NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
425626 |
2gmo   |
7056 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2gmo
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 1411
_Distance_constraint_stats_list.Viol_count 1200
_Distance_constraint_stats_list.Viol_total 713.729
_Distance_constraint_stats_list.Viol_max 0.743
_Distance_constraint_stats_list.Viol_rms 0.0238
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0051
_Distance_constraint_stats_list.Viol_average_violations_only 0.0595
_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 9 GLY 0.371 0.067 2 0 "[ . 1]"
1 10 VAL 1.582 0.165 6 0 "[ . 1]"
1 11 GLU 1.743 0.165 6 0 "[ . 1]"
1 12 SER 0.802 0.087 6 0 "[ . 1]"
1 13 ALA 0.370 0.070 9 0 "[ . 1]"
1 14 VAL 2.258 0.168 7 0 "[ . 1]"
1 15 LEU 3.217 0.275 4 0 "[ . 1]"
1 16 ARG 0.643 0.194 3 0 "[ . 1]"
1 17 GLY 0.022 0.022 10 0 "[ . 1]"
1 18 PHE 7.483 0.336 6 0 "[ . 1]"
1 19 LEU 2.549 0.139 2 0 "[ . 1]"
1 20 ILE 2.542 0.139 2 0 "[ . 1]"
1 21 LEU 2.416 0.132 7 0 "[ . 1]"
1 22 GLY 2.521 0.132 7 0 "[ . 1]"
1 23 LYS 1.408 0.073 5 0 "[ . 1]"
1 24 GLU 2.709 0.124 4 0 "[ . 1]"
1 25 ASP 3.763 0.152 4 0 "[ . 1]"
1 26 ARG 0.712 0.111 5 0 "[ . 1]"
1 27 ARG 0.224 0.169 7 0 "[ . 1]"
1 28 TYR 4.163 0.159 4 0 "[ . 1]"
1 29 GLY 0.653 0.054 8 0 "[ . 1]"
1 30 PRO 1.570 0.127 4 0 "[ . 1]"
1 31 ALA 1.299 0.127 4 0 "[ . 1]"
1 32 LEU 3.314 0.204 4 0 "[ . 1]"
1 33 SER 1.485 0.141 8 0 "[ . 1]"
1 34 ILE 4.011 0.153 8 0 "[ . 1]"
1 35 ASN 1.868 0.124 8 0 "[ . 1]"
1 36 GLU 2.339 0.153 8 0 "[ . 1]"
1 37 LEU 4.403 0.204 4 0 "[ . 1]"
1 38 SER 3.451 0.526 4 2 "[ +. - 1]"
1 39 ASN 0.024 0.024 10 0 "[ . 1]"
1 40 LEU 2.450 0.336 6 0 "[ . 1]"
1 41 ALA 2.949 0.743 7 2 "[ .-+ 1]"
1 42 LYS 5.095 0.743 7 2 "[ .-+ 1]"
1 43 GLY 0.965 0.139 6 0 "[ . 1]"
1 44 GLU 2.154 0.122 7 0 "[ . 1]"
1 45 LYS 3.646 0.130 8 0 "[ . 1]"
1 46 ALA 1.467 0.205 4 0 "[ . 1]"
1 47 ASN 1.742 0.067 1 0 "[ . 1]"
1 48 VAL 2.641 0.167 6 0 "[ . 1]"
1 49 LEU 2.237 0.107 2 0 "[ . 1]"
1 50 ILE 2.015 0.134 2 0 "[ . 1]"
1 51 GLY 1.472 0.134 2 0 "[ . 1]"
1 52 GLN 0.103 0.055 7 0 "[ . 1]"
1 53 GLY 0.268 0.085 8 0 "[ . 1]"
1 54 ASP 0.492 0.074 8 0 "[ . 1]"
1 55 VAL 0.616 0.050 4 0 "[ . 1]"
1 56 VAL 2.317 0.124 4 0 "[ . 1]"
1 57 LEU 7.072 0.205 4 0 "[ . 1]"
1 58 VAL 7.501 0.190 9 0 "[ . 1]"
1 59 MET 3.446 0.128 2 0 "[ . 1]"
1 60 LYS 7.814 0.526 4 2 "[ +. - 1]"
1 61 ARG 1.801 0.234 1 0 "[ . 1]"
1 62 LYS 0.396 0.093 10 0 "[ . 1]"
1 63 ARG 1.236 0.202 7 0 "[ . 1]"
1 65 SER 0.425 0.149 3 0 "[ . 1]"
1 66 SER 0.201 0.188 9 0 "[ . 1]"
1 67 ILE 4.210 0.267 8 0 "[ . 1]"
1 68 LEU 3.612 0.267 8 0 "[ . 1]"
1 69 THR 0.512 0.144 3 0 "[ . 1]"
1 70 ASP 0.108 0.046 2 0 "[ . 1]"
1 71 SER 0.253 0.053 9 0 "[ . 1]"
1 72 GLN 0.036 0.029 9 0 "[ . 1]"
1 73 THR 0.280 0.039 4 0 "[ . 1]"
1 74 ALA 0.181 0.053 9 0 "[ . 1]"
1 75 THR 0.888 0.194 8 0 "[ . 1]"
1 76 LYS 0.194 0.194 8 0 "[ . 1]"
1 77 ARG 0.533 0.065 5 0 "[ . 1]"
1 78 ILE 0.748 0.084 10 0 "[ . 1]"
1 79 ARG 0.662 0.063 2 0 "[ . 1]"
1 80 MET 0.041 0.041 8 0 "[ . 1]"
1 81 ALA 0.000 0.000 . 0 "[ . 1]"
1 82 ILE 0.389 0.234 1 0 "[ . 1]"
1 83 ASN 0.000 0.000 . 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 14 VAL MG2 1 37 LEU QD 5.000 . 6.000 4.945 4.811 5.151 . 0 0 "[ . 1]" 1
2 1 18 PHE HZ 1 40 LEU QD 5.073 . 5.748 3.024 2.836 3.221 . 0 0 "[ . 1]" 1
3 1 18 PHE QD 1 58 VAL HA 3.757 . 4.508 4.563 4.490 4.678 0.170 3 0 "[ . 1]" 1
4 1 25 ASP HA 1 28 TYR QD 4.064 . 4.837 4.951 4.931 4.989 0.152 4 0 "[ . 1]" 1
5 1 18 PHE HA 1 18 PHE QE 3.861 . 4.633 4.643 4.608 4.681 0.048 6 0 "[ . 1]" 1
6 1 18 PHE HA 1 18 PHE QD 3.106 . 3.727 3.031 2.991 3.103 . 0 0 "[ . 1]" 1
7 1 28 TYR HA 1 28 TYR QD 2.874 . 3.449 2.164 2.116 2.218 . 0 0 "[ . 1]" 1
8 1 28 TYR HA 1 28 TYR QE 3.559 . 4.271 4.287 4.262 4.307 0.036 4 0 "[ . 1]" 1
9 1 28 TYR QD 1 46 ALA HA 3.599 . 4.319 4.112 4.010 4.250 . 0 0 "[ . 1]" 1
10 1 15 LEU HA 1 18 PHE QE 3.676 . 4.411 4.202 4.014 4.430 0.019 1 0 "[ . 1]" 1
11 1 15 LEU HA 1 18 PHE QD 3.506 . 4.105 4.053 3.938 4.275 0.170 3 0 "[ . 1]" 1
12 1 18 PHE HZ 1 38 SER HA 3.903 . 4.684 3.037 2.946 3.129 . 0 0 "[ . 1]" 1
13 1 18 PHE QE 1 38 SER HA 3.730 . 4.476 3.942 3.765 4.093 . 0 0 "[ . 1]" 1
14 1 18 PHE HZ 1 38 SER QB 3.702 . 4.442 4.297 4.179 4.350 . 0 0 "[ . 1]" 1
15 1 18 PHE QE 1 38 SER QB 3.578 . 4.294 4.342 4.322 4.364 0.070 9 0 "[ . 1]" 1
16 1 12 SER QB 1 18 PHE QD 3.709 . 4.451 4.489 4.340 4.538 0.087 6 0 "[ . 1]" 1
17 1 18 PHE QE 1 60 LYS HA 3.970 . 4.664 4.341 3.897 4.733 0.069 6 0 "[ . 1]" 1
18 1 18 PHE QD 1 60 LYS HA 3.108 . 3.730 3.360 2.963 3.808 0.078 4 0 "[ . 1]" 1
19 1 28 TYR QB 1 28 TYR QD 2.861 . 3.394 2.174 2.169 2.184 . 0 0 "[ . 1]" 1
20 1 28 TYR QB 1 28 TYR QE 3.510 . 3.901 3.947 3.944 3.951 0.050 8 0 "[ . 1]" 1
21 1 18 PHE QB 1 18 PHE QE 3.630 . 4.219 3.917 3.911 3.922 . 0 0 "[ . 1]" 1
22 1 18 PHE QB 1 18 PHE QD 2.861 . 3.433 2.120 2.113 2.128 . 0 0 "[ . 1]" 1
23 1 18 PHE HZ 1 60 LYS QE 3.536 . 4.243 3.932 2.677 4.351 0.108 7 0 "[ . 1]" 1
24 1 18 PHE QE 1 60 LYS QE 3.358 . 4.030 2.033 1.841 2.501 . 0 0 "[ . 1]" 1
25 1 18 PHE QD 1 58 VAL HB 3.052 . 3.662 1.929 1.842 2.088 . 0 0 "[ . 1]" 1
26 1 18 PHE QD 1 60 LYS QB 3.559 . 4.271 4.138 2.751 4.351 0.080 1 0 "[ . 1]" 1
27 1 18 PHE QE 1 60 LYS QB 3.369 . 4.043 3.996 2.836 4.179 0.136 5 0 "[ . 1]" 1
28 1 18 PHE QE 1 40 LEU HG 3.694 . 4.433 4.481 4.463 4.508 0.075 6 0 "[ . 1]" 1
29 1 18 PHE HZ 1 40 LEU QB 4.628 . 5.354 3.813 3.694 4.147 . 0 0 "[ . 1]" 1
30 1 18 PHE QE 1 40 LEU QB 3.154 . 3.785 3.146 2.961 3.543 . 0 0 "[ . 1]" 1
31 1 15 LEU QB 1 18 PHE QD 3.290 . 3.808 1.670 1.538 1.779 . 0 0 "[ . 1]" 1
32 1 18 PHE HZ 1 37 LEU HG 3.163 . 3.796 2.858 2.624 3.058 . 0 0 "[ . 1]" 1
33 1 18 PHE QE 1 37 LEU HG 3.236 . 3.883 2.533 2.296 2.665 . 0 0 "[ . 1]" 1
34 1 15 LEU HG 1 18 PHE QD 3.459 . 4.151 4.004 3.585 4.262 0.111 9 0 "[ . 1]" 1
35 1 18 PHE HZ 1 37 LEU QB 3.284 . 3.941 2.030 1.848 2.337 . 0 0 "[ . 1]" 1
36 1 18 PHE QE 1 37 LEU QB 3.287 . 3.904 2.915 2.794 3.205 . 0 0 "[ . 1]" 1
37 1 28 TYR QE 1 57 LEU QB . . 3.952 4.065 4.043 4.111 0.159 4 0 "[ . 1]" 1
38 1 28 TYR QD 1 57 LEU QB 5.285 . 6.342 3.407 3.356 3.609 . 0 0 "[ . 1]" 1
39 1 18 PHE QD 1 60 LYS QD 3.291 . 3.949 2.518 2.221 3.075 . 0 0 "[ . 1]" 1
40 1 18 PHE HZ 1 60 LYS QD 3.328 . 3.994 3.677 3.606 3.845 . 0 0 "[ . 1]" 1
41 1 18 PHE QE 1 60 LYS QD 2.900 . 3.480 2.001 1.744 2.081 . 0 0 "[ . 1]" 1
42 1 18 PHE QE 1 60 LYS QG 3.510 . 4.212 3.978 3.643 4.058 . 0 0 "[ . 1]" 1
43 1 28 TYR QE 1 45 LYS QD 3.077 . 3.692 2.562 2.476 2.634 . 0 0 "[ . 1]" 1
44 1 28 TYR QD 1 45 LYS QD 3.697 . 4.336 4.444 4.424 4.466 0.130 8 0 "[ . 1]" 1
45 1 28 TYR QD 1 45 LYS QB 3.657 . 4.308 3.395 3.351 3.445 . 0 0 "[ . 1]" 1
46 1 28 TYR QE 1 45 LYS QB 3.246 . 3.895 2.209 2.069 2.356 . 0 0 "[ . 1]" 1
47 1 18 PHE QD 1 40 LEU MD1 3.241 . 3.889 3.877 3.771 3.920 0.031 9 0 "[ . 1]" 1
48 1 18 PHE QD 1 40 LEU QD 3.795 . 4.554 3.835 3.727 3.878 . 0 0 "[ . 1]" 1
49 1 28 TYR QD 1 57 LEU QD 3.466 . 4.079 2.073 1.839 2.238 . 0 0 "[ . 1]" 1
50 1 28 TYR QE 1 57 LEU QD 3.041 . 3.649 2.207 2.127 2.270 . 0 0 "[ . 1]" 1
51 1 18 PHE QD 1 58 VAL MG1 3.726 . 4.471 3.150 3.070 3.256 . 0 0 "[ . 1]" 1
52 1 18 PHE HZ 1 58 VAL MG2 3.889 . 4.667 4.661 4.493 4.713 0.046 6 0 "[ . 1]" 1
53 1 18 PHE QE 1 58 VAL MG2 3.153 . 3.784 3.452 3.355 3.600 . 0 0 "[ . 1]" 1
54 1 18 PHE QD 1 58 VAL MG2 2.902 . 3.482 2.999 2.883 3.103 . 0 0 "[ . 1]" 1
