3.930 . 4.520 3.080 2.580 3.530 . 0 0 "[ . 1 . 2]" 1
1311 1 34 LEU HB3 1 52 LEU MD2 4.910 . 5.650 4.276 3.768 4.681 . 0 0 "[ . 1 . 2]" 1
1312 1 31 VAL MG2 1 52 LEU MD1 3.610 . 4.150 3.388 2.479 3.786 . 0 0 "[ . 1 . 2]" 1
1313 1 34 LEU HB2 1 52 LEU MD1 3.930 . 4.520 2.470 2.068 3.051 . 0 0 "[ . 1 . 2]" 1
1314 1 34 LEU HB2 1 52 LEU MD2 4.910 . 5.650 4.431 3.904 4.877 . 0 0 "[ . 1 . 2]" 1
1315 1 34 LEU MD1 1 52 LEU MD1 3.000 . 3.450 2.546 2.279 2.999 . 0 0 "[ . 1 . 2]" 1
1316 1 38 LEU MD2 1 52 LEU MD2 3.760 . 4.320 3.438 3.167 3.800 . 0 0 "[ . 1 . 2]" 1
1317 1 21 ALA HA 1 63 ILE MD 5.600 . 6.440 5.259 3.540 6.516 0.076 11 0 "[ . 1 . 2]" 1
1318 1 66 VAL MG1 1 69 ALA H 5.040 . 5.800 4.732 3.496 5.436 . 0 0 "[ . 1 . 2]" 1
1319 1 66 VAL HB 1 67 PRO HD3 3.480 . 4.000 3.559 2.814 4.046 0.046 15 0 "[ . 1 . 2]" 1
1320 1 66 VAL HB 1 67 PRO HD2 3.480 . 4.000 2.874 1.805 3.894 . 0 0 "[ . 1 . 2]" 1
1321 1 69 ALA MB 1 70 PRO HD2 3.650 . 4.200 2.722 1.751 3.703 0.049 5 0 "[ . 1 . 2]" 1
1322 1 13 THR MG 1 14 PRO HD2 4.090 . 4.700 2.824 1.866 3.766 . 0 0 "[ . 1 . 2]" 1
1323 1 13 THR MG 1 14 PRO HD3 4.090 . 4.700 3.406 2.832 3.911 . 0 0 "[ . 1 . 2]" 1
1324 1 26 LEU HA 1 29 MET HB3 4.790 . 5.510 4.526 4.072 5.308 . 0 0 "[ . 1 . 2]" 1
1325 1 26 LEU HA 1 29 MET HB2 4.790 . 5.510 3.054 2.546 3.766 . 0 0 "[ . 1 . 2]" 1
1326 1 31 VAL MG2 1 32 ALA MB 5.200 . 5.980 4.893 4.788 4.991 . 0 0 "[ . 1 . 2]" 1
1327 1 31 VAL MG1 1 35 LYS HD2 3.510 . 4.040 3.138 2.745 3.630 . 0 0 "[ . 1 . 2]" 1
1328 1 31 VAL MG1 1 35 LYS HG2 3.810 . 4.380 3.932 3.694 4.242 . 0 0 "[ . 1 . 2]" 1
1329 1 31 VAL MG1 1 35 LYS HD3 3.880 . 4.460 4.258 4.008 4.476 0.016 7 0 "[ . 1 . 2]" 1
1330 1 31 VAL MG1 1 35 LYS HG3 3.660 . 4.210 2.806 2.623 3.174 . 0 0 "[ . 1 . 2]" 1
1331 1 31 VAL MG1 1 35 LYS HE2 3.570 . 4.110 3.441 3.194 3.725 . 0 0 "[ . 1 . 2]" 1
1332 1 31 VAL MG2 1 35 LYS HE2 6.000 . 6.900 5.965 5.747 6.263 . 0 0 "[ . 1 . 2]" 1
1333 1 35 LYS HB3 1 45 VAL HB 3.820 . 4.390 2.755 2.266 3.558 . 0 0 "[ . 1 . 2]" 1
1334 1 35 LYS HG2 1 38 LEU MD1 4.070 . 4.680 2.703 2.222 3.369 . 0 0 "[ . 1 . 2]" 1
1335 1 41 ARG HB2 1 43 LEU MD1 3.410 . 3.920 2.248 2.002 2.514 . 0 0 "[ . 1 . 2]" 1
1336 1 43 LEU MD2 1 55 ARG HD2 5.140 . 5.910 3.750 2.781 4.625 . 0 0 "[ . 1 . 2]" 1
1337 1 43 LEU MD1 1 44 PRO HD2 6.000 . 6.900 4.409 4.160 4.668 . 0 0 "[ . 1 . 2]" 1
1338 1 38 LEU MD1 1 43 LEU MD1 4.680 . 5.380 4.259 4.115 4.402 . 0 0 "[ . 1 . 2]" 1
1339 1 35 LYS HG2 1 45 VAL HA 5.120 . 5.890 3.186 2.888 3.754 . 0 0 "[ . 1 . 2]" 1
1340 1 35 LYS HA 1 45 VAL HA 4.580 . 5.270 3.636 3.150 4.462 . 0 0 "[ . 1 . 2]" 1
1341 1 38 LEU HB3 1 45 VAL HA 4.720 . 5.430 3.378 2.958 3.698 . 0 0 "[ . 1 . 2]" 1
1342 1 35 LYS HB2 1 45 VAL HB 4.880 . 5.610 4.179 3.836 4.689 . 0 0 "[ . 1 . 2]" 1
1343 1 49 LYS HG3 1 52 LEU MD1 6.000 . 6.900 4.390 3.172 5.729 . 0 0 "[ . 1 . 2]" 1
1344 1 49 LYS HG3 1 53 ILE HG12 6.000 . 6.900 4.554 3.968 5.015 . 0 0 "[ . 1 . 2]" 1
1345 1 49 LYS HB3 1 52 LEU MD1 5.410 . 6.220 5.205 4.544 5.843 . 0 0 "[ . 1 . 2]" 1
1346 1 49 LYS HG2 1 52 LEU MD1 6.000 . 6.900 5.241 4.329 6.280 . 0 0 "[ . 1 . 2]" 1
1347 1 49 LYS HG2 1 53 ILE HG12 6.000 . 6.900 4.847 3.611 6.500 . 0 0 "[ . 1 . 2]" 1
1348 1 31 VAL MG2 1 49 LYS HE2 4.830 . 5.550 4.710 2.844 5.462 . 0 0 "[ . 1 . 2]" 1
1349 1 55 ARG H 1 56 LEU MD2 6.000 . 6.900 5.710 5.493 5.880 . 0 0 "[ . 1 . 2]" 1
1350 1 56 LEU MD2 1 60 GLN H 6.000 . 6.900 5.041 4.701 5.323 . 0 0 "[ . 1 . 2]" 1
1351 1 26 LEU MD2 1 27 ASP H 5.380 . 6.190 4.689 4.622 4.751 . 0 0 "[ . 1 . 2]" 1
1352 1 53 ILE H 1 56 LEU MD1 6.000 . 6.900 4.587 4.264 4.822 . 0 0 "[ . 1 . 2]" 1
1353 1 54 GLU HA 1 57 ARG HG3 4.510 . 5.190 3.270 1.980 4.814 . 0 0 "[ . 1 . 2]" 1
1354 1 54 GLU HA 1 57 ARG HG2 4.870 . 5.600 4.447 3.634 4.939 . 0 0 "[ . 1 . 2]" 1
1355 1 54 GLU HA 1 57 ARG HD2 4.740 . 5.450 3.544 2.278 4.722 . 0 0 "[ . 1 . 2]" 1
1356 1 54 GLU HA 1 57 ARG HD3 4.740 . 5.450 2.674 1.904 4.063 . 0 0 "[ . 1 . 2]" 1
1357 1 22 LEU MD1 1 57 ARG HG3 3.720 . 4.280 3.454 2.649 4.191 . 0 0 "[ . 1 . 2]" 1
1358 1 22 LEU MD1 1 57 ARG HD2 5.330 . 6.130 5.030 4.407 5.881 . 0 0 "[ . 1 . 2]" 1
1359 1 22 LEU MD1 1 57 ARG HD3 5.330 . 6.130 5.245 4.236 6.121 . 0 0 "[ . 1 . 2]" 1
1360 1 35 LYS HE2 1 45 VAL MG2 4.180 . 4.810 3.639 2.948 4.770 . 0 0 "[ . 1 . 2]" 1
1361 1 35 LYS HE2 1 52 LEU MD1 4.320 . 4.970 3.145 2.553 4.455 . 0 0 "[ . 1 . 2]" 1
1362 1 31 VAL HB 1 34 LEU MD1 5.620 . 6.460 5.098 4.748 5.476 . 0 0 "[ . 1 . 2]" 1
1363 1 41 ARG H 1 42 SER HA 4.840 . 5.570 4.528 4.292 4.889 . 0 0 "[ . 1 . 2]" 1
1364 1 32 ALA HA 1 35 LYS HG2 5.510 . 6.340 4.778 4.413 5.374 . 0 0 "[ . 1 . 2]" 1
1365 1 35 LYS HG3 1 45 VAL HB 4.550 . 5.230 3.827 3.527 4.593 . 0 0 "[ . 1 . 2]" 1
1366 1 31 VAL MG2 1 35 LYS HG3 5.340 . 6.140 5.264 5.077 5.568 . 0 0 "[ . 1 . 2]" 1
1367 1 43 LEU HB2 1 59 TYR QD 6.000 . 6.900 5.751 5.433 6.369 . 0 0 "[ . 1 . 2]" 1
1368 1 58 ALA MB 1 59 TYR QD 6.000 . 6.900 5.186 4.911 5.365 . 0 0 "[ . 1 . 2]" 1
1369 1 13 THR H 1 14 PRO QD 5.100 . 5.870 4.204 3.778 4.400 . 0 0 "[ . 1 . 2]" 1
1370 1 13 THR HA 1 14 PRO QD 2.710 . 3.120 1.918 1.778 2.283 0.022 6 0 "[ . 1 . 2]" 1
1371 1 13 THR HB 1 14 PRO QD 3.530 . 4.060 3.334 1.973 4.139 0.079 3 0 "[ . 1 . 2]" 1
1372 1 14 PRO QB 1 15 LEU H 4.020 . 4.620 3.387 2.546 3.807 . 0 0 "[ . 1 . 2]" 1
1373 1 15 LEU H 1 15 LEU QB 3.040 . 3.500 2.377 2.186 2.758 . 0 0 "[ . 1 . 2]" 1
1374 1 15 LEU H 1 15 LEU QD 4.380 . 5.040 3.537 2.047 4.045 . 0 0 "[ . 1 . 2]" 1
1375 1 15 LEU HA 1 15 LEU QD 3.400 . 3.910 2.223 1.804 3.429 . 0 0 "[ . 1 . 2]" 1
1376 1 15 LEU QB 1 15 LEU QD 2.730 . 3.140 1.971 1.891 2.071 . 0 0 "[ . 1 . 2]" 1
1377 1 15 LEU QD 1 16 THR H 4.100 . 4.720 3.046 1.899 4.317 . 0 0 "[ . 1 . 2]" 1
1378 1 17 GLY QA 1 18 LYS H 3.100 . 3.570 2.327 2.080 2.885 . 0 0 "[ . 1 . 2]" 1
1379 1 17 GLY QA 1 18 LYS QB 5.180 . 5.960 4.150 3.783 4.738 . 0 0 "[ . 1 . 2]" 1
1380 1 18 LYS H 1 18 LYS QB 3.430 . 3.940 2.801 2.304 3.383 . 0 0 "[ . 1 . 2]" 1
1381 1 18 LYS H 1 18 LYS QG 3.800 . 4.370 2.949 2.330 4.050 . 0 0 "[ . 1 . 2]" 1
1382 1 18 LYS HA 1 18 LYS QG 3.500 . 4.030 2.716 2.278 3.481 . 0 0 "[ . 1 . 2]" 1
1383 1 18 LYS HA 1 18 LYS QE 4.420 . 5.080 4.206 3.596 4.982 . 0 0 "[ . 1 . 2]" 1
1384 1 18 LYS HA 1 19 PRO QD 2.690 . 3.090 1.898 1.780 2.122 0.020 12 0 "[ . 1 . 2]" 1
1385 1 18 LYS QB 1 19 PRO QD 3.630 . 4.170 2.967 2.080 3.724 . 0 0 "[ . 1 . 2]" 1
1386 1 18 LYS QG 1 19 PRO QD 4.270 . 4.910 3.640 2.744 4.355 . 0 0 "[ . 1 . 2]" 1
1387 1 19 PRO HA 1 20 GLY QA 4.660 . 5.360 3.956 3.870 4.424 . 0 0 "[ . 1 . 2]" 1
1388 1 19 PRO QB 1 21 ALA H 4.480 . 5.150 3.650 2.248 5.212 0.062 19 0 "[ . 1 . 2]" 1
1389 1 19 PRO QG 1 20 GLY H 4.680 . 5.380 4.533 3.119 5.002 . 0 0 "[ . 1 . 2]" 1
1390 1 20 GLY QA 1 21 ALA H 3.110 . 3.580 2.695 2.292 2.898 . 0 0 "[ . 1 . 2]" 1
1391 1 20 GLY QA 1 21 ALA HA 4.950 . 5.690 4.005 3.932 4.072 . 0 0 "[ . 1 . 2]" 1
1392 1 20 GLY QA 1 21 ALA MB 4.470 . 5.140 3.945 3.591 4.192 . 0 0 "[ . 1 . 2]" 1
1393 1 21 ALA HA 1 60 GLN QG 5.070 . 5.830 2.578 1.935 3.985 . 0 0 "[ . 1 . 2]" 1
1394 1 21 ALA HA 1 60 GLN QE 3.780 . 4.350 3.015 1.858 4.371 0.021 18 0 "[ . 1 . 2]" 1
1395 1 21 ALA MB 1 60 GLN QG 5.210 . 5.990 3.645 2.776 4.816 . 0 0 "[ . 1 . 2]" 1
1396 1 21 ALA MB 1 60 GLN QE 4.290 . 4.930 3.439 2.201 4.808 . 0 0 "[ . 1 . 2]" 1
1397 1 22 LEU H 1 60 GLN QG 4.640 . 5.340 2.937 2.420 4.083 . 0 0 "[ . 1 . 2]" 1
1398 1 22 LEU HA 1 23 PRO QG 4.940 . 5.680 3.957 3.819 4.065 . 0 0 "[ . 1 . 2]" 1