55 1 28 TYR QD 1 57 LEU HG 4.890 . 5.868 5.023 4.855 5.167 . 0 0 "[ . 1]" 1
56 1 28 TYR QE 1 57 LEU HG 5.256 . 6.000 4.948 4.776 5.083 . 0 0 "[ . 1]" 1
57 1 15 LEU MD2 1 18 PHE QE 2.911 . 3.493 3.269 2.309 3.526 0.033 9 0 "[ . 1]" 1
58 1 15 LEU MD2 1 18 PHE QD 3.220 . 3.864 2.992 2.532 3.617 . 0 0 "[ . 1]" 1
59 1 18 PHE HZ 1 37 LEU MD2 3.529 . 4.235 3.425 3.274 3.608 . 0 0 "[ . 1]" 1
60 1 18 PHE QE 1 37 LEU MD2 3.691 . 4.429 3.221 3.067 3.351 . 0 0 "[ . 1]" 1
61 1 18 PHE QD 1 37 LEU MD2 3.666 . 4.399 3.652 3.512 3.761 . 0 0 "[ . 1]" 1
62 1 18 PHE HZ 1 37 LEU MD1 3.513 . 4.216 4.171 4.090 4.259 0.043 2 0 "[ . 1]" 1
63 1 18 PHE QE 1 37 LEU MD1 3.231 . 3.877 3.859 3.563 3.925 0.048 8 0 "[ . 1]" 1
64 1 32 LEU MD1 1 46 ALA MB . . 3.360 2.651 2.008 2.937 . 0 0 "[ . 1]" 1
65 1 32 LEU MD2 1 46 ALA MB 4.619 . 5.543 3.275 2.631 3.678 . 0 0 "[ . 1]" 1
66 1 21 LEU MD1 1 59 MET ME 5.378 . 6.414 6.374 5.741 6.473 0.059 6 0 "[ . 1]" 1
67 1 40 LEU MD1 1 46 ALA MB . . 3.360 1.919 1.832 2.001 . 0 0 "[ . 1]" 1
68 1 31 ALA MB 1 49 LEU MD2 4.937 . 5.924 3.703 3.062 5.150 . 0 0 "[ . 1]" 1
69 1 49 LEU MD2 1 55 VAL MG2 4.687 . 5.624 2.343 1.815 5.012 . 0 0 "[ . 1]" 1
70 1 15 LEU MD1 1 50 ILE MD 4.841 . 5.809 5.841 5.823 5.867 0.058 7 0 "[ . 1]" 1
71 1 15 LEU MD1 1 50 ILE MG 4.680 . 5.616 3.711 3.428 4.183 . 0 0 "[ . 1]" 1
72 1 31 ALA MB 1 49 LEU QD 5.024 . 6.029 3.438 3.002 3.969 . 0 0 "[ . 1]" 1
73 1 49 LEU MD1 1 55 VAL MG2 4.329 . 5.195 3.886 3.076 4.258 . 0 0 "[ . 1]" 1
74 1 19 LEU MD1 1 59 MET ME . . 4.080 3.432 3.255 3.759 . 0 0 "[ . 1]" 1
75 1 19 LEU MD2 1 59 MET ME 5.186 . 6.000 5.486 5.408 5.532 . 0 0 "[ . 1]" 1
76 1 15 LEU MD2 1 48 VAL MG2 4.711 . 5.653 3.050 2.287 3.855 . 0 0 "[ . 1]" 1
77 1 15 LEU MD2 1 50 ILE MG 5.265 . 6.318 4.380 3.692 5.234 . 0 0 "[ . 1]" 1
78 1 15 LEU MD2 1 34 ILE MD 4.680 . 5.616 3.322 2.729 3.977 . 0 0 "[ . 1]" 1
79 1 21 LEU QD 1 59 MET ME 4.792 . 5.750 4.423 4.326 4.564 . 0 0 "[ . 1]" 1
80 1 48 VAL MG2 1 50 ILE MD 5.032 . 6.038 5.169 4.119 5.783 . 0 0 "[ . 1]" 1
81 1 50 ILE MD 1 56 VAL MG2 4.390 . 5.268 2.110 1.897 2.559 . 0 0 "[ . 1]" 1
82 1 50 ILE MD 1 56 VAL MG1 4.453 . 5.344 2.863 2.617 3.287 . 0 0 "[ . 1]" 1
83 1 34 ILE MD 1 50 ILE MG 4.766 . 5.719 4.382 3.867 4.905 . 0 0 "[ . 1]" 1
84 1 34 ILE MD 1 48 VAL MG1 5.007 . 6.008 2.698 2.406 2.980 . 0 0 "[ . 1]" 1
85 1 14 VAL MG1 1 34 ILE MD 5.053 . 6.064 6.103 6.028 6.153 0.089 5 0 "[ . 1]" 1
86 1 14 VAL MG2 1 34 ILE MD 4.850 . 5.820 4.424 4.258 4.514 . 0 0 "[ . 1]" 1
87 1 46 ALA MB 1 58 VAL MG2 4.879 . 5.855 2.719 2.464 2.871 . 0 0 "[ . 1]" 1
88 1 31 ALA MB 1 55 VAL QG 5.304 . 6.365 3.502 3.161 3.745 . 0 0 "[ . 1]" 1
89 1 48 VAL MG2 1 58 VAL MG1 4.488 . 5.386 3.189 3.126 3.223 . 0 0 "[ . 1]" 1
90 1 48 VAL MG1 1 58 VAL MG2 4.779 . 5.735 3.198 3.099 3.283 . 0 0 "[ . 1]" 1
91 1 48 VAL MG1 1 56 VAL MG2 5.425 . 6.510 5.402 5.241 5.586 . 0 0 "[ . 1]" 1
92 1 48 VAL MG2 1 56 VAL MG1 4.870 . 5.844 5.454 5.342 5.566 . 0 0 "[ . 1]" 1
93 1 14 VAL MG2 1 34 ILE MG 5.004 . 6.005 4.233 3.539 4.844 . 0 0 "[ . 1]" 1
94 1 48 VAL MG2 1 58 VAL MG2 4.842 . 5.810 1.881 1.852 1.921 . 0 0 "[ . 1]" 1
95 1 48 VAL MG2 1 56 VAL MG2 4.642 . 5.570 3.365 3.165 3.568 . 0 0 "[ . 1]" 1
96 1 37 LEU MD2 1 40 LEU MD1 4.287 . 5.144 3.434 3.344 3.523 . 0 0 "[ . 1]" 1
97 1 14 VAL MG2 1 15 LEU MD2 4.843 . 5.812 3.308 2.465 3.939 . 0 0 "[ . 1]" 1
98 1 19 LEU MD2 1 21 LEU MD2 5.374 . 6.449 5.407 4.755 5.799 . 0 0 "[ . 1]" 1
99 1 13 ALA MB 1 14 VAL MG1 . . 4.080 3.122 2.943 3.268 . 0 0 "[ . 1]" 1
100 1 13 ALA MB 1 14 VAL MG2 . . 4.080 3.612 3.469 3.714 . 0 0 "[ . 1]" 1
101 1 10 VAL MG2 1 13 ALA MB 5.688 . 6.826 4.020 3.750 4.443 . 0 0 "[ . 1]" 1
102 1 48 VAL MG1 1 50 ILE MG 5.095 . 6.114 5.356 5.050 5.741 . 0 0 "[ . 1]" 1
103 1 48 VAL MG2 1 50 ILE MG 4.481 . 5.377 3.257 3.070 3.552 . 0 0 "[ . 1]" 1
104 1 56 VAL MG2 1 58 VAL MG1 4.204 . 5.045 3.799 3.691 3.889 . 0 0 "[ . 1]" 1
105 1 15 LEU MD1 1 48 VAL MG1 6.470 . 7.764 2.813 1.930 3.688 . 0 0 "[ . 1]" 1
106 1 31 ALA H 1 47 ASN H 5.000 . 6.000 3.497 3.397 3.591 . 0 0 "[ . 1]" 1
107 1 54 ASP H 1 56 VAL H 5.000 . 6.000 6.032 6.020 6.074 0.074 8 0 "[ . 1]" 1
108 1 40 LEU QB 1 41 ALA H 2.800 . 3.360 2.465 1.891 2.684 . 0 0 "[ . 1]" 1
109 1 68 LEU H 1 68 LEU QB 2.800 . 3.360 3.095 2.953 3.324 . 0 0 "[ . 1]" 1
110 1 32 LEU H 1 48 VAL QG 5.000 . 6.000 2.890 2.353 3.576 . 0 0 "[ . 1]" 1
111 1 32 LEU H 1 32 LEU QD 3.400 . 4.080 2.144 1.839 2.391 . 0 0 "[ . 1]" 1
112 1 32 LEU H 1 32 LEU QB 3.400 . 4.080 3.096 2.830 3.341 . 0 0 "[ . 1]" 1
113 1 57 LEU H 1 57 LEU QB 2.800 . 3.360 2.882 2.830 3.037 . 0 0 "[ . 1]" 1
114 1 31 ALA H 1 32 LEU QD 5.000 . 6.000 3.959 3.568 4.222 . 0 0 "[ . 1]" 1
115 1 30 PRO QD 1 31 ALA H 5.000 . 6.000 2.306 2.140 2.453 . 0 0 "[ . 1]" 1
116 1 10 VAL QG 1 11 GLU H 2.800 . 3.360 3.240 2.297 3.414 0.054 4 0 "[ . 1]" 1
117 1 66 SER QB 1 67 ILE H 3.400 . 4.080 2.495 1.907 2.809 . 0 0 "[ . 1]" 1
118 1 19 LEU H 1 59 MET QB 5.000 . 6.000 3.190 3.070 3.292 . 0 0 "[ . 1]" 1
119 1 37 LEU QD 1 40 LEU H 5.000 . 6.000 4.745 4.576 4.901 . 0 0 "[ . 1]" 1
120 1 40 LEU H 1 40 LEU QB 2.800 . 3.360 2.323 2.271 2.420 . 0 0 "[ . 1]" 1
121 1 26 ARG QD 1 27 ARG H 5.000 . 6.000 4.147 4.027 4.187 . 0 0 "[ . 1]" 1
122 1 45 LYS H 1 57 LEU QD 5.000 . 6.000 4.603 4.561 4.640 . 0 0 "[ . 1]" 1
123 1 45 LYS H 1 45 LYS QB 2.800 . 3.360 2.457 2.399 2.484 . 0 0 "[ . 1]" 1
124 1 44 GLU QB 1 45 LYS H 2.800 . 3.360 2.193 2.172 2.219 . 0 0 "[ . 1]" 1
125 1 42 LYS QD 1 44 GLU H 5.000 . 6.000 5.137 4.822 6.017 0.017 7 0 "[ . 1]" 1
126 1 44 GLU H 1 44 GLU QB 2.800 . 3.360 2.453 2.390 2.505 . 0 0 "[ . 1]" 1
127 1 16 ARG H 1 16 ARG QB 2.800 . 3.360 3.170 2.810 3.374 0.014 2 0 "[ . 1]" 1
128 1 16 ARG H 1 16 ARG QD 5.000 . 6.000 4.723 4.196 5.279 . 0 0 "[ . 1]" 1
129 1 16 ARG H 1 17 GLY QA 5.000 . 6.000 4.666 3.835 5.083 . 0 0 "[ . 1]" 1
130 1 42 LYS H 1 44 GLU QB 5.000 . 6.000 5.009 4.924 5.126 . 0 0 "[ . 1]" 1
131 1 42 LYS H 1 42 LYS QE 5.000 . 6.000 4.919 4.635 5.339 . 0 0 "[ . 1]" 1
132 1 23 LYS H 1 23 LYS QG 2.800 . 3.360 1.843 1.803 1.891 . 0 0 "[ . 1]" 1
133 1 15 LEU H 1 16 ARG QB 5.000 . 6.000 5.133 4.652 5.391 . 0 0 "[ . 1]" 1
134 1 10 VAL H 1 10 VAL QG 2.800 . 3.360 2.091 1.791 2.719 . 0 0 "[ . 1]" 1
135 1 37 LEU H 1 37 LEU QD 2.800 . 3.360 2.884 2.749 3.122 . 0 0 "[ . 1]" 1
136 1 36 GLU QG 1 37 LEU H 2.800 . 3.360 3.380 2.877 3.460 0.100 10 0 "[ . 1]" 1
137 1 57 LEU QB 1 58 VAL H 5.000 . 6.000 2.474 2.445 2.533 . 0 0 "[ . 1]" 1
138 1 16 ARG QB 1 18 PHE H 5.000 . 6.000 5.156 4.276 5.463 . 0 0 "[ . 1]" 1
139 1 17 GLY QA 1 18 PHE H 3.400 . 4.080 2.855 2.632 2.924 . 0 0 "[ . 1]" 1
140 1 36 GLU H 1 37 LEU QD 5.000 . 6.000 4.055 3.922 4.338 . 0 0 "[ . 1]" 1
141 1 36 GLU H 1 36 GLU QG 2.800 . 3.360 1.978 1.867 2.700 . 0 0 "[ . 1]" 1
142 1 14 VAL H 1 14 VAL QG 2.800 . 3.360 1.850 1.822 1.893 . 0 0 "[ . 1]" 1
143 1 39 ASN H 1 40 LEU QB 5.000 . 6.000 4.414 4.342 4.624 . 0 0 "[ . 1]" 1
144 1 35 ASN H 1 36 GLU QG 5.000 . 6.000 3.729 3.588 4.766 . 0 0 "[ . 1]" 1
145 1 35 ASN H 1 35 ASN QB 2.800 . 3.360 2.243 2.202 2.251 . 0 0 "[ . 1]" 1
146 1 10 VAL QG 1 12 SER H 5.000 . 6.000 4.630 4.106 4.919 . 0 0 "[ . 1]" 1
147 1 11 GLU QB 1 12 SER H 3.400 . 4.080 2.768 2.251 3.631 . 0 0 "[ . 1]" 1
148 1 12 SER H 1 12 SER QB 3.400 . 4.080 2.560 2.466 2.655 . 0 0 "[ . 1]" 1
149 1 33 SER H 1 36 GLU QB 2.800 . 3.360 3.360 3.159 3.501 0.141 8 0 "[ . 1]" 1