1399 1 22 LEU HB2 1 60 GLN QG 4.730 . 5.440 3.457 2.707 4.109 . 0 0 "[ . 1 . 2]" 1
1400 1 22 LEU HB3 1 60 GLN QG 5.810 . 6.680 4.539 3.986 5.224 . 0 0 "[ . 1 . 2]" 1
1401 1 22 LEU HG 1 60 GLN QG 3.930 . 4.520 2.042 1.740 2.731 0.060 15 0 "[ . 1 . 2]" 1
1402 1 22 LEU MD1 1 57 ARG QD 4.560 . 5.240 4.561 3.899 5.321 0.081 11 0 "[ . 1 . 2]" 1
1403 1 22 LEU MD1 1 60 GLN QG 5.470 . 6.290 2.923 1.956 3.571 . 0 0 "[ . 1 . 2]" 1
1404 1 22 LEU MD2 1 41 ARG QG 5.810 . 6.680 4.959 4.369 5.839 . 0 0 "[ . 1 . 2]" 1
1405 1 22 LEU MD2 1 41 ARG QD 4.200 . 4.830 3.442 2.828 4.411 . 0 0 "[ . 1 . 2]" 1
1406 1 22 LEU MD2 1 59 TYR QB 5.590 . 6.430 4.528 3.733 5.526 . 0 0 "[ . 1 . 2]" 1
1407 1 22 LEU MD2 1 60 GLN QG 3.760 . 4.320 3.389 2.434 4.212 . 0 0 "[ . 1 . 2]" 1
1408 1 23 PRO QB 1 24 ALA MB 5.260 . 6.050 4.301 3.763 4.559 . 0 0 "[ . 1 . 2]" 1
1409 1 23 PRO QB 1 25 ASN H 3.620 . 4.160 2.460 2.074 3.291 . 0 0 "[ . 1 . 2]" 1
1410 1 23 PRO QB 1 25 ASN HB2 5.660 . 6.510 3.332 2.730 4.615 . 0 0 "[ . 1 . 2]" 1
1411 1 23 PRO QB 1 26 LEU MD2 4.040 . 4.650 3.685 3.212 4.134 . 0 0 "[ . 1 . 2]" 1
1412 1 23 PRO QG 1 24 ALA H 4.800 . 5.520 4.437 3.794 4.746 . 0 0 "[ . 1 . 2]" 1
1413 1 23 PRO QG 1 25 ASN H 5.050 . 5.810 3.732 3.122 4.919 . 0 0 "[ . 1 . 2]" 1
1414 1 23 PRO QG 1 26 LEU HA 4.200 . 4.830 3.605 3.385 3.901 . 0 0 "[ . 1 . 2]" 1
1415 1 23 PRO QG 1 26 LEU HG 4.040 . 4.650 3.362 2.804 3.784 . 0 0 "[ . 1 . 2]" 1
1416 1 23 PRO QG 1 26 LEU MD1 4.530 . 5.210 4.194 3.769 4.606 . 0 0 "[ . 1 . 2]" 1
1417 1 23 PRO QG 1 26 LEU MD2 3.120 . 3.590 2.145 1.780 2.515 0.020 16 0 "[ . 1 . 2]" 1
1418 1 25 ASN HA 1 25 ASN QD 3.930 . 4.520 2.842 1.777 3.838 0.023 1 0 "[ . 1 . 2]" 1
1419 1 25 ASN QD 1 28 ASP HB2 4.390 . 5.050 3.286 2.497 4.055 . 0 0 "[ . 1 . 2]" 1
1420 1 25 ASN QD 1 28 ASP HB3 5.810 . 6.680 3.650 2.187 5.015 . 0 0 "[ . 1 . 2]" 1
1421 1 26 LEU H 1 27 ASP QB 5.810 . 6.680 4.507 4.115 4.956 . 0 0 "[ . 1 . 2]" 1
1422 1 26 LEU HA 1 29 MET QB 4.100 . 4.720 3.008 2.522 3.691 . 0 0 "[ . 1 . 2]" 1
1423 1 26 LEU HA 1 29 MET QG 3.730 . 4.290 2.960 2.127 4.091 . 0 0 "[ . 1 . 2]" 1
1424 1 26 LEU MD2 1 29 MET QB 4.620 . 5.310 3.795 3.328 4.371 . 0 0 "[ . 1 . 2]" 1
1425 1 27 ASP H 1 27 ASP QB 2.860 . 3.290 2.362 2.232 2.629 . 0 0 "[ . 1 . 2]" 1
1426 1 27 ASP HA 1 49 LYS QD 5.810 . 6.680 4.609 4.136 5.360 . 0 0 "[ . 1 . 2]" 1
1427 1 27 ASP HA 1 49 LYS QE 4.160 . 4.780 2.698 2.026 4.358 . 0 0 "[ . 1 . 2]" 1
1428 1 27 ASP QB 1 28 ASP H 3.300 . 3.800 3.028 2.740 3.704 . 0 0 "[ . 1 . 2]" 1
1429 1 27 ASP QB 1 53 ILE MG 4.600 . 5.290 3.884 2.810 4.875 . 0 0 "[ . 1 . 2]" 1
1430 1 27 ASP QB 1 53 ILE MD 4.720 . 5.430 2.850 2.109 3.799 . 0 0 "[ . 1 . 2]" 1
1431 1 28 ASP H 1 29 MET QB 4.860 . 5.590 4.414 4.282 4.619 . 0 0 "[ . 1 . 2]" 1
1432 1 28 ASP H 1 29 MET QG 5.480 . 6.300 3.882 3.592 4.236 . 0 0 "[ . 1 . 2]" 1
1433 1 28 ASP HB3 1 29 MET QB 5.810 . 6.680 5.178 4.732 5.701 . 0 0 "[ . 1 . 2]" 1
1434 1 29 MET H 1 29 MET QB 2.960 . 3.400 2.408 2.333 2.477 . 0 0 "[ . 1 . 2]" 1
1435 1 29 MET H 1 29 MET QG 3.190 . 3.670 2.366 2.151 2.645 . 0 0 "[ . 1 . 2]" 1
1436 1 29 MET QB 1 30 LYS H 3.270 . 3.760 2.578 2.167 2.868 . 0 0 "[ . 1 . 2]" 1
1437 1 29 MET QB 1 34 LEU HG 4.130 . 4.750 2.969 2.634 3.289 . 0 0 "[ . 1 . 2]" 1
1438 1 29 MET QB 1 34 LEU MD1 5.440 . 6.260 3.621 3.250 4.028 . 0 0 "[ . 1 . 2]" 1
1439 1 29 MET ME 1 29 MET QG 3.070 . 3.530 2.443 2.324 2.513 . 0 0 "[ . 1 . 2]" 1
1440 1 29 MET QG 1 30 LYS H 3.850 . 4.430 3.970 3.673 4.446 0.016 11 0 "[ . 1 . 2]" 1
1441 1 29 MET QG 1 34 LEU HG 5.650 . 6.500 4.998 4.455 5.385 . 0 0 "[ . 1 . 2]" 1
1442 1 29 MET QG 1 34 LEU MD2 5.610 . 6.450 3.707 2.903 4.234 . 0 0 "[ . 1 . 2]" 1
1443 1 30 LYS H 1 30 LYS QD 4.680 . 5.380 3.442 1.760 3.952 0.040 5 0 "[ . 1 . 2]" 1
1444 1 30 LYS H 1 30 LYS QE 5.810 . 6.680 4.322 1.801 5.222 . 0 0 "[ . 1 . 2]" 1
1445 1 30 LYS H 1 33 GLU QG 3.780 . 4.350 2.134 1.791 3.085 0.009 15 0 "[ . 1 . 2]" 1
1446 1 30 LYS HA 1 30 LYS QD 4.840 . 5.570 3.937 2.924 4.195 . 0 0 "[ . 1 . 2]" 1
1447 1 30 LYS HB2 1 30 LYS QD 2.400 . 2.760 2.269 1.962 2.407 . 0 0 "[ . 1 . 2]" 1
1448 1 30 LYS HB2 1 30 LYS QE 3.830 . 4.400 3.847 2.512 4.194 . 0 0 "[ . 1 . 2]" 1
1449 1 30 LYS HB2 1 33 GLU QG 3.870 . 4.450 1.951 1.771 3.149 0.029 11 0 "[ . 1 . 2]" 1
1450 1 30 LYS HB3 1 30 LYS QD 3.710 . 4.270 2.638 2.344 3.313 . 0 0 "[ . 1 . 2]" 1
1451 1 30 LYS HB3 1 30 LYS QE 4.560 . 5.240 3.871 2.303 4.245 . 0 0 "[ . 1 . 2]" 1
1452 1 30 LYS HB3 1 33 GLU QG 4.050 . 4.660 3.509 3.090 4.478 . 0 0 "[ . 1 . 2]" 1
1453 1 30 LYS HG2 1 33 GLU QG 4.950 . 5.690 4.088 3.537 4.845 . 0 0 "[ . 1 . 2]" 1
1454 1 30 LYS QD 1 30 LYS HG3 2.630 . 3.020 2.356 2.143 2.498 . 0 0 "[ . 1 . 2]" 1
1455 1 30 LYS QE 1 30 LYS HG3 3.640 . 4.190 2.728 2.197 3.511 . 0 0 "[ . 1 . 2]" 1
1456 1 31 VAL H 1 49 LYS QD 4.490 . 5.160 4.071 3.272 5.020 . 0 0 "[ . 1 . 2]" 1
1457 1 31 VAL H 1 49 LYS QE 5.210 . 5.990 4.396 3.395 5.234 . 0 0 "[ . 1 . 2]" 1
1458 1 31 VAL HA 1 34 LEU QB 3.680 . 4.230 2.921 2.572 3.264 . 0 0 "[ . 1 . 2]" 1
1459 1 31 VAL MG2 1 49 LYS QG 3.620 . 4.160 3.170 2.419 4.174 0.014 4 0 "[ . 1 . 2]" 1
1460 1 31 VAL MG2 1 49 LYS QD 3.550 . 4.080 2.509 1.789 3.374 0.011 5 0 "[ . 1 . 2]" 1
1461 1 31 VAL MG2 1 49 LYS QE 4.120 . 4.740 3.723 2.730 4.436 . 0 0 "[ . 1 . 2]" 1
1462 1 32 ALA MB 1 33 GLU QG 4.320 . 4.970 3.383 3.183 3.838 . 0 0 "[ . 1 . 2]" 1
1463 1 33 GLU H 1 33 GLU QG 3.070 . 3.530 2.097 1.787 2.402 0.013 15 0 "[ . 1 . 2]" 1
1464 1 33 GLU HA 1 33 GLU QG 3.470 . 3.990 3.057 2.799 3.432 . 0 0 "[ . 1 . 2]" 1
1465 1 33 GLU QG 1 34 LEU H 4.140 . 4.760 3.732 2.339 4.158 . 0 0 "[ . 1 . 2]" 1
1466 1 33 GLU QG 1 34 LEU HG 5.810 . 6.680 4.697 3.176 5.369 . 0 0 "[ . 1 . 2]" 1
1467 1 34 LEU H 1 34 LEU QB 3.370 . 3.880 2.449 2.384 2.497 . 0 0 "[ . 1 . 2]" 1
1468 1 34 LEU HA 1 37 GLU QB 4.520 . 5.200 3.068 2.500 3.763 . 0 0 "[ . 1 . 2]" 1
1469 1 34 LEU HA 1 37 GLU QG 4.500 . 5.180 3.433 2.823 4.261 . 0 0 "[ . 1 . 2]" 1
1470 1 34 LEU QB 1 34 LEU MD1 2.810 . 3.230 2.092 2.085 2.099 . 0 0 "[ . 1 . 2]" 1
1471 1 34 LEU QB 1 35 LYS H 3.320 . 3.820 2.544 2.447 2.807 . 0 0 "[ . 1 . 2]" 1
1472 1 34 LEU QB 1 35 LYS HG3 4.620 . 5.310 3.431 3.235 3.904 . 0 0 "[ . 1 . 2]" 1
1473 1 34 LEU QB 1 52 LEU HB3 3.910 . 4.500 2.432 2.102 2.918 . 0 0 "[ . 1 . 2]" 1
1474 1 34 LEU QB 1 52 LEU MD1 3.340 . 3.840 2.369 2.029 2.875 . 0 0 "[ . 1 . 2]" 1
1475 1 34 LEU QB 1 52 LEU MD2 4.230 . 4.860 3.871 3.497 4.226 . 0 0 "[ . 1 . 2]" 1
1476 1 34 LEU QB 1 53 ILE HG13 5.810 . 6.680 4.524 4.144 5.069 . 0 0 "[ . 1 . 2]" 1
1477 1 34 LEU MD1 1 49 LYS QG 3.250 . 3.740 2.654 1.913 3.762 0.022 8 0 "[ . 1 . 2]" 1
1478 1 34 LEU MD1 1 49 LYS QD 3.670 . 4.220 3.037 1.948 4.069 . 0 0 "[ . 1 . 2]" 1
1479 1 34 LEU MD1 1 49 LYS QE 3.150 . 3.620 2.541 2.068 3.020 . 0 0 "[ . 1 . 2]" 1
1480 1 36 GLN HA 1 36 GLN QE 4.450 . 5.120 2.795 2.449 3.686 . 0 0 "[ . 1 . 2]" 1
1481 1 36 GLN HA 1 39 LYS QD 4.170 . 4.800 2.528 2.120 2.993 . 0 0 "[ . 1 . 2]" 1
1482 1 36 GLN HA 1 39 LYS QE 4.870 . 5.600 3.573 2.235 4.822 . 0 0 "[ . 1 . 2]" 1
1483 1 36 GLN HB2 1 37 GLU QG 4.580 . 5.270 3.502 3.273 3.947 . 0 0 "[ . 1 . 2]" 1
1484 1 36 GLN HB3 1 37 GLU QG 5.590 . 6.430 4.251 3.615 4.631 . 0 0 "[ . 1 . 2]" 1
1485 1 36 GLN HG2 1 39 LYS QD 4.930 . 5.670 4.333 3.691 4.973 . 0 0 "[ . 1 . 2]" 1
1486 1 36 GLN QE 1 37 GLU HA 5.810 . 6.680 5.481 4.801 6.603 . 0 0 "[ . 1 . 2]" 1
1487 1 36 GLN QE 1 39 LYS QD 5.170 . 5.950 2.757 2.055 3.419 . 0 0 "[ . 1 . 2]" 1
1488 1 36 GLN QE 1 40 LEU H 5.810 . 6.680 5.420 4.262 6.619 . 0 0 "[ . 1 . 2]" 1