150 1 28 TYR H 1 28 TYR QD 3.400 . 4.080 3.282 3.211 3.369 . 0 0 "[ . 1]" 1
151 1 37 LEU QD 1 38 SER H 5.000 . 6.000 4.173 4.106 4.213 . 0 0 "[ . 1]" 1
152 1 36 GLU QG 1 38 SER H 5.000 . 6.000 5.395 4.504 5.550 . 0 0 "[ . 1]" 1
153 1 52 GLN QB 1 53 GLY H 5.000 . 6.000 3.867 3.667 4.039 . 0 0 "[ . 1]" 1
154 1 36 GLU QG 1 39 ASN QD 5.000 . 6.000 5.011 4.230 6.024 0.024 10 0 "[ . 1]" 1
155 1 21 LEU QD 1 22 GLY H 2.800 . 3.360 2.260 2.140 2.308 . 0 0 "[ . 1]" 1
156 1 10 VAL H 1 10 VAL HB 2.800 . 3.360 2.795 2.569 3.478 0.118 8 0 "[ . 1]" 1
157 1 10 VAL HA 1 11 GLU H 2.800 . 3.360 3.455 3.417 3.525 0.165 6 0 "[ . 1]" 1
158 1 10 VAL H 1 11 GLU H 3.400 . 4.080 2.742 2.421 4.041 . 0 0 "[ . 1]" 1
159 1 11 GLU H 1 11 GLU QG 2.800 . 3.360 2.544 1.711 3.342 . 0 0 "[ . 1]" 1
160 1 11 GLU HA 1 12 SER H 3.400 . 4.080 3.519 3.414 3.562 . 0 0 "[ . 1]" 1
161 1 11 GLU QG 1 12 SER H 5.000 . 6.000 3.541 1.899 4.580 . 0 0 "[ . 1]" 1
162 1 11 GLU H 1 12 SER H 5.000 . 6.000 2.614 2.422 2.753 . 0 0 "[ . 1]" 1
163 1 13 ALA HA 1 14 VAL H 3.400 . 4.080 3.581 3.570 3.596 . 0 0 "[ . 1]" 1
164 1 13 ALA MB 1 14 VAL H 5.000 . 6.000 2.206 2.169 2.240 . 0 0 "[ . 1]" 1
165 1 13 ALA H 1 14 VAL H 5.000 . 6.000 2.943 2.884 3.008 . 0 0 "[ . 1]" 1
166 1 14 VAL H 1 14 VAL HB 3.200 . 3.760 3.621 3.608 3.639 . 0 0 "[ . 1]" 1
167 1 14 VAL H 1 15 LEU QB 5.000 . 6.000 4.540 4.172 4.830 . 0 0 "[ . 1]" 1
168 1 14 VAL HA 1 15 LEU H 3.400 . 4.080 3.524 3.510 3.544 . 0 0 "[ . 1]" 1
169 1 14 VAL HB 1 15 LEU H 2.800 . 3.360 3.432 3.397 3.459 0.099 5 0 "[ . 1]" 1
170 1 14 VAL MG2 1 15 LEU H 5.000 . 6.000 1.757 1.679 1.821 . 0 0 "[ . 1]" 1
171 1 14 VAL H 1 15 LEU H 5.000 . 6.000 2.754 2.593 2.835 . 0 0 "[ . 1]" 1
172 1 15 LEU H 1 15 LEU MD1 5.000 . 6.000 2.882 2.191 3.508 . 0 0 "[ . 1]" 1
173 1 15 LEU H 1 15 LEU MD2 5.000 . 6.000 3.566 3.058 4.003 . 0 0 "[ . 1]" 1
174 1 15 LEU H 1 15 LEU HG 3.800 . 4.560 3.086 2.006 4.097 . 0 0 "[ . 1]" 1
175 1 15 LEU HA 1 16 ARG H 3.400 . 3.960 3.515 3.442 3.547 . 0 0 "[ . 1]" 1
176 1 15 LEU MD1 1 16 ARG H 5.000 . 6.000 4.327 4.201 4.527 . 0 0 "[ . 1]" 1
177 1 15 LEU MD2 1 16 ARG H 5.000 . 6.000 4.504 3.638 4.976 . 0 0 "[ . 1]" 1
178 1 15 LEU H 1 16 ARG H 3.400 . 4.080 2.887 2.585 3.580 . 0 0 "[ . 1]" 1
179 1 16 ARG H 1 16 ARG HA 2.800 . 3.360 2.373 2.264 2.797 . 0 0 "[ . 1]" 1
180 1 15 LEU MD2 1 18 PHE H 5.000 . 6.000 4.932 3.811 5.816 . 0 0 "[ . 1]" 1
181 1 16 ARG QG 1 18 PHE H 5.000 . 6.000 5.729 5.227 6.023 0.023 5 0 "[ . 1]" 1
182 1 18 PHE H 1 18 PHE QB 2.800 . 3.360 2.573 2.336 2.680 . 0 0 "[ . 1]" 1
183 1 18 PHE H 1 18 PHE QD 5.000 . 6.000 2.805 2.449 3.051 . 0 0 "[ . 1]" 1
184 1 18 PHE H 1 19 LEU MD2 5.000 . 6.000 5.718 5.072 6.080 0.080 5 0 "[ . 1]" 1
185 1 18 PHE QB 1 19 LEU H 5.000 . 6.000 2.132 2.090 2.328 . 0 0 "[ . 1]" 1
186 1 18 PHE H 1 19 LEU H 5.000 . 6.000 4.448 4.416 4.532 . 0 0 "[ . 1]" 1
187 1 19 LEU HA 1 20 ILE H 2.800 . 3.360 2.381 2.279 2.469 . 0 0 "[ . 1]" 1
188 1 19 LEU QB 1 20 ILE H 3.400 . 4.080 2.683 2.288 3.272 . 0 0 "[ . 1]" 1
189 1 19 LEU H 1 20 ILE H 5.000 . 6.000 4.485 4.422 4.540 . 0 0 "[ . 1]" 1
190 1 20 ILE H 1 20 ILE HB 2.800 . 3.360 2.487 2.356 2.570 . 0 0 "[ . 1]" 1
191 1 20 ILE H 1 21 LEU H 5.000 . 6.000 4.269 4.230 4.374 . 0 0 "[ . 1]" 1
192 1 21 LEU H 1 21 LEU MD2 3.400 . 4.080 3.769 2.095 3.995 . 0 0 "[ . 1]" 1
193 1 21 LEU HA 1 22 GLY H 2.800 . 3.360 3.477 3.465 3.492 0.132 7 0 "[ . 1]" 1
194 1 21 LEU QB 1 22 GLY H 2.800 . 3.360 1.601 1.516 2.066 . 0 0 "[ . 1]" 1
195 1 21 LEU H 1 22 GLY H . . 3.360 3.247 3.164 3.320 . 0 0 "[ . 1]" 1
196 1 22 GLY H 1 23 LYS QB 5.000 . 6.000 5.780 5.732 5.828 . 0 0 "[ . 1]" 1
197 1 22 GLY H 1 23 LYS H 4.000 . 4.680 4.398 4.369 4.414 . 0 0 "[ . 1]" 1
198 1 23 LYS H 1 23 LYS QB 2.800 . 3.360 2.906 2.836 2.968 . 0 0 "[ . 1]" 1
199 1 23 LYS H 1 24 GLU QG 3.400 . 4.080 3.591 3.467 3.732 . 0 0 "[ . 1]" 1
200 1 23 LYS HA 1 24 GLU H 2.800 . 3.360 2.400 2.345 2.442 . 0 0 "[ . 1]" 1
201 1 23 LYS QB 1 24 GLU H 3.800 . 4.360 3.903 3.862 3.929 . 0 0 "[ . 1]" 1
202 1 23 LYS H 1 24 GLU H 3.400 . 4.080 3.576 3.467 3.769 . 0 0 "[ . 1]" 1
203 1 23 LYS HA 1 25 ASP H 5.400 . 6.400 6.450 6.434 6.473 0.073 5 0 "[ . 1]" 1
204 1 24 GLU HA 1 25 ASP H 2.800 . 3.360 2.751 2.708 2.765 . 0 0 "[ . 1]" 1
205 1 24 GLU H 1 25 ASP H 5.000 . 6.000 4.292 4.284 4.326 . 0 0 "[ . 1]" 1
206 1 25 ASP H 1 25 ASP QB 3.400 . 4.080 2.872 2.855 2.884 . 0 0 "[ . 1]" 1
207 1 25 ASP QB 1 27 ARG H 5.000 . 6.000 4.346 4.265 4.400 . 0 0 "[ . 1]" 1
208 1 26 ARG HA 1 27 ARG H 5.000 . 6.000 3.330 3.321 3.342 . 0 0 "[ . 1]" 1
209 1 26 ARG QB 1 27 ARG H 5.000 . 6.000 3.306 3.251 3.760 . 0 0 "[ . 1]" 1
210 1 26 ARG QG 1 27 ARG H 5.000 . 6.000 4.505 2.753 4.719 . 0 0 "[ . 1]" 1
211 1 26 ARG H 1 27 ARG H 5.000 . 6.000 2.628 2.590 2.764 . 0 0 "[ . 1]" 1
212 1 27 ARG H 1 27 ARG HA 2.800 . 3.360 2.787 2.769 2.806 . 0 0 "[ . 1]" 1
213 1 27 ARG H 1 27 ARG QB 2.800 . 3.360 2.381 2.234 2.544 . 0 0 "[ . 1]" 1
214 1 27 ARG H 1 27 ARG QD 5.000 . 6.000 4.135 3.258 4.706 . 0 0 "[ . 1]" 1
215 1 26 ARG HA 1 28 TYR H 5.000 . 6.000 3.328 3.151 3.453 . 0 0 "[ . 1]" 1
216 1 27 ARG H 1 28 TYR HA 5.000 . 6.000 5.239 5.199 5.272 . 0 0 "[ . 1]" 1
217 1 27 ARG QB 1 28 TYR H 5.000 . 6.000 3.258 2.917 3.717 . 0 0 "[ . 1]" 1
218 1 27 ARG QG 1 28 TYR H 3.400 . 4.080 3.468 2.653 4.040 . 0 0 "[ . 1]" 1
219 1 27 ARG H 1 28 TYR H 2.800 . 3.360 2.678 2.645 2.704 . 0 0 "[ . 1]" 1
220 1 28 TYR H 1 28 TYR QB 3.400 . 4.080 2.267 2.241 2.302 . 0 0 "[ . 1]" 1
221 1 26 ARG HA 1 29 GLY H 3.400 . 4.080 3.268 3.180 3.363 . 0 0 "[ . 1]" 1
222 1 27 ARG H 1 29 GLY H 5.000 . 6.000 4.384 4.321 4.427 . 0 0 "[ . 1]" 1
223 1 28 TYR QB 1 29 GLY H 5.000 . 6.000 2.637 2.600 2.660 . 0 0 "[ . 1]" 1
224 1 28 TYR H 1 29 GLY H 2.800 . 3.360 2.513 2.490 2.540 . 0 0 "[ . 1]" 1
225 1 29 GLY H 1 30 PRO QB 5.000 . 6.000 5.185 5.172 5.201 . 0 0 "[ . 1]" 1
226 1 30 PRO QB 1 31 ALA H 3.800 . 4.560 2.393 2.284 2.542 . 0 0 "[ . 1]" 1
227 1 30 PRO QG 1 31 ALA H 3.400 . 4.080 1.805 1.708 1.882 . 0 0 "[ . 1]" 1
228 1 31 ALA H 1 31 ALA MB 2.800 . 3.360 2.858 2.833 2.879 . 0 0 "[ . 1]" 1
229 1 31 ALA MB 1 32 LEU H 5.000 . 6.000 3.598 3.484 3.690 . 0 0 "[ . 1]" 1
230 1 31 ALA H 1 32 LEU H 5.000 . 6.000 3.085 2.697 3.554 . 0 0 "[ . 1]" 1
231 1 32 LEU H 1 32 LEU HG 3.400 . 4.080 2.323 1.903 2.823 . 0 0 "[ . 1]" 1
232 1 32 LEU H 1 33 SER QB 5.000 . 6.000 5.795 5.626 5.959 . 0 0 "[ . 1]" 1
233 1 32 LEU QB 1 33 SER H 3.400 . 4.080 1.738 1.714 1.845 . 0 0 "[ . 1]" 1
234 1 32 LEU MD1 1 33 SER H 4.400 . 5.280 2.957 2.863 3.168 . 0 0 "[ . 1]" 1
235 1 32 LEU HG 1 33 SER H 5.000 . 6.000 4.451 4.398 4.526 . 0 0 "[ . 1]" 1
236 1 32 LEU H 1 33 SER H 5.000 . 6.000 4.364 4.301 4.431 . 0 0 "[ . 1]" 1
237 1 33 SER H 1 33 SER QB 3.400 . 4.080 2.364 2.333 2.408 . 0 0 "[ . 1]" 1
238 1 33 SER HA 1 34 ILE H 2.800 . 3.360 2.421 2.349 2.517 . 0 0 "[ . 1]" 1
239 1 33 SER QB 1 34 ILE H 3.400 . 4.080 3.226 3.087 3.345 . 0 0 "[ . 1]" 1
240 1 33 SER H 1 34 ILE H 5.000 . 6.000 4.529 4.495 4.562 . 0 0 "[ . 1]" 1
241 1 34 ILE H 1 34 ILE HB 2.800 . 3.360 2.286 2.267 2.300 . 0 0 "[ . 1]" 1
242 1 34 ILE H 1 34 ILE QG 3.400 . 4.080 3.420 3.392 3.449 . 0 0 "[ . 1]" 1
243 1 33 SER HA 1 35 ASN H 5.000 . 6.000 4.450 4.322 4.628 . 0 0 "[ . 1]" 1
244 1 33 SER QB 1 35 ASN H 5.000 . 6.000 3.335 3.189 3.480 . 0 0 "[ . 1]" 1
245 1 33 SER H 1 35 ASN H 5.000 . 6.000 5.247 5.149 5.490 . 0 0 "[ . 1]" 1