1489 1 36 GLN QE 1 40 LEU MD1 3.430 . 3.940 3.181 2.348 3.959 0.019 15 0 "[ . 1 . 2]" 1
1490 1 36 GLN QE 1 40 LEU MD2 4.380 . 5.040 3.787 2.536 4.495 . 0 0 "[ . 1 . 2]" 1
1491 1 37 GLU H 1 37 GLU QB 3.270 . 3.760 2.369 2.269 2.466 . 0 0 "[ . 1 . 2]" 1
1492 1 37 GLU QB 1 38 LEU H 3.280 . 3.770 2.678 2.463 2.944 . 0 0 "[ . 1 . 2]" 1
1493 1 37 GLU QB 1 56 LEU MD1 3.930 . 4.520 2.575 2.071 3.026 . 0 0 "[ . 1 . 2]" 1
1494 1 37 GLU QB 1 56 LEU MD2 3.310 . 3.810 2.380 2.026 2.830 . 0 0 "[ . 1 . 2]" 1
1495 1 37 GLU QG 1 38 LEU H 4.850 . 5.580 4.166 3.995 4.318 . 0 0 "[ . 1 . 2]" 1
1496 1 37 GLU QG 1 40 LEU HB2 5.240 . 6.030 5.294 4.207 5.766 . 0 0 "[ . 1 . 2]" 1
1497 1 37 GLU QG 1 40 LEU MD1 4.670 . 5.370 4.379 3.339 4.948 . 0 0 "[ . 1 . 2]" 1
1498 1 37 GLU QG 1 56 LEU MD1 4.770 . 5.490 3.377 2.643 4.348 . 0 0 "[ . 1 . 2]" 1
1499 1 37 GLU QG 1 56 LEU MD2 4.950 . 5.690 3.848 3.340 4.581 . 0 0 "[ . 1 . 2]" 1
1500 1 38 LEU HA 1 41 ARG QD 5.240 . 6.030 4.039 3.646 4.527 . 0 0 "[ . 1 . 2]" 1
1501 1 38 LEU MD1 1 55 ARG QD 4.080 . 4.690 3.464 2.710 4.457 . 0 0 "[ . 1 . 2]" 1
1502 1 38 LEU MD2 1 41 ARG QD 5.510 . 6.340 4.459 3.707 4.933 . 0 0 "[ . 1 . 2]" 1
1503 1 38 LEU MD2 1 44 PRO QB 5.180 . 5.960 4.828 4.408 5.373 . 0 0 "[ . 1 . 2]" 1
1504 1 38 LEU MD2 1 44 PRO QG 4.740 . 5.450 4.692 3.945 5.306 . 0 0 "[ . 1 . 2]" 1
1505 1 38 LEU MD2 1 59 TYR QB 5.810 . 6.680 4.393 4.025 4.672 . 0 0 "[ . 1 . 2]" 1
1506 1 39 LYS HB2 1 39 LYS QD 3.570 . 4.110 2.769 2.427 3.092 . 0 0 "[ . 1 . 2]" 1
1507 1 39 LYS HB3 1 39 LYS QE 4.420 . 5.080 2.356 1.865 2.806 . 0 0 "[ . 1 . 2]" 1
1508 1 39 LYS QE 1 39 LYS HG2 3.650 . 4.200 2.902 2.350 3.466 . 0 0 "[ . 1 . 2]" 1
1509 1 39 LYS QD 1 40 LEU H 4.970 . 5.720 4.369 3.950 4.533 . 0 0 "[ . 1 . 2]" 1
1510 1 39 LYS QE 1 45 VAL MG1 5.100 . 5.870 3.350 1.823 4.287 . 0 0 "[ . 1 . 2]" 1
1511 1 39 LYS QE 1 45 VAL MG2 4.320 . 4.970 4.393 2.946 5.018 0.048 17 0 "[ . 1 . 2]" 1
1512 1 40 LEU MD1 1 41 ARG QG 5.120 . 5.890 4.385 3.959 4.804 . 0 0 "[ . 1 . 2]" 1
1513 1 41 ARG H 1 41 ARG QG 3.510 . 4.040 2.747 2.329 3.208 . 0 0 "[ . 1 . 2]" 1
1514 1 41 ARG H 1 41 ARG QD 4.540 . 5.220 4.086 3.760 4.301 . 0 0 "[ . 1 . 2]" 1
1515 1 41 ARG HA 1 41 ARG QG 3.280 . 3.770 2.434 2.325 2.521 . 0 0 "[ . 1 . 2]" 1
1516 1 41 ARG HA 1 41 ARG QD 4.750 . 5.460 4.064 3.957 4.257 . 0 0 "[ . 1 . 2]" 1
1517 1 41 ARG QG 1 42 SER H 4.790 . 5.510 4.429 4.267 4.532 . 0 0 "[ . 1 . 2]" 1
1518 1 41 ARG QG 1 59 TYR QE 5.150 . 5.920 3.547 2.840 4.659 . 0 0 "[ . 1 . 2]" 1
1519 1 41 ARG QD 1 56 LEU MD2 3.490 . 4.010 2.908 2.277 3.501 . 0 0 "[ . 1 . 2]" 1
1520 1 41 ARG QD 1 59 TYR QD 4.570 . 5.260 3.085 2.255 4.669 . 0 0 "[ . 1 . 2]" 1
1521 1 41 ARG QD 1 59 TYR QE 4.530 . 5.210 2.785 1.797 4.652 0.003 13 0 "[ . 1 . 2]" 1
1522 1 43 LEU HB2 1 55 ARG QD 5.810 . 6.680 4.653 3.823 5.877 . 0 0 "[ . 1 . 2]" 1
1523 1 43 LEU HB3 1 55 ARG QD 4.500 . 5.180 3.175 2.455 4.331 . 0 0 "[ . 1 . 2]" 1
1524 1 43 LEU MD1 1 55 ARG QD 5.050 . 5.810 4.030 3.250 4.943 . 0 0 "[ . 1 . 2]" 1
1525 1 43 LEU MD1 1 59 TYR QB 3.620 . 4.160 2.442 1.962 3.371 . 0 0 "[ . 1 . 2]" 1
1526 1 43 LEU MD2 1 44 PRO QG 4.190 . 4.820 3.895 3.565 4.224 . 0 0 "[ . 1 . 2]" 1
1527 1 43 LEU MD2 1 55 ARG QD 4.390 . 5.050 2.889 2.212 3.569 . 0 0 "[ . 1 . 2]" 1
1528 1 43 LEU MD2 1 59 TYR QB 4.170 . 4.800 2.359 1.769 2.960 0.031 17 0 "[ . 1 . 2]" 1
1529 1 44 PRO QB 1 45 VAL H 3.620 . 4.160 3.241 2.894 3.574 . 0 0 "[ . 1 . 2]" 1
1530 1 44 PRO QB 1 45 VAL MG1 5.680 . 6.530 4.735 4.521 4.888 . 0 0 "[ . 1 . 2]" 1
1531 1 44 PRO QB 1 45 VAL MG2 4.880 . 5.610 4.472 4.220 4.701 . 0 0 "[ . 1 . 2]" 1
1532 1 44 PRO QB 1 46 SER H 3.590 . 4.130 2.872 2.534 3.312 . 0 0 "[ . 1 . 2]" 1