246 1 34 ILE HA 1 35 ASN H 5.000 . 6.000 3.531 3.523 3.541 . 0 0 "[ . 1]" 1
247 1 34 ILE HB 1 35 ASN H 3.400 . 4.080 2.721 2.602 2.791 . 0 0 "[ . 1]" 1
248 1 34 ILE QG 1 35 ASN H 5.000 . 6.000 4.509 4.442 4.549 . 0 0 "[ . 1]" 1
249 1 34 ILE H 1 35 ASN H 3.400 . 4.080 2.651 2.561 2.758 . 0 0 "[ . 1]" 1
250 1 35 ASN H 1 35 ASN HA 2.800 . 3.360 2.758 2.753 2.763 . 0 0 "[ . 1]" 1
251 1 33 SER H 1 36 GLU H 5.000 . 6.000 4.108 4.047 4.207 . 0 0 "[ . 1]" 1
252 1 34 ILE HA 1 36 GLU H 5.000 . 6.000 3.585 3.548 3.663 . 0 0 "[ . 1]" 1
253 1 34 ILE H 1 36 GLU H 5.000 . 6.000 3.995 3.878 4.043 . 0 0 "[ . 1]" 1
254 1 35 ASN H 1 36 GLU H 2.800 . 3.360 2.702 2.677 2.743 . 0 0 "[ . 1]" 1
255 1 36 GLU H 1 36 GLU HA 2.800 . 3.360 2.934 2.932 2.936 . 0 0 "[ . 1]" 1
256 1 34 ILE HA 1 37 LEU H 5.000 . 6.000 2.834 2.774 2.925 . 0 0 "[ . 1]" 1
257 1 35 ASN HA 1 37 LEU H 5.000 . 6.000 4.247 4.156 4.331 . 0 0 "[ . 1]" 1
258 1 36 GLU H 1 37 LEU HA 5.000 . 6.000 4.675 4.643 4.701 . 0 0 "[ . 1]" 1
259 1 36 GLU H 1 37 LEU H 2.800 . 3.360 2.055 2.019 2.120 . 0 0 "[ . 1]" 1
260 1 37 LEU H 1 37 LEU QB 2.800 . 3.360 1.992 1.980 2.008 . 0 0 "[ . 1]" 1
261 1 38 SER H 1 39 ASN H 3.400 . 4.080 2.617 2.525 2.706 . 0 0 "[ . 1]" 1
262 1 39 ASN H 1 39 ASN QB . . 3.360 2.489 2.363 2.741 . 0 0 "[ . 1]" 1
263 1 39 ASN HA 1 40 LEU H 3.400 . 4.080 3.256 3.178 3.380 . 0 0 "[ . 1]" 1
264 1 39 ASN QB 1 40 LEU H . . 4.080 3.430 3.142 3.948 . 0 0 "[ . 1]" 1
265 1 39 ASN H 1 40 LEU H 2.800 . 3.360 2.445 2.308 2.527 . 0 0 "[ . 1]" 1
266 1 40 LEU H 1 40 LEU HA 2.800 . 3.360 2.846 2.802 2.880 . 0 0 "[ . 1]" 1
267 1 40 LEU H 1 40 LEU MD2 3.400 . 4.080 3.744 3.528 3.871 . 0 0 "[ . 1]" 1
268 1 40 LEU H 1 41 ALA MB 5.000 . 6.000 5.789 5.722 5.849 . 0 0 "[ . 1]" 1
269 1 40 LEU HA 1 41 ALA H 2.800 . 3.360 2.344 2.241 2.605 . 0 0 "[ . 1]" 1
270 1 40 LEU MD2 1 41 ALA H 5.000 . 6.000 3.107 2.944 3.227 . 0 0 "[ . 1]" 1
271 1 40 LEU H 1 41 ALA H 5.000 . 6.000 4.599 4.527 4.618 . 0 0 "[ . 1]" 1
272 1 41 ALA H 1 42 LYS H 5.000 . 6.000 4.527 4.350 4.577 . 0 0 "[ . 1]" 1
273 1 42 LYS H 1 43 GLY H 5.000 . 6.000 4.629 4.614 4.639 . 0 0 "[ . 1]" 1
274 1 40 LEU MD2 1 44 GLU H 5.000 . 6.000 5.844 5.682 5.925 . 0 0 "[ . 1]" 1
275 1 41 ALA H 1 44 GLU QG 5.000 . 6.000 3.696 3.496 3.928 . 0 0 "[ . 1]" 1
276 1 41 ALA H 1 44 GLU H 5.000 . 6.000 5.102 4.623 5.296 . 0 0 "[ . 1]" 1
277 1 42 LYS QG 1 44 GLU H 4.000 . 4.680 4.731 4.699 4.802 0.122 7 0 "[ . 1]" 1
278 1 43 GLY QA 1 44 GLU H 3.400 . 4.080 2.907 2.898 2.917 . 0 0 "[ . 1]" 1
279 1 43 GLY H 1 44 GLU H 3.400 . 4.080 2.616 2.538 2.683 . 0 0 "[ . 1]" 1
280 1 44 GLU H 1 44 GLU QG 3.400 . 4.080 2.785 2.650 2.923 . 0 0 "[ . 1]" 1
281 1 44 GLU HA 1 45 LYS H 2.800 . 3.360 2.467 2.448 2.489 . 0 0 "[ . 1]" 1
282 1 44 GLU QG 1 45 LYS H 3.400 . 4.080 4.121 4.090 4.153 0.073 7 0 "[ . 1]" 1
283 1 44 GLU H 1 45 LYS H 5.000 . 6.000 4.499 4.493 4.509 . 0 0 "[ . 1]" 1
284 1 45 LYS H 1 45 LYS HE2 5.000 . 6.000 3.732 3.535 3.930 . 0 0 "[ . 1]" 1
285 1 45 LYS H 1 45 LYS QG 3.400 . 4.080 3.462 3.328 3.556 . 0 0 "[ . 1]" 1
286 1 45 LYS HA 1 46 ALA H 2.800 . 3.360 2.547 2.508 2.618 . 0 0 "[ . 1]" 1
287 1 45 LYS QB 1 46 ALA H 3.400 . 4.080 2.079 1.986 2.141 . 0 0 "[ . 1]" 1
288 1 45 LYS HE3 1 46 ALA H 5.000 . 6.000 5.422 5.338 5.474 . 0 0 "[ . 1]" 1
289 1 45 LYS H 1 46 ALA H 5.000 . 6.000 4.445 4.434 4.465 . 0 0 "[ . 1]" 1
290 1 46 ALA H 1 46 ALA HA 2.800 . 3.360 2.851 2.833 2.862 . 0 0 "[ . 1]" 1
291 1 24 GLU H 1 47 ASN QB 5.000 . 6.000 6.017 5.979 6.036 0.036 4 0 "[ . 1]" 1
292 1 25 ASP H 1 47 ASN QD 5.000 . 6.000 5.850 5.296 6.009 0.009 4 0 "[ . 1]" 1
293 1 28 TYR H 1 47 ASN QD 3.400 . 4.080 3.444 3.093 4.056 . 0 0 "[ . 1]" 1
294 1 28 TYR QB 1 47 ASN H 5.000 . 6.000 3.398 3.258 3.539 . 0 0 "[ . 1]" 1
295 1 29 GLY H 1 47 ASN QD 5.000 . 6.000 3.423 3.164 4.170 . 0 0 "[ . 1]" 1
296 1 32 LEU H 1 47 ASN QB 5.000 . 6.000 4.765 4.468 5.023 . 0 0 "[ . 1]" 1
297 1 46 ALA HA 1 47 ASN H 2.800 . 3.360 2.137 2.130 2.144 . 0 0 "[ . 1]" 1
298 1 47 ASN H 1 47 ASN QB 3.400 . 4.080 2.389 2.341 2.481 . 0 0 "[ . 1]" 1
299 1 47 ASN H 1 47 ASN QD 5.000 . 6.000 2.221 1.623 4.122 . 0 0 "[ . 1]" 1
300 1 32 LEU H 1 48 VAL HA 5.000 . 6.000 3.887 3.232 4.388 . 0 0 "[ . 1]" 1
301 1 34 ILE H 1 48 VAL MG2 5.000 . 6.000 5.570 5.385 5.824 . 0 0 "[ . 1]" 1
302 1 37 LEU H 1 48 VAL MG2 5.000 . 6.000 6.061 6.027 6.113 0.113 8 0 "[ . 1]" 1
303 1 46 ALA MB 1 48 VAL H 5.000 . 6.000 4.820 4.671 5.007 . 0 0 "[ . 1]" 1
304 1 47 ASN HA 1 48 VAL H 2.800 . 3.360 2.094 2.066 2.112 . 0 0 "[ . 1]" 1
305 1 47 ASN QB 1 48 VAL H 5.000 . 6.000 3.381 3.233 3.470 . 0 0 "[ . 1]" 1
306 1 47 ASN H 1 48 VAL H 5.000 . 6.000 4.415 4.360 4.465 . 0 0 "[ . 1]" 1
307 1 32 LEU H 1 49 LEU H 5.000 . 6.000 5.437 4.631 6.019 0.019 8 0 "[ . 1]" 1
308 1 48 VAL HA 1 49 LEU H 2.800 . 3.360 2.221 2.178 2.275 . 0 0 "[ . 1]" 1
309 1 48 VAL MG2 1 49 LEU H 3.400 . 4.080 3.930 3.746 4.062 . 0 0 "[ . 1]" 1
310 1 48 VAL H 1 49 LEU H 5.000 . 6.000 4.354 4.294 4.404 . 0 0 "[ . 1]" 1
311 1 49 LEU H 1 49 LEU QB 2.800 . 3.360 2.917 2.877 2.969 . 0 0 "[ . 1]" 1
312 1 49 LEU H 1 49 LEU MD2 3.400 . 4.080 2.224 1.802 2.372 . 0 0 "[ . 1]" 1
313 1 49 LEU HA 1 50 ILE H 2.800 . 3.360 2.206 2.152 2.241 . 0 0 "[ . 1]" 1
314 1 49 LEU QB 1 50 ILE H 5.000 . 6.000 2.961 2.753 3.179 . 0 0 "[ . 1]" 1
315 1 49 LEU H 1 50 ILE H 5.000 . 6.000 4.584 4.541 4.608 . 0 0 "[ . 1]" 1
316 1 50 ILE H 1 50 ILE HB 3.400 . 4.080 3.666 3.584 3.742 . 0 0 "[ . 1]" 1
317 1 50 ILE H 1 50 ILE QG 3.400 . 4.080 1.968 1.706 2.281 . 0 0 "[ . 1]" 1
318 1 49 LEU HA 1 51 GLY H 5.000 . 6.000 3.645 3.518 3.748 . 0 0 "[ . 1]" 1
319 1 50 ILE HA 1 51 GLY H 3.400 . 4.080 3.228 3.146 3.352 . 0 0 "[ . 1]" 1
320 1 50 ILE HB 1 51 GLY H 3.400 . 4.080 4.168 4.105 4.214 0.134 2 0 "[ . 1]" 1
321 1 50 ILE QG 1 51 GLY H 5.000 . 6.000 3.065 2.738 3.226 . 0 0 "[ . 1]" 1
322 1 50 ILE H 1 51 GLY H 3.400 . 4.080 2.184 1.931 2.537 . 0 0 "[ . 1]" 1
323 1 51 GLY QA 1 52 GLN H 5.000 . 6.000 2.417 2.123 2.847 . 0 0 "[ . 1]" 1
324 1 51 GLY H 1 52 GLN H 5.000 . 6.000 2.994 1.778 4.265 . 0 0 "[ . 1]" 1
325 1 51 GLY QA 1 53 GLY H 5.000 . 6.000 4.348 3.419 5.380 . 0 0 "[ . 1]" 1
326 1 50 ILE QG 1 54 ASP H 5.000 . 6.000 4.192 3.444 4.950 . 0 0 "[ . 1]" 1
327 1 51 GLY H 1 54 ASP QB 5.000 . 6.000 4.000 3.063 4.641 . 0 0 "[ . 1]" 1
328 1 51 GLY QA 1 54 ASP H 5.000 . 6.000 4.516 3.615 5.205 . 0 0 "[ . 1]" 1
329 1 52 GLN H 1 54 ASP H 5.000 . 6.000 3.803 2.741 5.086 . 0 0 "[ . 1]" 1
330 1 53 GLY H 1 54 ASP QB 5.000 . 6.000 4.409 3.524 5.137 . 0 0 "[ . 1]" 1
331 1 53 GLY QA 1 54 ASP H 2.800 . 3.360 2.821 2.634 2.914 . 0 0 "[ . 1]" 1
332 1 53 GLY H 1 54 ASP H 2.800 . 3.360 2.061 1.530 2.471 . 0 0 "[ . 1]" 1
333 1 54 ASP H 1 54 ASP HA 2.800 . 3.360 2.930 2.874 2.948 . 0 0 "[ . 1]" 1
334 1 54 ASP H 1 54 ASP QB 2.800 . 3.360 2.788 2.475 3.345 . 0 0 "[ . 1]" 1
335 1 54 ASP HA 1 55 VAL H 2.800 . 3.360 2.172 2.124 2.229 . 0 0 "[ . 1]" 1
336 1 54 ASP QB 1 55 VAL H 3.400 . 4.080 3.595 3.328 3.943 . 0 0 "[ . 1]" 1
337 1 54 ASP H 1 55 VAL H 3.600 . 4.280 3.990 3.455 4.326 0.046 7 0 "[ . 1]" 1
338 1 55 VAL H 1 55 VAL HB 2.800 . 3.360 2.539 2.500 2.592 . 0 0 "[ . 1]" 1
339 1 22 GLY H 1 56 VAL HA 5.000 . 6.000 4.388 4.257 4.894 . 0 0 "[ . 1]" 1
340 1 22 GLY H 1 56 VAL HB 5.000 . 6.000 3.246 3.078 3.594 . 0 0 "[ . 1]" 1