1533 1 44 PRO QB 1 46 SER QB 5.180 . 5.960 3.669 3.110 4.404 . 0 0 "[ . 1 . 2]" 1
1534 1 44 PRO QG 1 45 VAL H 4.790 . 5.510 4.705 4.523 4.902 . 0 0 "[ . 1 . 2]" 1
1535 1 44 PRO QG 1 46 SER H 4.930 . 5.670 4.671 4.073 5.266 . 0 0 "[ . 1 . 2]" 1
1536 1 44 PRO HD2 1 55 ARG QD 3.820 . 4.390 2.326 1.780 3.301 0.020 18 0 "[ . 1 . 2]" 1
1537 1 44 PRO HD3 1 55 ARG QD 5.100 . 5.870 3.794 3.253 4.488 . 0 0 "[ . 1 . 2]" 1
1538 1 45 VAL H 1 46 SER QB 5.440 . 6.260 4.311 3.814 4.781 . 0 0 "[ . 1 . 2]" 1
1539 1 45 VAL MG2 1 46 SER QB 4.490 . 5.160 3.874 3.245 4.520 . 0 0 "[ . 1 . 2]" 1
1540 1 46 SER H 1 46 SER QB 3.110 . 3.580 2.520 2.277 2.887 . 0 0 "[ . 1 . 2]" 1
1541 1 46 SER HA 1 47 GLY QA 4.830 . 5.550 3.937 3.900 4.045 . 0 0 "[ . 1 . 2]" 1
1542 1 46 SER QB 1 47 GLY H 3.170 . 3.650 3.334 2.559 3.736 0.086 13 0 "[ . 1 . 2]" 1
1543 1 46 SER QB 1 52 LEU MD2 5.350 . 6.150 4.799 4.482 5.293 . 0 0 "[ . 1 . 2]" 1
1544 1 47 GLY QA 1 51 GLU HB3 4.490 . 5.160 3.243 2.710 4.158 . 0 0 "[ . 1 . 2]" 1
1545 1 47 GLY QA 1 51 GLU QG 5.610 . 6.450 3.465 2.549 4.281 . 0 0 "[ . 1 . 2]" 1
1546 1 47 GLY QA 1 52 LEU H 5.400 . 6.210 4.429 3.991 4.977 . 0 0 "[ . 1 . 2]" 1
1547 1 48 THR H 1 51 GLU QG 3.830 . 4.400 2.742 1.962 3.306 . 0 0 "[ . 1 . 2]" 1
1548 1 48 THR HB 1 51 GLU QG 5.810 . 6.680 4.356 3.967 5.265 . 0 0 "[ . 1 . 2]" 1
1549 1 48 THR MG 1 51 GLU QG 4.610 . 5.300 3.765 3.163 4.238 . 0 0 "[ . 1 . 2]" 1
1550 1 49 LYS H 1 49 LYS QG 4.550 . 5.230 3.994 3.963 4.043 . 0 0 "[ . 1 . 2]" 1
1551 1 49 LYS H 1 49 LYS QD 4.990 . 5.740 4.303 4.123 4.432 . 0 0 "[ . 1 . 2]" 1
1552 1 49 LYS HA 1 49 LYS QG 3.380 . 3.890 2.670 2.414 3.011 . 0 0 "[ . 1 . 2]" 1
1553 1 49 LYS HA 1 49 LYS QD 4.380 . 5.040 3.279 2.060 4.084 . 0 0 "[ . 1 . 2]" 1
1554 1 49 LYS HB2 1 49 LYS QD 2.390 . 2.750 2.391 2.301 2.532 . 0 0 "[ . 1 . 2]" 1
1555 1 49 LYS HB2 1 49 LYS QE 4.570 . 5.260 4.036 3.885 4.190 . 0 0 "[ . 1 . 2]" 1
1556 1 49 LYS HB3 1 49 LYS QD 3.690 . 4.240 2.749 2.301 3.311 . 0 0 "[ . 1 . 2]" 1
1557 1 49 LYS QE 1 49 LYS QG 3.200 . 3.680 2.226 2.113 2.395 . 0 0 "[ . 1 . 2]" 1
1558 1 49 LYS QG 1 52 LEU MD1 5.230 . 6.010 4.165 3.097 5.307 . 0 0 "[ . 1 . 2]" 1
1559 1 49 LYS QG 1 53 ILE HG13 5.260 . 6.050 3.038 2.461 3.848 . 0 0 "[ . 1 . 2]" 1
1560 1 49 LYS QD 1 52 LEU MD1 5.760 . 6.620 4.472 2.856 5.623 . 0 0 "[ . 1 . 2]" 1
1561 1 49 LYS QD 1 53 ILE MD 5.690 . 6.540 3.419 3.134 3.844 . 0 0 "[ . 1 . 2]" 1
1562 1 49 LYS QE 1 53 ILE HG12 4.400 . 5.060 3.919 3.108 5.099 0.039 11 0 "[ . 1 . 2]" 1
1563 1 49 LYS QE 1 53 ILE MD 3.680 . 4.230 2.201 1.776 3.717 0.024 13 0 "[ . 1 . 2]" 1
1564 1 50 THR HB 1 51 GLU QG 4.800 . 5.520 3.522 3.049 4.565 . 0 0 "[ . 1 . 2]" 1
1565 1 50 THR MG 1 51 GLU QG 4.740 . 5.450 4.267 3.730 5.331 . 0 0 "[ . 1 . 2]" 1
1566 1 50 THR MG 1 54 GLU QG 3.810 . 4.380 2.930 2.417 4.105 . 0 0 "[ . 1 . 2]" 1
1567 1 51 GLU H 1 51 GLU QG 3.080 . 3.540 2.448 2.134 3.386 . 0 0 "[ . 1 . 2]" 1
1568 1 51 GLU QG 1 52 LEU H 4.730 . 5.440 4.157 3.953 4.458 . 0 0 "[ . 1 . 2]" 1
1569 1 52 LEU HA 1 55 ARG QD 4.560 . 5.240 3.770 3.077 4.707 . 0 0 "[ . 1 . 2]" 1
1570 1 52 LEU MD2 1 55 ARG QD 4.950 . 5.690 3.695 2.895 4.586 . 0 0 "[ . 1 . 2]" 1
1571 1 53 ILE HB 1 54 GLU QG 4.720 . 5.430 3.502 2.812 5.538 0.108 4 0 "[ . 1 . 2]" 1
1572 1 53 ILE MG 1 54 GLU QG 4.680 . 5.380 3.716 2.863 5.230 . 0 0 "[ . 1 . 2]" 1
1573 1 53 ILE MG 1 57 ARG QD 3.670 . 4.220 2.262 1.799 2.842 0.001 6 0 "[ . 1 . 2]" 1
1574 1 53 ILE MD 1 54 GLU QG 5.810 . 6.680 4.828 4.119 6.617 . 0 0 "[ . 1 . 2]" 1
1575 1 54 GLU H 1 54 GLU QG 3.330 . 3.830 2.524 2.100 3.990 0.160 4 0 "[ . 1 . 2]" 1
1576 1 54 GLU HA 1 54 GLU QG 3.500 . 4.030 2.681 2.284 3.038 . 0 0 "[ . 1 . 2]" 1
1577 1 54 GLU HA 1 57 ARG QD 4.140 . 4.760 2.421 1.896 3.794 . 0 0 "[ . 1 . 2]" 1