341 1 23 LYS H 1 56 VAL HA 5.000 . 6.000 4.320 4.190 4.493 . 0 0 "[ . 1]" 1
342 1 24 GLU H 1 56 VAL HA 5.000 . 6.000 3.743 3.635 3.836 . 0 0 "[ . 1]" 1
343 1 48 VAL H 1 56 VAL H . . 4.080 3.291 3.157 3.399 . 0 0 "[ . 1]" 1
344 1 49 LEU HA 1 56 VAL H 5.000 . 6.000 3.175 2.977 3.268 . 0 0 "[ . 1]" 1
345 1 55 VAL HB 1 56 VAL H 5.000 . 6.000 4.354 4.330 4.390 . 0 0 "[ . 1]" 1
346 1 55 VAL H 1 56 VAL H 3.600 . 4.280 4.270 4.250 4.299 0.019 9 0 "[ . 1]" 1
347 1 22 GLY H 1 57 LEU H 5.000 . 6.000 3.095 2.954 3.630 . 0 0 "[ . 1]" 1
348 1 56 VAL HA 1 57 LEU H 2.800 . 3.360 2.233 2.180 2.301 . 0 0 "[ . 1]" 1
349 1 56 VAL HB 1 57 LEU H 2.800 . 3.360 2.929 2.771 3.128 . 0 0 "[ . 1]" 1
350 1 56 VAL H 1 57 LEU H 5.000 . 6.000 4.368 4.305 4.444 . 0 0 "[ . 1]" 1
351 1 18 PHE H 1 58 VAL HB 5.000 . 6.000 5.982 5.631 6.067 0.067 1 0 "[ . 1]" 1
352 1 45 LYS HA 1 58 VAL H 5.000 . 6.000 3.941 3.871 4.046 . 0 0 "[ . 1]" 1
353 1 46 ALA H 1 58 VAL H 3.400 . 4.080 2.148 2.064 2.233 . 0 0 "[ . 1]" 1
354 1 48 VAL H 1 58 VAL H 5.000 . 6.000 4.292 4.202 4.490 . 0 0 "[ . 1]" 1
355 1 57 LEU H 1 58 VAL H 5.000 . 6.000 4.593 4.584 4.609 . 0 0 "[ . 1]" 1
356 1 18 PHE QB 1 59 MET H 5.000 . 6.000 2.907 2.701 3.039 . 0 0 "[ . 1]" 1
357 1 19 LEU H 1 59 MET QG 5.000 . 6.000 5.050 4.903 5.145 . 0 0 "[ . 1]" 1
358 1 19 LEU H 1 59 MET H 3.400 . 4.080 2.116 1.755 2.378 . 0 0 "[ . 1]" 1
359 1 21 LEU H 1 59 MET H 5.000 . 6.000 4.056 3.855 4.934 . 0 0 "[ . 1]" 1
360 1 45 LYS H 1 59 MET HA 5.000 . 6.000 5.143 5.027 5.192 . 0 0 "[ . 1]" 1
361 1 46 ALA H 1 59 MET HA 5.000 . 6.000 4.689 4.630 4.724 . 0 0 "[ . 1]" 1
362 1 58 VAL HA 1 59 MET H 2.800 . 3.360 2.398 2.357 2.520 . 0 0 "[ . 1]" 1
363 1 58 VAL HB 1 59 MET H 3.400 . 4.080 2.493 2.266 2.634 . 0 0 "[ . 1]" 1
364 1 58 VAL MG1 1 59 MET H 3.400 . 4.080 2.452 2.361 2.491 . 0 0 "[ . 1]" 1
365 1 58 VAL MG2 1 59 MET H 5.000 . 6.000 3.942 3.821 4.016 . 0 0 "[ . 1]" 1
366 1 58 VAL H 1 59 MET H 5.000 . 6.000 4.461 4.450 4.477 . 0 0 "[ . 1]" 1
367 1 45 LYS HA 1 60 LYS H 5.000 . 6.000 3.689 3.414 3.833 . 0 0 "[ . 1]" 1
368 1 59 MET HA 1 60 LYS H 3.400 . 4.080 2.139 2.116 2.174 . 0 0 "[ . 1]" 1
369 1 59 MET QG 1 60 LYS H 5.000 . 6.000 3.555 3.307 3.740 . 0 0 "[ . 1]" 1
370 1 59 MET H 1 60 LYS H 5.000 . 6.000 4.208 3.991 4.359 . 0 0 "[ . 1]" 1
371 1 60 LYS H 1 60 LYS QB 3.400 . 4.080 2.857 2.811 2.929 . 0 0 "[ . 1]" 1
372 1 19 LEU H 1 61 ARG H 5.000 . 6.000 5.559 4.221 6.036 0.036 5 0 "[ . 1]" 1
373 1 60 LYS HA 1 61 ARG H 2.800 . 3.360 2.561 2.209 2.756 . 0 0 "[ . 1]" 1
374 1 60 LYS QB 1 61 ARG H 5.000 . 6.000 2.725 2.203 3.939 . 0 0 "[ . 1]" 1
375 1 60 LYS H 1 61 ARG H 5.000 . 6.000 4.329 3.260 4.587 . 0 0 "[ . 1]" 1
376 1 61 ARG H 1 61 ARG QD 5.000 . 6.000 4.033 3.673 4.634 . 0 0 "[ . 1]" 1
377 1 61 ARG H 1 61 ARG QG 3.400 . 4.080 2.412 1.940 3.158 . 0 0 "[ . 1]" 1
378 1 61 ARG HA 1 62 LYS H 3.400 . 4.080 2.533 2.105 3.550 . 0 0 "[ . 1]" 1
379 1 61 ARG QB 1 62 LYS H 5.000 . 6.000 2.688 1.509 3.512 . 0 0 "[ . 1]" 1
380 1 61 ARG H 1 62 LYS H 5.000 . 6.000 4.220 2.625 4.628 . 0 0 "[ . 1]" 1
381 1 61 ARG H 1 63 ARG H 5.000 . 6.000 5.242 4.751 5.865 . 0 0 "[ . 1]" 1
382 1 66 SER H 1 67 ILE H 5.000 . 6.000 2.762 1.764 4.623 . 0 0 "[ . 1]" 1
383 1 67 ILE H 1 67 ILE HB 3.200 . 3.760 3.754 3.356 3.889 0.129 3 0 "[ . 1]" 1
384 1 67 ILE H 1 67 ILE QG 3.400 . 4.080 2.497 2.099 4.176 0.096 9 0 "[ . 1]" 1
385 1 67 ILE HA 1 68 LEU H 3.100 . 3.660 3.338 3.273 3.447 . 0 0 "[ . 1]" 1
386 1 67 ILE HB 1 68 LEU H 3.700 . 4.380 4.148 3.948 4.356 . 0 0 "[ . 1]" 1
387 1 67 ILE QG 1 68 LEU H 5.000 . 6.000 2.784 2.251 4.286 . 0 0 "[ . 1]" 1
388 1 67 ILE H 1 68 LEU H . . 4.280 1.841 1.497 2.525 . 0 0 "[ . 1]" 1
389 1 68 LEU H 1 68 LEU HA 2.800 . 3.360 2.251 2.238 2.264 . 0 0 "[ . 1]" 1
390 1 68 LEU HA 1 69 THR H 2.800 . 3.360 2.891 2.189 3.504 0.144 3 0 "[ . 1]" 1
391 1 68 LEU MD2 1 69 THR H 5.000 . 6.000 3.920 2.736 4.529 . 0 0 "[ . 1]" 1
392 1 68 LEU H 1 69 THR H 5.000 . 6.000 3.171 2.709 4.056 . 0 0 "[ . 1]" 1
393 1 74 ALA HA 1 75 THR H 3.400 . 4.080 2.556 2.217 3.524 . 0 0 "[ . 1]" 1
394 1 74 ALA MB 1 75 THR H 5.000 . 6.000 3.429 1.782 3.716 . 0 0 "[ . 1]" 1
395 1 77 ARG HA 1 78 ILE H 2.800 . 3.360 2.343 2.171 2.722 . 0 0 "[ . 1]" 1
396 1 78 ILE H 1 78 ILE HB 3.800 . 4.080 3.610 3.590 3.657 . 0 0 "[ . 1]" 1
397 1 78 ILE H 1 78 ILE QG 3.400 . 4.080 2.479 1.843 3.392 . 0 0 "[ . 1]" 1
398 1 78 ILE HA 1 79 ARG H 2.800 . 3.360 2.321 2.218 2.502 . 0 0 "[ . 1]" 1
399 1 78 ILE MG 1 79 ARG H 5.000 . 6.000 3.690 3.435 3.926 . 0 0 "[ . 1]" 1
400 1 78 ILE H 1 79 ARG H 5.000 . 6.000 4.614 4.572 4.628 . 0 0 "[ . 1]" 1
401 1 79 ARG HA 1 80 MET H 5.000 . 6.000 3.215 2.906 3.360 . 0 0 "[ . 1]" 1
402 1 80 MET HA 1 81 ALA H 2.800 . 3.360 2.291 2.147 2.587 . 0 0 "[ . 1]" 1
403 1 81 ALA MB 1 82 ILE H 5.000 . 6.000 2.578 1.863 3.235 . 0 0 "[ . 1]" 1
404 1 81 ALA H 1 82 ILE H 5.000 . 6.000 4.501 4.376 4.624 . 0 0 "[ . 1]" 1
405 1 82 ILE H 1 82 ILE HB 3.400 . 4.080 3.028 2.436 3.644 . 0 0 "[ . 1]" 1
406 1 81 ALA MB 1 83 ASN H 5.000 . 6.000 4.397 2.485 5.579 . 0 0 "[ . 1]" 1
407 1 82 ILE HA 1 83 ASN H 5.000 . 6.000 2.806 2.145 3.558 . 0 0 "[ . 1]" 1
408 1 82 ILE HB 1 83 ASN H 5.000 . 6.000 3.000 1.963 4.196 . 0 0 "[ . 1]" 1
409 1 82 ILE MG 1 83 ASN H 5.000 . 6.000 3.365 2.483 4.117 . 0 0 "[ . 1]" 1
410 1 22 GLY HA2 1 23 LYS QG 5.000 . 6.000 3.819 3.664 3.924 . 0 0 "[ . 1]" 1
411 1 29 GLY HA2 1 30 PRO QD 3.400 . 4.080 2.629 2.608 2.649 . 0 0 "[ . 1]" 1
412 1 9 GLY QA 1 10 VAL H 3.400 . 4.080 2.363 2.163 2.816 . 0 0 "[ . 1]" 1
413 1 9 GLY QA 1 10 VAL QG 5.000 . 6.000 3.610 3.231 3.989 . 0 0 "[ . 1]" 1
414 1 29 GLY HA3 1 30 PRO QD 3.400 . 4.080 3.528 3.523 3.537 . 0 0 "[ . 1]" 1
415 1 29 GLY HA3 1 30 PRO QG 5.000 . 6.000 5.273 5.243 5.303 . 0 0 "[ . 1]" 1
416 1 22 GLY HA3 1 23 LYS QG 5.000 . 6.000 3.975 3.866 4.079 . 0 0 "[ . 1]" 1
417 1 32 LEU HB2 1 36 GLU QG 5.000 . 6.000 2.402 2.245 2.573 . 0 0 "[ . 1]" 1
418 1 32 LEU HB3 1 36 GLU QG 3.400 . 4.080 3.680 3.445 3.889 . 0 0 "[ . 1]" 1
419 1 25 ASP HB2 1 28 TYR QD 5.000 . 6.000 4.513 4.385 4.701 . 0 0 "[ . 1]" 1
420 1 25 ASP HB2 1 28 TYR QE 5.000 . 6.000 4.134 3.942 4.271 . 0 0 "[ . 1]" 1
421 1 18 PHE HE1 1 40 LEU QB 5.000 . 6.000 6.028 5.916 6.336 0.336 6 0 "[ . 1]" 1
422 1 40 LEU QB 1 60 LYS QE . . 4.080 2.669 1.665 3.196 . 0 0 "[ . 1]" 1
423 1 49 LEU HB2 1 49 LEU QD 2.800 . 3.360 2.210 2.146 2.431 . 0 0 "[ . 1]" 1
424 1 49 LEU HB3 1 49 LEU QD 2.800 . 3.360 2.117 2.096 2.242 . 0 0 "[ . 1]" 1
425 1 21 LEU HB3 1 21 LEU QD 2.800 . 3.360 2.221 2.089 2.261 . 0 0 "[ . 1]" 1
426 1 16 ARG HA 1 16 ARG QD 3.400 . 4.080 3.609 1.790 4.171 0.091 8 0 "[ . 1]" 1
427 1 27 ARG QB 1 27 ARG HD3 2.800 . 3.360 2.754 2.366 3.413 0.053 7 0 "[ . 1]" 1
428 1 77 ARG HA 1 77 ARG QD 3.400 . 4.080 3.925 3.855 4.047 . 0 0 "[ . 1]" 1
429 1 60 LYS HA 1 60 LYS QE 5.000 . 6.000 3.967 3.545 4.291 . 0 0 "[ . 1]" 1
430 1 60 LYS QE 1 60 LYS HG2 3.400 . 4.080 2.574 2.227 3.467 . 0 0 "[ . 1]" 1
431 1 42 LYS QE 1 42 LYS HG2 2.800 . 3.360 2.570 2.362 2.942 . 0 0 "[ . 1]" 1
432 1 23 LYS H 1 23 LYS QE 5.000 . 6.000 4.226 3.641 4.794 . 0 0 "[ . 1]" 1
433 1 23 LYS HA 1 23 LYS QE 5.000 . 6.000 4.798 4.135 5.684 . 0 0 "[ . 1]" 1
434 1 62 LYS H 1 62 LYS QE 5.000 . 6.000 4.605 2.667 6.032 0.032 9 0 "[ . 1]" 1
435 1 62 LYS HA 1 62 LYS QE 5.000 . 6.000 4.256 1.747 5.671 . 0 0 "[ . 1]" 1
436 1 58 VAL MG1 1 59 MET QB 3.400 . 4.080 4.182 4.158 4.199 0.119 2 0 "[ . 1]" 1
437 1 35 ASN HB2 1 36 GLU QG 5.000 . 6.000 4.875 4.684 6.124 0.124 8 0 "[ . 1]" 1
438 1 35 ASN HB3 1 36 GLU QG 5.000 . 6.000 3.437 3.194 4.981 . 0 0 "[ . 1]" 1
439 1 32 LEU HA 1 36 GLU QG 5.000 . 6.000 4.279 4.143 4.490 . 0 0 "[ . 1]" 1
440 1 36 GLU HA 1 36 GLU QG 3.400 . 4.080 3.229 3.206 3.272 . 0 0 "[ . 1]" 1
441 1 32 LEU QD 1 36 GLU QG 5.000 . 6.000 2.788 2.127 2.974 . 0 0 "[ . 1]" 1
442 1 28 TYR HB3 1 57 LEU QD 5.000 . 6.000 4.625 4.386 4.812 . 0 0 "[ . 1]" 1
443 1 28 TYR HB2 1 57 LEU QD 5.000 . 6.000 3.754 3.493 3.912 . 0 0 "[ . 1]" 1
444 1 52 GLN HA 1 52 GLN QG 3.400 . 4.080 2.750 2.417 3.340 . 0 0 "[ . 1]" 1
445 1 30 PRO HB3 1 30 PRO QD 3.400 . 4.080 3.252 3.203 3.295 . 0 0 "[ . 1]" 1
446 1 40 LEU QB 1 60 LYS HB3 5.000 . 6.000 4.311 3.994 4.591 . 0 0 "[ . 1]" 1
447 1 40 LEU QB 1 60 LYS HB2 5.000 . 6.000 4.981 4.568 5.218 . 0 0 "[ . 1]" 1
448 1 24 GLU HB3 1 26 ARG QD 3.400 . 4.080 4.136 4.116 4.169 0.089 5 0 "[ . 1]" 1
449 1 77 ARG HB2 1 77 ARG QD 3.400 . 4.080 2.734 2.484 3.069 . 0 0 "[ . 1]" 1
450 1 77 ARG HB3 1 77 ARG QD 3.400 . 4.080 2.386 2.236 2.698 . 0 0 "[ . 1]" 1
451 1 24 GLU HB2 1 26 ARG QD 5.000 . 6.000 3.697 3.649 3.739 . 0 0 "[ . 1]" 1
452 1 36 GLU H 1 36 GLU QB 3.400 . 4.080 2.755 2.456 2.810 . 0 0 "[ . 1]" 1
453 1 36 GLU QB 1 37 LEU H 5.000 . 6.000 3.002 2.855 3.652 . 0 0 "[ . 1]" 1
454 1 32 LEU HA 1 36 GLU QB 5.000 . 6.000 5.178 4.856 5.718 . 0 0 "[ . 1]" 1
455 1 32 LEU HB3 1 36 GLU QB 5.000 . 6.000 4.057 3.818 4.962 . 0 0 "[ . 1]" 1
456 1 32 LEU HB2 1 36 GLU QB 5.000 . 6.000 2.891 2.548 3.933 . 0 0 "[ . 1]" 1
457 1 32 LEU QD 1 36 GLU QB 5.000 . 6.000 2.029 1.717 3.762 . 0 0 "[ . 1]" 1
458 1 11 GLU H 1 11 GLU QB 3.400 . 4.080 2.538 2.345 2.813 . 0 0 "[ . 1]" 1
459 1 42 LYS H 1 42 LYS QD 5.000 . 6.000 2.979 2.571 4.221 . 0 0 "[ . 1]" 1
460 1 26 ARG HB3 1 26 ARG QD 3.400 . 4.080 3.429 2.511 3.545 . 0 0 "[ . 1]" 1
461 1 45 LYS QB 1 45 LYS HD3 3.400 . 4.080 3.273 3.268 3.280 . 0 0 "[ . 1]" 1
462 1 34 ILE HG13 1 37 LEU QD 5.000 . 6.000 2.132 1.999 2.302 . 0 0 "[ . 1]" 1
463 1 23 LYS H 1 23 LYS QD 5.000 . 6.000 3.869 3.755 3.951 . 0 0 "[ . 1]" 1
464 1 23 LYS QD 1 24 GLU H 5.000 . 6.000 5.909 5.817 6.033 0.033 4 0 "[ . 1]" 1
465 1 23 LYS HB3 1 23 LYS QD 3.400 . 4.080 2.572 2.343 2.875 . 0 0 "[ . 1]" 1
466 1 23 LYS QD 1 56 VAL MG1 5.000 . 6.000 3.442 3.064 3.828 . 0 0 "[ . 1]" 1
467 1 34 ILE HG12 1 37 LEU QD 5.000 . 6.000 3.584 3.477 3.754 . 0 0 "[ . 1]" 1
468 1 18 PHE QE 1 60 LYS HD2 5.000 . 6.000 2.355 1.749 2.720 . 0 0 "[ . 1]" 1
469 1 30 PRO QD 1 32 LEU MD1 5.000 . 6.000 5.493 4.874 5.946 . 0 0 "[ . 1]" 1
470 1 32 LEU MD1 1 36 GLU QG 3.400 . 4.080 3.350 2.958 3.519 . 0 0 "[ . 1]" 1
471 1 18 PHE QE 1 40 LEU MD1 3.400 . 4.080 2.092 1.978 2.213 . 0 0 "[ . 1]" 1
472 1 40 LEU QB 1 40 LEU MD1 2.800 . 3.360 2.073 2.050 2.087 . 0 0 "[ . 1]" 1
473 1 37 LEU QD 1 40 LEU MD1 2.800 . 3.360 1.766 1.701 1.807 . 0 0 "[ . 1]" 1
474 1 37 LEU MD1 1 48 VAL QG 2.800 . 3.360 1.731 1.681 1.797 . 0 0 "[ . 1]" 1
475 1 23 LYS QG 1 24 GLU H 5.000 . 6.000 4.279 4.240 4.328 . 0 0 "[ . 1]" 1
476 1 23 LYS HA 1 23 LYS QG 3.400 . 4.080 3.320 3.294 3.336 . 0 0 "[ . 1]" 1
477 1 21 LEU QD 1 23 LYS QG 5.000 . 6.000 5.569 5.414 6.008 0.008 4 0 "[ . 1]" 1
478 1 57 LEU QD 1 58 VAL H 3.400 . 4.080 3.939 3.903 4.057 . 0 0 "[ . 1]" 1
479 1 47 ASN HA 1 57 LEU QD 5.000 . 6.000 3.308 2.742 3.433 . 0 0 "[ . 1]" 1
480 1 25 ASP HB2 1 57 LEU QD 5.000 . 6.000 2.715 2.566 2.954 . 0 0 "[ . 1]" 1
481 1 40 LEU MD1 1 40 LEU MD2 2.800 . 3.360 2.081 2.076 2.087 . 0 0 "[ . 1]" 1
482 1 37 LEU QD 1 40 LEU MD2 3.400 . 4.080 3.269 3.121 3.362 . 0 0 "[ . 1]" 1
483 1 15 LEU MD2 1 18 PHE HD1 5.000 . 6.000 3.081 2.576 3.657 . 0 0 "[ . 1]" 1
484 1 15 LEU MD2 1 37 LEU QD 3.400 . 4.080 1.975 1.830 2.112 . 0 0 "[ . 1]" 1
485 1 68 LEU MD1 1 68 LEU MD2 2.800 . 3.360 2.074 2.044 2.089 . 0 0 "[ . 1]" 1
486 1 36 GLU QB 1 37 LEU MD2 5.000 . 6.000 5.497 5.294 6.083 0.083 8 0 "[ . 1]" 1
487 1 37 LEU MD2 1 48 VAL QG 2.800 . 3.360 1.784 1.672 1.965 . 0 0 "[ . 1]" 1
488 1 37 LEU MD1 1 37 LEU MD2 2.800 . 3.360 2.055 2.034 2.063 . 0 0 "[ . 1]" 1
489 1 48 VAL MG1 1 48 VAL MG2 2.800 . 3.360 2.086 2.076 2.092 . 0 0 "[ . 1]" 1
490 1 32 LEU MD1 1 32 LEU MD2 2.800 . 3.360 2.084 2.080 2.088 . 0 0 "[ . 1]" 1
491 1 75 THR MG 1 76 LYS QG 5.000 . 6.000 4.569 3.770 5.734 . 0 0 "[ . 1]" 1
492 1 14 VAL MG2 1 18 PHE QE 5.200 . 6.200 6.309 6.267 6.368 0.168 7 0 "[ . 1]" 1
493 1 14 VAL MG2 1 18 PHE QD 5.000 . 6.000 5.510 5.413 5.743 . 0 0 "[ . 1]" 1
494 1 14 VAL MG1 1 14 VAL MG2 2.800 . 3.360 2.087 2.083 2.093 . 0 0 "[ . 1]" 1
495 1 40 LEU QB 1 41 ALA MB 3.400 . 4.080 4.097 3.865 4.154 0.074 5 0 "[ . 1]" 1
496 1 30 PRO QG 1 31 ALA MB 5.000 . 6.000 4.140 4.052 4.217 . 0 0 "[ . 1]" 1
497 1 58 VAL MG1 1 58 VAL MG2 2.800 . 3.360 2.094 2.089 2.097 . 0 0 "[ . 1]" 1
498 1 37 LEU QD 1 58 VAL MG2 3.400 . 4.080 1.856 1.651 2.036 . 0 0 "[ . 1]" 1
499 1 10 VAL QG 1 13 ALA MB 3.400 . 4.080 3.098 2.722 3.541 . 0 0 "[ . 1]" 1
500 1 56 VAL MG1 1 56 VAL MG2 2.800 . 3.360 2.082 2.075 2.087 . 0 0 "[ . 1]" 1
501 1 34 ILE MG 1 37 LEU QD 3.400 . 4.080 2.951 2.789 3.061 . 0 0 "[ . 1]" 1
502 1 34 ILE MD 1 37 LEU QD 3.400 . 4.080 2.460 2.295 2.608 . 0 0 "[ . 1]" 1
503 1 67 ILE MD 1 70 ASP QB 5.000 . 6.000 5.164 3.529 6.046 0.046 2 0 "[ . 1]" 1
504 1 32 LEU QD 1 33 SER HB3 5.000 . 6.000 4.313 4.205 4.567 . 0 0 "[ . 1]" 1
505 1 14 VAL HA 1 14 VAL QG 2.800 . 3.360 2.259 2.244 2.274 . 0 0 "[ . 1]" 1
506 1 34 ILE HA 1 48 VAL QG 3.400 . 4.080 3.315 3.050 3.519 . 0 0 "[ . 1]" 1
507 1 38 SER H 1 38 SER QB 3.400 . 4.080 2.368 2.243 2.566 . 0 0 "[ . 1]" 1
508 1 10 VAL HA 1 10 VAL QG 2.800 . 3.360 2.127 2.102 2.139 . 0 0 "[ . 1]" 1
509 1 75 THR HA 1 76 LYS QG 5.000 . 6.000 5.308 5.004 6.194 0.194 8 0 "[ . 1]" 1
510 1 30 PRO HA 1 30 PRO QG 3.400 . 4.080 3.533 3.531 3.535 . 0 0 "[ . 1]" 1
511 1 28 TYR HA 1 57 LEU QD 5.000 . 6.000 5.692 5.520 5.813 . 0 0 "[ . 1]" 1
512 1 10 VAL MG1 1 11 GLU HA 5.000 . 6.000 3.632 2.994 3.937 . 0 0 "[ . 1]" 1
513 1 11 GLU HA 1 11 GLU QG 3.400 . 4.080 2.825 2.414 3.334 . 0 0 "[ . 1]" 1
514 1 24 GLU HA 1 24 GLU QG 3.400 . 4.080 3.332 3.321 3.336 . 0 0 "[ . 1]" 1
515 1 79 ARG HA 1 79 ARG HB3 2.800 . 3.360 2.303 2.277 2.323 . 0 0 "[ . 1]" 1
516 1 79 ARG HA 1 79 ARG QG 3.400 . 4.080 3.383 3.354 3.405 . 0 0 "[ . 1]" 1
517 1 72 GLN HA 1 72 GLN QG 3.400 . 4.080 3.362 3.338 3.475 . 0 0 "[ . 1]" 1
518 1 40 LEU HA 1 40 LEU QD 3.400 . 4.080 2.076 1.958 2.193 . 0 0 "[ . 1]" 1
519 1 21 LEU HA 1 21 LEU QD 2.800 . 3.360 1.999 1.841 3.231 . 0 0 "[ . 1]" 1
520 1 68 LEU HA 1 68 LEU QD 2.800 . 3.360 1.948 1.861 2.064 . 0 0 "[ . 1]" 1
521 1 49 LEU HA 1 49 LEU QD 3.400 . 4.080 2.758 2.618 2.991 . 0 0 "[ . 1]" 1
522 1 13 ALA HA 1 16 ARG QD 5.000 . 6.000 5.896 5.673 6.022 0.022 9 0 "[ . 1]" 1
523 1 32 LEU HA 1 32 LEU QD 2.800 . 3.360 3.281 3.266 3.309 . 0 0 "[ . 1]" 1
524 1 19 LEU HA 1 19 LEU QD 3.400 . 4.080 1.948 1.836 2.059 . 0 0 "[ . 1]" 1
525 1 40 LEU QB 1 41 ALA HA 5.000 . 6.000 4.245 4.010 4.349 . 0 0 "[ . 1]" 1
526 1 57 LEU QB 1 58 VAL MG1 4.300 . 4.980 5.055 5.004 5.093 0.113 6 0 "[ . 1]" 1
527 1 23 LYS QG 1 24 GLU HG2 3.800 . 4.560 4.556 4.447 4.609 0.049 4 0 "[ . 1]" 1
528 1 25 ASP HB3 1 28 TYR QD 5.000 . 6.000 3.033 2.924 3.231 . 0 0 "[ . 1]" 1
529 1 26 ARG QB 1 26 ARG QD 2.800 . 3.360 2.664 2.456 2.723 . 0 0 "[ . 1]" 1