1578 1 55 ARG H 1 57 ARG QD 5.810 . 6.680 5.388 4.870 6.508 . 0 0 "[ . 1 . 2]" 1
1579 1 55 ARG HA 1 55 ARG QD 4.750 . 5.460 4.052 3.295 4.218 . 0 0 "[ . 1 . 2]" 1
1580 1 55 ARG HB3 1 55 ARG QD 3.620 . 4.160 2.673 2.405 3.448 . 0 0 "[ . 1 . 2]" 1
1581 1 55 ARG HG2 1 59 TYR QB 4.980 . 5.730 4.048 3.283 5.255 . 0 0 "[ . 1 . 2]" 1
1582 1 55 ARG QD 1 56 LEU MD2 5.810 . 6.680 5.079 4.256 6.234 . 0 0 "[ . 1 . 2]" 1
1583 1 56 LEU HA 1 59 TYR QB 3.680 . 4.230 2.676 2.356 2.860 . 0 0 "[ . 1 . 2]" 1
1584 1 56 LEU MD2 1 59 TYR QB 5.810 . 6.680 3.525 3.230 3.761 . 0 0 "[ . 1 . 2]" 1
1585 1 57 ARG H 1 57 ARG QD 4.750 . 5.460 3.626 2.749 4.218 . 0 0 "[ . 1 . 2]" 1
1586 1 57 ARG HA 1 57 ARG QD 4.610 . 5.300 4.118 3.714 4.254 . 0 0 "[ . 1 . 2]" 1
1587 1 57 ARG HA 1 60 GLN QG 5.300 . 6.100 4.655 3.723 5.424 . 0 0 "[ . 1 . 2]" 1
1588 1 57 ARG HB2 1 57 ARG QD 3.610 . 4.150 2.433 2.323 3.113 . 0 0 "[ . 1 . 2]" 1
1589 1 57 ARG HB3 1 57 ARG QD 3.680 . 4.230 2.860 2.360 3.376 . 0 0 "[ . 1 . 2]" 1
1590 1 58 ALA H 1 59 TYR QB 5.170 . 5.950 4.393 4.206 4.485 . 0 0 "[ . 1 . 2]" 1
1591 1 58 ALA MB 1 59 TYR QB 4.850 . 5.580 3.847 3.711 3.952 . 0 0 "[ . 1 . 2]" 1
1592 1 58 ALA MB 1 62 GLN QE 4.860 . 5.590 3.502 2.830 5.133 . 0 0 "[ . 1 . 2]" 1
1593 1 59 TYR HA 1 62 GLN QB 4.210 . 4.840 4.257 3.876 4.554 . 0 0 "[ . 1 . 2]" 1
1594 1 59 TYR HA 1 62 GLN QE 4.620 . 5.310 2.558 2.059 4.031 . 0 0 "[ . 1 . 2]" 1
1595 1 59 TYR QB 1 60 GLN H 3.570 . 4.110 2.521 2.323 2.918 . 0 0 "[ . 1 . 2]" 1
1596 1 59 TYR QD 1 60 GLN QG 4.750 . 5.460 4.591 2.829 5.469 0.009 7 0 "[ . 1 . 2]" 1
1597 1 59 TYR QE 1 63 ILE QG 5.190 . 5.970 3.955 3.336 5.179 . 0 0 "[ . 1 . 2]" 1
1598 1 60 GLN H 1 60 GLN QG 4.240 . 4.880 3.831 2.469 4.058 . 0 0 "[ . 1 . 2]" 1
1599 1 60 GLN H 1 60 GLN QE 5.810 . 6.680 5.330 3.988 5.819 . 0 0 "[ . 1 . 2]" 1
1600 1 60 GLN HA 1 60 GLN QG 3.420 . 3.930 2.463 2.261 3.076 . 0 0 "[ . 1 . 2]" 1
1601 1 60 GLN HA 1 63 ILE QG 3.700 . 4.260 2.591 1.808 3.406 . 0 0 "[ . 1 . 2]" 1
1602 1 60 GLN HB3 1 60 GLN QE 4.320 . 4.970 3.350 1.711 4.300 0.089 18 0 "[ . 1 . 2]" 1
1603 1 60 GLN QG 1 61 ASP H 5.370 . 6.180 4.329 3.727 4.670 . 0 0 "[ . 1 . 2]" 1
1604 1 60 GLN QG 1 63 ILE H 5.630 . 6.470 4.937 4.016 5.901 . 0 0 "[ . 1 . 2]" 1
1605 1 60 GLN QG 1 63 ILE HB 5.810 . 6.680 3.766 2.719 5.644 . 0 0 "[ . 1 . 2]" 1
1606 1 60 GLN QG 1 63 ILE QG 5.610 . 6.450 4.180 2.898 5.064 . 0 0 "[ . 1 . 2]" 1
1607 1 60 GLN QG 1 63 ILE MD 4.960 . 5.700 3.669 2.300 5.714 0.014 13 0 "[ . 1 . 2]" 1
1608 1 60 GLN QE 1 63 ILE HB 5.300 . 6.100 3.947 3.109 5.190 . 0 0 "[ . 1 . 2]" 1
1609 1 60 GLN QE 1 63 ILE MG 5.080 . 5.840 4.226 2.988 5.854 0.014 18 0 "[ . 1 . 2]" 1
1610 1 60 GLN QE 1 63 ILE MD 4.970 . 5.720 4.624 2.455 5.794 0.074 16 0 "[ . 1 . 2]" 1
1611 1 61 ASP H 1 63 ILE QG 5.810 . 6.680 4.688 4.233 5.160 . 0 0 "[ . 1 . 2]" 1
1612 1 61 ASP HB3 1 62 GLN QB 5.300 . 6.100 4.065 3.888 4.756 . 0 0 "[ . 1 . 2]" 1
1613 1 62 GLN H 1 62 GLN QB 2.970 . 3.420 2.637 2.504 2.809 . 0 0 "[ . 1 . 2]" 1
1614 1 62 GLN H 1 63 ILE QG 5.320 . 6.120 3.858 3.596 4.105 . 0 0 "[ . 1 . 2]" 1
1615 1 62 GLN QB 1 63 ILE H 3.790 . 4.360 3.746 2.832 3.944 . 0 0 "[ . 1 . 2]" 1
1616 1 62 GLN QB 1 63 ILE HA 5.290 . 6.080 4.555 3.973 4.695 . 0 0 "[ . 1 . 2]" 1
1617 1 62 GLN HG3 1 63 ILE QG 5.150 . 5.920 3.255 2.225 4.697 . 0 0 "[ . 1 . 2]" 1
1618 1 63 ILE H 1 63 ILE QG 3.170 . 3.650 2.336 2.160 2.690 . 0 0 "[ . 1 . 2]" 1
1619 1 63 ILE HA 1 63 ILE QG 3.680 . 4.230 2.550 2.346 2.948 . 0 0 "[ . 1 . 2]" 1
1620 1 63 ILE MG 1 64 SER QB 4.510 . 5.190 4.104 3.016 4.989 . 0 0 "[ . 1 . 2]" 1
1621 1 63 ILE QG 1 64 SER H 5.210 . 5.990 4.019 3.763 4.230 . 0 0 "[ . 1 . 2]" 1
1622 1 63 ILE MD 1 64 SER QB 5.810 . 6.680 5.775 5.004 6.332 . 0 0 "[ . 1 . 2]" 1