530 1 30 PRO HB2 1 30 PRO QD 3.400 . 4.080 3.489 3.461 3.515 . 0 0 "[ . 1]" 1
531 1 34 ILE HA 1 37 LEU QD 3.400 . 4.080 2.057 1.866 2.253 . 0 0 "[ . 1]" 1
532 1 34 ILE HB 1 37 LEU QD 5.000 . 6.000 4.107 4.023 4.211 . 0 0 "[ . 1]" 1
533 1 38 SER QB 1 39 ASN H 5.000 . 6.000 3.356 2.978 3.735 . 0 0 "[ . 1]" 1
534 1 38 SER QB 1 40 LEU QB 5.000 . 6.000 5.747 5.566 5.870 . 0 0 "[ . 1]" 1
535 1 51 GLY HA3 1 52 GLN QG 5.000 . 6.000 5.038 3.465 6.055 0.055 7 0 "[ . 1]" 1
536 1 55 VAL MG1 1 57 LEU QD 3.400 . 4.080 4.031 3.710 4.109 0.029 7 0 "[ . 1]" 1
537 1 55 VAL MG1 1 55 VAL MG2 2.800 . 3.360 2.090 2.082 2.094 . 0 0 "[ . 1]" 1
538 1 57 LEU QB 1 58 VAL MG2 4.000 . 4.560 3.843 3.807 3.875 . 0 0 "[ . 1]" 1
539 1 18 PHE QE 1 60 LYS HB3 5.000 . 6.000 4.117 2.876 4.312 . 0 0 "[ . 1]" 1
540 1 18 PHE QE 1 60 LYS HG2 5.000 . 6.000 4.421 3.838 4.616 . 0 0 "[ . 1]" 1
541 1 40 LEU QB 1 60 LYS HG2 3.400 . 4.080 4.044 3.941 4.110 0.030 5 0 "[ . 1]" 1
542 1 62 LYS HB2 1 62 LYS QD 2.800 . 3.360 2.555 2.190 3.453 0.093 10 0 "[ . 1]" 1
543 1 62 LYS QE 1 63 ARG H 5.000 . 6.000 5.236 4.085 6.072 0.072 9 0 "[ . 1]" 1
544 1 63 ARG HA 1 63 ARG QG 3.400 . 4.080 2.532 2.326 3.020 . 0 0 "[ . 1]" 1
545 1 65 SER QB 1 66 SER H 5.000 . 6.000 3.141 1.751 3.871 . 0 0 "[ . 1]" 1
546 1 65 SER QB 1 67 ILE H 5.000 . 6.000 4.249 2.890 5.702 . 0 0 "[ . 1]" 1
547 1 65 SER QB 1 68 LEU MD1 6.000 . 7.200 4.593 3.013 6.941 . 0 0 "[ . 1]" 1
548 1 66 SER QB 1 68 LEU QB 5.500 . 6.500 5.910 4.437 6.420 . 0 0 "[ . 1]" 1
549 1 77 ARG HA 1 77 ARG QG 3.400 . 4.080 2.205 2.141 2.312 . 0 0 "[ . 1]" 1
550 1 29 GLY HA2 1 30 PRO QG 5.000 . 6.000 4.520 4.500 4.542 . 0 0 "[ . 1]" 1
551 1 59 MET QB 1 59 MET ME 2.800 . 3.360 2.450 2.317 2.910 . 0 0 "[ . 1]" 1
552 1 77 ARG QB 1 77 ARG HD3 2.800 . 3.360 2.714 2.258 3.298 . 0 0 "[ . 1]" 1
553 1 10 VAL HA 1 10 VAL MG1 3.400 . 4.080 2.368 2.280 2.518 . 0 0 "[ . 1]" 1
554 1 10 VAL HA 1 10 VAL MG2 3.400 . 4.080 2.419 2.289 2.499 . 0 0 "[ . 1]" 1
555 1 10 VAL H 1 10 VAL MG1 3.400 . 4.080 3.828 3.750 4.094 0.014 10 0 "[ . 1]" 1
556 1 10 VAL H 1 10 VAL MG2 3.400 . 4.080 2.103 1.795 2.760 . 0 0 "[ . 1]" 1
557 1 10 VAL HB 1 11 GLU HG3 5.000 . 6.000 4.734 3.951 5.741 . 0 0 "[ . 1]" 1
558 1 10 VAL MG2 1 11 GLU HG3 5.000 . 6.000 5.734 4.717 6.063 0.063 10 0 "[ . 1]" 1
559 1 10 VAL HB 1 11 GLU H 5.000 . 6.000 2.780 1.867 3.200 . 0 0 "[ . 1]" 1
560 1 10 VAL MG1 1 11 GLU H 5.000 . 6.000 3.582 2.326 3.906 . 0 0 "[ . 1]" 1
561 1 10 VAL MG2 1 11 GLU H 5.000 . 6.000 3.786 3.563 4.148 . 0 0 "[ . 1]" 1
562 1 11 GLU HA 1 11 GLU HG2 3.400 . 4.080 3.591 2.935 3.727 . 0 0 "[ . 1]" 1
563 1 11 GLU H 1 11 GLU HG2 5.000 . 6.000 2.924 1.837 3.902 . 0 0 "[ . 1]" 1
564 1 11 GLU HG3 1 12 SER H 5.000 . 6.000 3.957 1.956 5.071 . 0 0 "[ . 1]" 1
565 1 10 VAL HA 1 13 ALA MB 5.000 . 6.000 2.598 2.208 3.535 . 0 0 "[ . 1]" 1
566 1 10 VAL MG1 1 13 ALA MB 5.000 . 6.000 3.251 2.761 4.016 . 0 0 "[ . 1]" 1
567 1 12 SER HB3 1 13 ALA HA 5.000 . 6.000 5.463 4.663 5.683 . 0 0 "[ . 1]" 1
568 1 13 ALA MB 1 14 VAL HA 5.000 . 6.000 3.778 3.760 3.810 . 0 0 "[ . 1]" 1
569 1 13 ALA MB 1 14 VAL HB 5.000 . 6.000 5.162 5.067 5.238 . 0 0 "[ . 1]" 1
570 1 14 VAL HA 1 14 VAL MG1 3.400 . 4.080 2.309 2.292 2.326 . 0 0 "[ . 1]" 1
571 1 15 LEU HA 1 15 LEU MD2 3.400 . 4.080 2.952 2.097 3.798 . 0 0 "[ . 1]" 1
572 1 13 ALA HA 1 16 ARG H 5.000 . 6.000 3.813 3.239 5.219 . 0 0 "[ . 1]" 1
573 1 16 ARG HA 1 16 ARG HG3 . . 3.360 2.908 2.525 3.258 . 0 0 "[ . 1]" 1
574 1 16 ARG HA 1 16 ARG HG2 . . 3.360 2.834 2.448 3.554 0.194 3 0 "[ . 1]" 1
575 1 16 ARG H 1 16 ARG HG3 5.000 . 6.000 3.632 2.847 4.839 . 0 0 "[ . 1]" 1
576 1 16 ARG H 1 16 ARG HG2 5.000 . 6.000 4.136 3.324 5.294 . 0 0 "[ . 1]" 1
577 1 18 PHE HB3 1 19 LEU H 5.000 . 6.000 2.153 2.109 2.356 . 0 0 "[ . 1]" 1
578 1 18 PHE HB2 1 19 LEU H 5.000 . 6.000 3.456 3.377 3.635 . 0 0 "[ . 1]" 1
579 1 19 LEU HB3 1 19 LEU MD1 3.400 . 4.080 2.349 2.294 2.413 . 0 0 "[ . 1]" 1
580 1 19 LEU H 1 19 LEU HB2 . . 3.360 2.425 2.265 2.541 . 0 0 "[ . 1]" 1
581 1 19 LEU H 1 19 LEU MD1 5.000 . 6.000 4.247 4.011 4.481 . 0 0 "[ . 1]" 1
582 1 19 LEU H 1 19 LEU MD2 5.000 . 6.000 4.200 4.095 4.330 . 0 0 "[ . 1]" 1
583 1 19 LEU H 1 19 LEU HG 5.000 . 6.000 3.745 3.333 4.306 . 0 0 "[ . 1]" 1
584 1 19 LEU MD1 1 20 ILE HA 5.000 . 6.000 6.073 5.954 6.139 0.139 2 0 "[ . 1]" 1
585 1 19 LEU HA 1 20 ILE HB 5.000 . 6.000 4.774 4.422 4.919 . 0 0 "[ . 1]" 1
586 1 19 LEU HA 1 20 ILE MD 5.000 . 6.000 4.640 3.830 5.445 . 0 0 "[ . 1]" 1
587 1 19 LEU HA 1 20 ILE HG13 5.000 . 6.000 4.842 3.930 5.570 . 0 0 "[ . 1]" 1
588 1 19 LEU HB3 1 20 ILE H 5.000 . 6.000 2.730 2.312 3.387 . 0 0 "[ . 1]" 1
589 1 19 LEU HB2 1 20 ILE H 5.000 . 6.000 4.001 3.658 4.324 . 0 0 "[ . 1]" 1
590 1 19 LEU MD1 1 20 ILE H 5.000 . 6.000 4.248 4.082 4.562 . 0 0 "[ . 1]" 1
591 1 19 LEU MD2 1 20 ILE H 5.000 . 6.000 2.513 1.896 3.048 . 0 0 "[ . 1]" 1
592 1 19 LEU HG 1 20 ILE H 5.000 . 6.000 4.425 4.040 4.813 . 0 0 "[ . 1]" 1
593 1 20 ILE HA 1 20 ILE MG 3.400 . 4.080 2.451 2.361 2.601 . 0 0 "[ . 1]" 1
594 1 20 ILE H 1 20 ILE MD 5.000 . 6.000 3.663 3.235 4.061 . 0 0 "[ . 1]" 1
595 1 20 ILE H 1 20 ILE HG13 5.000 . 6.000 3.360 2.479 4.151 . 0 0 "[ . 1]" 1
596 1 20 ILE H 1 20 ILE HG12 5.000 . 6.000 2.907 2.302 3.701 . 0 0 "[ . 1]" 1
597 1 20 ILE HA 1 21 LEU MD2 5.000 . 6.000 5.167 3.182 5.419 . 0 0 "[ . 1]" 1
598 1 20 ILE HA 1 21 LEU H 3.400 . 4.080 2.162 2.138 2.178 . 0 0 "[ . 1]" 1
599 1 20 ILE MG 1 21 LEU H . . 4.080 3.185 3.027 3.224 . 0 0 "[ . 1]" 1
600 1 21 LEU HB2 1 21 LEU MD1 3.400 . 4.080 3.082 2.171 3.189 . 0 0 "[ . 1]" 1
601 1 21 LEU HB2 1 21 LEU MD2 3.400 . 4.080 2.507 2.406 3.116 . 0 0 "[ . 1]" 1
602 1 21 LEU H 1 21 LEU MD1 5.000 . 6.000 4.199 3.734 4.274 . 0 0 "[ . 1]" 1
603 1 21 LEU H 1 21 LEU HG 5.000 . 6.000 4.386 2.101 4.676 . 0 0 "[ . 1]" 1
604 1 20 ILE MD 1 22 GLY HA2 5.000 . 6.000 6.005 5.500 6.093 0.093 3 0 "[ . 1]" 1
605 1 20 ILE MG 1 22 GLY HA2 5.000 . 6.000 3.884 3.618 4.111 . 0 0 "[ . 1]" 1
606 1 20 ILE MG 1 22 GLY H 5.000 . 6.000 4.519 4.297 4.664 . 0 0 "[ . 1]" 1
607 1 20 ILE MG 1 23 LYS H 6.000 . 7.200 6.004 5.693 6.202 . 0 0 "[ . 1]" 1
608 1 22 GLY HA3 1 23 LYS HB3 5.000 . 6.000 5.264 5.193 5.356 . 0 0 "[ . 1]" 1
609 1 22 GLY HA2 1 23 LYS HB3 5.000 . 6.000 4.665 4.582 4.777 . 0 0 "[ . 1]" 1
610 1 22 GLY HA3 1 23 LYS HB2 5.000 . 6.000 5.949 5.903 6.000 . 3 0 "[ . 1]" 1
611 1 22 GLY HA2 1 23 LYS HB2 5.000 . 6.000 5.822 5.792 5.842 . 0 0 "[ . 1]" 1
612 1 22 GLY HA3 1 23 LYS H 2.800 . 3.360 2.457 2.421 2.514 . 0 0 "[ . 1]" 1
613 1 22 GLY HA2 1 23 LYS H . . 3.360 2.625 2.589 2.679 . 0 0 "[ . 1]" 1
614 1 23 LYS HA 1 24 GLU HG2 5.000 . 6.000 4.476 4.364 4.541 . 0 0 "[ . 1]" 1
615 1 23 LYS HB2 1 24 GLU H 5.000 . 6.000 4.241 4.177 4.275 . 0 0 "[ . 1]" 1
616 1 24 GLU H 1 24 GLU HG3 5.000 . 6.000 3.099 3.020 3.187 . 0 0 "[ . 1]" 1
617 1 24 GLU H 1 24 GLU HG2 5.000 . 6.000 2.659 2.590 2.695 . 0 0 "[ . 1]" 1
618 1 24 GLU HB3 1 25 ASP H . . 3.360 3.416 3.402 3.434 0.074 3 0 "[ . 1]" 1
619 1 24 GLU HG3 1 25 ASP H 5.000 . 6.000 3.025 2.953 3.189 . 0 0 "[ . 1]" 1
620 1 24 GLU HG2 1 25 ASP H 5.000 . 6.000 4.197 4.144 4.304 . 0 0 "[ . 1]" 1
621 1 25 ASP H 1 26 ARG HA 5.000 . 6.000 5.143 5.103 5.166 . 0 0 "[ . 1]" 1
622 1 26 ARG HA 1 26 ARG HG3 3.400 . 4.080 2.593 2.395 4.191 0.111 5 0 "[ . 1]" 1
623 1 26 ARG HA 1 26 ARG HG2 3.400 . 4.080 3.627 3.573 3.652 . 0 0 "[ . 1]" 1