1623 1 64 SER H 1 64 SER QB 3.350 . 3.850 2.711 2.270 3.443 . 0 0 "[ . 1 . 2]" 1
1624 1 64 SER H 1 65 PRO QD 5.150 . 5.920 3.920 2.095 4.400 . 0 0 "[ . 1 . 2]" 1
1625 1 64 SER HA 1 65 PRO QD 3.040 . 3.500 1.945 1.752 2.385 0.048 1 0 "[ . 1 . 2]" 1
1626 1 64 SER QB 1 65 PRO QG 5.180 . 5.960 4.618 3.515 5.328 . 0 0 "[ . 1 . 2]" 1
1627 1 65 PRO QB 1 66 VAL H 3.920 . 4.510 3.316 1.766 3.844 0.034 12 0 "[ . 1 . 2]" 1
1628 1 65 PRO QG 1 66 VAL H 4.720 . 5.430 4.606 3.324 4.898 . 0 0 "[ . 1 . 2]" 1
1629 1 66 VAL H 1 66 VAL QG 3.360 . 3.860 1.900 1.789 2.165 0.011 5 0 "[ . 1 . 2]" 1
1630 1 66 VAL H 1 67 PRO QD 4.950 . 5.690 4.236 3.729 4.388 . 0 0 "[ . 1 . 2]" 1
1631 1 66 VAL HB 1 67 PRO QD 2.990 . 3.440 2.730 1.798 3.516 0.076 12 0 "[ . 1 . 2]" 1
1632 1 66 VAL QG 1 67 PRO QD 3.800 . 4.370 2.996 2.740 3.235 . 0 0 "[ . 1 . 2]" 1
1633 1 66 VAL QG 1 69 ALA H 4.090 . 4.700 2.902 2.247 4.220 . 0 0 "[ . 1 . 2]" 1
1634 1 66 VAL QG 1 69 ALA MB 3.980 . 4.580 2.500 1.801 3.842 . 0 0 "[ . 1 . 2]" 1
1635 1 67 PRO HB2 1 68 GLY QA 4.850 . 5.580 3.882 3.392 4.492 . 0 0 "[ . 1 . 2]" 1
1636 1 67 PRO QD 1 69 ALA H 5.810 . 6.680 4.424 3.257 5.422 . 0 0 "[ . 1 . 2]" 1
1637 1 69 ALA HA 1 70 PRO QD 2.660 . 3.060 1.943 1.780 2.292 0.020 11 0 "[ . 1 . 2]" 1
1638 1 71 LYS H 1 71 LYS QB 3.570 . 4.110 2.470 2.198 3.261 . 0 0 "[ . 1 . 2]" 1
1639 1 71 LYS H 1 71 LYS QG 4.660 . 5.360 3.546 2.067 4.151 . 0 0 "[ . 1 . 2]" 1
1640 1 71 LYS QB 1 71 LYS QD 2.360 . 2.710 2.312 2.111 2.632 . 0 0 "[ . 1 . 2]" 1
1641 1 72 ALA HA 1 73 PRO QD 3.260 . 3.750 1.988 1.769 2.471 0.031 3 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 14
_Distance_constraint_stats_list.Viol_count 14
_Distance_constraint_stats_list.Viol_total 3.416
_Distance_constraint_stats_list.Viol_max 0.035
_Distance_constraint_stats_list.Viol_rms 0.0035
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0006
_Distance_constraint_stats_list.Viol_average_violations_only 0.0122
_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 31 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 LYS 0.039 0.019 18 0 "[ . 1 . 2]"
1 39 LYS 0.039 0.019 18 0 "[ . 1 . 2]"
1 51 GLU 0.028 0.019 1 0 "[ . 1 . 2]"
1 53 ILE 0.035 0.035 18 0 "[ . 1 . 2]"
1 54 GLU 0.066 0.022 6 0 "[ . 1 . 2]"
1 55 ARG 0.030 0.019 1 0 "[ . 1 . 2]"
1 56 LEU 0.000 0.000 7 0 "[ . 1 . 2]"
1 57 ARG 0.035 0.035 18 0 "[ . 1 . 2]"
1 58 ALA 0.066 0.022 6 0 "[ . 1 . 2]"
1 59 TYR 0.002 0.002 20 0 "[ . 1 . 2]"
1 60 GLN 0.000 0.000 7 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 31 VAL O 1 35 LYS H 2.000 . 2.300 2.119 1.990 2.229 . 0 0 "[ . 1 . 2]" 2
2 1 31 VAL O 1 35 LYS N 3.000 . 3.450 3.036 2.931 3.152 . 0 0 "[ . 1 . 2]" 2
3 1 35 LYS O 1 39 LYS H 2.000 . 2.300 1.900 1.781 2.127 0.019 18 0 "[ . 1 . 2]" 2
4 1 35 LYS O 1 39 LYS N 3.000 . 3.450 2.874 2.749 3.109 . 0 0 "[ . 1 . 2]" 2
5 1 51 GLU O 1 55 ARG H 2.000 . 2.300 1.919 1.781 2.147 0.019 1 0 "[ . 1 . 2]" 2
6 1 51 GLU O 1 55 ARG N 3.000 . 3.450 2.808 2.690 3.024 . 0 0 "[ . 1 . 2]" 2
7 1 53 ILE O 1 57 ARG H 2.000 . 2.300 2.061 1.881 2.335 0.035 18 0 "[ . 1 . 2]" 2
8 1 53 ILE O 1 57 ARG N 3.000 . 3.450 3.001 2.830 3.257 . 0 0 "[ . 1 . 2]" 2
9 1 54 GLU O 1 58 ALA H 2.000 . 2.300 1.884 1.778 2.046 0.022 6 0 "[ . 1 . 2]" 2
10 1 54 GLU O 1 58 ALA N 3.000 . 3.450 2.825 2.713 2.979 . 0 0 "[ . 1 . 2]" 2
11 1 55 ARG O 1 59 TYR H 2.000 . 2.300 2.131 1.917 2.302 0.002 20 0 "[ . 1 . 2]" 2
12 1 55 ARG O 1 59 TYR N 3.000 . 3.450 3.000 2.860 3.142 . 0 0 "[ . 1 . 2]" 2
13 1 56 LEU O 1 60 GLN H 2.000 . 2.300 1.956 1.800 2.150 0.000 7 0 "[ . 1 . 2]" 2
14 1 56 LEU O 1 60 GLN N 3.000 . 3.450 2.896 2.764 3.099 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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