624 1 27 ARG HA 1 27 ARG HD3 5.000 . 6.000 4.698 3.876 5.531 . 0 0 "[ . 1]" 1
625 1 27 ARG HA 1 27 ARG HD2 5.000 . 6.000 4.451 2.303 4.817 . 0 0 "[ . 1]" 1
626 1 27 ARG H 1 27 ARG HB3 . . 3.360 2.667 2.535 3.529 0.169 7 0 "[ . 1]" 1
627 1 27 ARG H 1 27 ARG HD3 5.000 . 6.000 4.740 3.959 5.928 . 0 0 "[ . 1]" 1
628 1 27 ARG H 1 27 ARG HD2 5.000 . 6.000 4.726 3.413 5.926 . 0 0 "[ . 1]" 1
629 1 27 ARG H 1 27 ARG HG3 5.000 . 6.000 3.841 3.215 4.448 . 0 0 "[ . 1]" 1
630 1 27 ARG H 1 27 ARG HG2 5.000 . 6.000 3.268 1.835 4.503 . 0 0 "[ . 1]" 1
631 1 27 ARG HA 1 28 TYR H 5.000 . 6.000 3.430 3.382 3.464 . 0 0 "[ . 1]" 1
632 1 27 ARG HB3 1 28 TYR H 5.000 . 6.000 3.615 2.987 4.240 . 0 0 "[ . 1]" 1
633 1 27 ARG HB2 1 28 TYR H 5.000 . 6.000 3.990 3.012 4.127 . 0 0 "[ . 1]" 1
634 1 28 TYR HA 1 29 GLY H 5.000 . 6.000 3.514 3.506 3.522 . 0 0 "[ . 1]" 1
635 1 28 TYR HB3 1 30 PRO HA 5.000 . 6.000 4.915 4.841 4.961 . 0 0 "[ . 1]" 1
636 1 28 TYR HB2 1 30 PRO HA 5.000 . 6.000 6.011 5.926 6.041 0.041 8 0 "[ . 1]" 1
637 1 29 GLY H 1 30 PRO HD3 5.000 . 6.000 2.329 2.258 2.387 . 0 0 "[ . 1]" 1
638 1 29 GLY H 1 30 PRO HD2 . . 3.360 3.390 3.383 3.395 0.035 10 0 "[ . 1]" 1
639 1 29 GLY HA2 1 30 PRO HG3 5.000 . 6.000 5.083 5.057 5.115 . 0 0 "[ . 1]" 1
640 1 29 GLY HA2 1 30 PRO HG2 5.000 . 6.000 5.064 5.033 5.094 . 0 0 "[ . 1]" 1
641 1 30 PRO HA 1 30 PRO HB3 2.800 . 3.360 2.305 2.301 2.309 . 0 0 "[ . 1]" 1
642 1 30 PRO HA 1 30 PRO HD3 3.400 . 4.080 3.962 3.941 3.984 . 0 0 "[ . 1]" 1
643 1 30 PRO HA 1 30 PRO HD2 3.400 . 4.080 3.974 3.953 3.992 . 0 0 "[ . 1]" 1
644 1 30 PRO HB2 1 30 PRO HG3 2.800 . 3.360 2.761 2.742 2.781 . 0 0 "[ . 1]" 1
645 1 30 PRO HA 1 30 PRO HG2 3.400 . 4.080 3.974 3.947 3.997 . 0 0 "[ . 1]" 1
646 1 30 PRO HA 1 31 ALA MB . . 4.080 4.188 4.164 4.207 0.127 4 0 "[ . 1]" 1
647 1 30 PRO HG2 1 31 ALA MB 5.000 . 6.000 4.287 4.185 4.377 . 0 0 "[ . 1]" 1
648 1 30 PRO HA 1 31 ALA H 3.000 . 3.560 3.552 3.539 3.566 0.006 2 0 "[ . 1]" 1
649 1 30 PRO HB3 1 31 ALA H 5.000 . 6.000 3.602 3.548 3.677 . 0 0 "[ . 1]" 1
650 1 30 PRO HB2 1 31 ALA H 5.000 . 6.000 2.430 2.312 2.592 . 0 0 "[ . 1]" 1
651 1 31 ALA HA 1 32 LEU H 3.400 . 4.080 2.555 2.189 2.977 . 0 0 "[ . 1]" 1
652 1 32 LEU HA 1 32 LEU MD1 . . 3.360 3.450 3.428 3.494 0.134 6 0 "[ . 1]" 1
653 1 32 LEU HB3 1 32 LEU MD1 3.400 . 4.080 3.198 3.190 3.201 . 0 0 "[ . 1]" 1
654 1 32 LEU HB2 1 32 LEU MD1 3.400 . 4.080 2.434 2.394 2.462 . 0 0 "[ . 1]" 1
655 1 32 LEU HB3 1 32 LEU MD2 3.400 . 4.080 2.361 2.321 2.386 . 0 0 "[ . 1]" 1
656 1 32 LEU H 1 32 LEU MD1 5.000 . 6.000 2.156 1.845 2.406 . 0 0 "[ . 1]" 1
657 1 32 LEU H 1 32 LEU MD2 5.000 . 6.000 3.885 3.561 4.216 . 0 0 "[ . 1]" 1
658 1 32 LEU HA 1 33 SER HB3 5.000 . 6.000 4.986 4.950 5.020 . 0 0 "[ . 1]" 1
659 1 32 LEU HA 1 33 SER HB2 5.000 . 6.000 4.477 4.391 4.580 . 0 0 "[ . 1]" 1
660 1 32 LEU HB3 1 33 SER HB2 5.000 . 6.000 5.820 5.592 5.898 . 0 0 "[ . 1]" 1
661 1 32 LEU HB2 1 33 SER HB2 5.000 . 6.000 4.581 4.521 4.626 . 0 0 "[ . 1]" 1
662 1 32 LEU MD1 1 33 SER HB2 5.000 . 6.000 4.944 4.833 5.182 . 0 0 "[ . 1]" 1
663 1 32 LEU MD2 1 33 SER HB2 5.000 . 6.000 6.045 6.028 6.081 0.081 6 0 "[ . 1]" 1
664 1 32 LEU HG 1 33 SER QB 5.200 . 6.200 6.227 6.184 6.308 0.108 8 0 "[ . 1]" 1
665 1 32 LEU HA 1 33 SER H 2.800 . 3.360 2.751 2.673 2.786 . 0 0 "[ . 1]" 1
666 1 32 LEU HB3 1 33 SER H 5.000 . 6.000 3.213 3.082 3.315 . 0 0 "[ . 1]" 1
667 1 32 LEU HB2 1 33 SER H 5.000 . 6.000 1.746 1.721 1.855 . 0 0 "[ . 1]" 1
668 1 32 LEU MD2 1 33 SER H 5.000 . 6.000 3.644 3.603 3.782 . 0 0 "[ . 1]" 1
669 1 33 SER H 1 33 SER HB2 3.400 . 4.080 2.853 2.748 2.892 . 0 0 "[ . 1]" 1
670 1 33 SER HA 1 34 ILE HA 5.000 . 6.000 4.302 4.294 4.311 . 0 0 "[ . 1]" 1
671 1 33 SER HA 1 34 ILE HB 5.000 . 6.000 4.689 4.643 4.756 . 0 0 "[ . 1]" 1
672 1 33 SER HB3 1 34 ILE HB 5.000 . 6.000 5.310 5.140 5.493 . 0 0 "[ . 1]" 1
673 1 33 SER HB3 1 34 ILE MD 5.000 . 6.000 4.886 4.756 4.995 . 0 0 "[ . 1]" 1
674 1 33 SER HB2 1 34 ILE MD 5.000 . 6.000 4.793 4.667 4.905 . 0 0 "[ . 1]" 1
675 1 33 SER HB3 1 34 ILE H 3.400 . 4.080 3.521 3.337 3.708 . 0 0 "[ . 1]" 1
676 1 33 SER HB2 1 34 ILE H 5.000 . 6.000 3.751 3.639 3.859 . 0 0 "[ . 1]" 1
677 1 34 ILE HB 1 34 ILE MD 3.400 . 4.080 2.425 2.408 2.456 . 0 0 "[ . 1]" 1
678 1 34 ILE HG13 1 34 ILE MG 3.400 . 4.080 2.381 2.358 2.406 . 0 0 "[ . 1]" 1
679 1 34 ILE HG12 1 34 ILE MG 2.800 . 3.360 2.354 2.331 2.373 . 0 0 "[ . 1]" 1
680 1 34 ILE H 1 34 ILE MD 5.000 . 6.000 2.047 1.981 2.100 . 0 0 "[ . 1]" 1
681 1 34 ILE H 1 34 ILE HG13 3.400 . 4.080 3.832 3.796 3.866 . 0 0 "[ . 1]" 1
682 1 34 ILE H 1 34 ILE HG12 5.000 . 6.000 3.846 3.786 3.885 . 0 0 "[ . 1]" 1
683 1 33 SER HB3 1 35 ASN H 5.000 . 6.000 3.428 3.258 3.592 . 0 0 "[ . 1]" 1
684 1 33 SER HB2 1 35 ASN H 5.000 . 6.000 4.573 4.495 4.661 . 0 0 "[ . 1]" 1
685 1 34 ILE MD 1 35 ASN HA 5.000 . 6.000 5.866 5.844 5.874 . 0 0 "[ . 1]" 1
686 1 34 ILE MD 1 35 ASN HB3 5.000 . 6.000 6.041 6.024 6.053 0.053 7 0 "[ . 1]" 1
687 1 34 ILE MD 1 35 ASN HB2 5.000 . 6.000 5.981 5.734 6.027 0.027 6 0 "[ . 1]" 1
688 1 34 ILE HG12 1 35 ASN H 5.100 . 6.100 5.068 4.977 5.126 . 0 0 "[ . 1]" 1
689 1 34 ILE MG 1 35 ASN H 5.000 . 6.000 2.974 2.901 3.050 . 0 0 "[ . 1]" 1
690 1 35 ASN H 1 35 ASN HB3 3.400 . 4.080 2.536 2.509 2.673 . 0 0 "[ . 1]" 1
691 1 35 ASN H 1 35 ASN HB2 3.400 . 4.080 2.506 2.345 2.539 . 0 0 "[ . 1]" 1
692 1 35 ASN H 1 36 GLU HA 5.000 . 6.000 5.328 5.309 5.349 . 0 0 "[ . 1]" 1
693 1 32 LEU MD1 1 37 LEU MD2 5.000 . 6.000 3.558 3.509 3.628 . 0 0 "[ . 1]" 1
694 1 32 LEU MD2 1 37 LEU MD2 5.000 . 6.000 5.134 4.861 5.276 . 0 0 "[ . 1]" 1
695 1 34 ILE HA 1 37 LEU MD1 5.000 . 6.000 2.869 2.676 3.130 . 0 0 "[ . 1]" 1
696 1 34 ILE HA 1 37 LEU MD2 5.000 . 6.000 2.109 1.904 2.335 . 0 0 "[ . 1]" 1
697 1 34 ILE HA 1 37 LEU HG 5.000 . 6.000 4.332 4.225 4.449 . 0 0 "[ . 1]" 1
698 1 36 GLU HA 1 37 LEU H . . 4.080 3.430 3.385 3.447 . 0 0 "[ . 1]" 1
699 1 37 LEU HA 1 37 LEU MD2 3.400 . 4.080 3.744 3.731 3.752 . 0 0 "[ . 1]" 1
700 1 37 LEU H 1 37 LEU HB3 3.400 . 4.080 3.238 3.095 3.304 . 0 0 "[ . 1]" 1
701 1 37 LEU H 1 37 LEU MD1 5.000 . 6.000 2.990 2.828 3.292 . 0 0 "[ . 1]" 1
702 1 37 LEU H 1 37 LEU MD2 5.000 . 6.000 3.801 3.733 3.884 . 0 0 "[ . 1]" 1
703 1 37 LEU H 1 37 LEU HG 4.000 . 4.680 4.433 4.371 4.534 . 0 0 "[ . 1]" 1
704 1 38 SER HA 1 39 ASN H 5.000 . 6.000 3.410 3.386 3.454 . 0 0 "[ . 1]" 1
705 1 39 ASN H 1 39 ASN HB2 3.400 . 4.080 2.622 2.395 3.693 . 0 0 "[ . 1]" 1
706 1 38 SER HA 1 40 LEU H 5.000 . 6.000 3.574 3.404 3.756 . 0 0 "[ . 1]" 1
707 1 39 ASN HB2 1 40 LEU MD2 5.000 . 6.000 4.842 4.552 5.619 . 0 0 "[ . 1]" 1
708 1 39 ASN HB2 1 40 LEU HG 5.000 . 6.000 4.435 4.193 5.650 . 0 0 "[ . 1]" 1
709 1 39 ASN HB2 1 40 LEU H 5.000 . 6.000 3.619 3.257 4.402 . 0 0 "[ . 1]" 1
710 1 40 LEU HA 1 40 LEU MD2 3.400 . 4.080 2.085 1.964 2.206 . 0 0 "[ . 1]" 1
711 1 40 LEU HA 1 40 LEU HG 3.400 . 4.080 2.838 2.737 2.961 . 0 0 "[ . 1]" 1
712 1 40 LEU H 1 40 LEU MD1 5.000 . 6.000 3.484 3.342 3.628 . 0 0 "[ . 1]" 1
713 1 40 LEU H 1 40 LEU HG 5.000 . 6.000 2.562 2.289 2.715 . 0 0 "[ . 1]" 1
714 1 40 LEU HA 1 41 ALA HA 5.000 . 6.000 4.362 4.332 4.451 . 0 0 "[ . 1]" 1
715 1 40 LEU HA 1 41 ALA MB 5.000 . 6.000 3.973 3.949 3.984 . 0 0 "[ . 1]" 1
716 1 40 LEU MD1 1 41 ALA H 5.000 . 6.000 4.520 4.052 4.708 . 0 0 "[ . 1]" 1
717 1 41 ALA H 1 41 ALA MB . . 3.360 2.307 2.246 2.430 . 0 0 "[ . 1]" 1
718 1 41 ALA HA 1 42 LYS H 2.800 . 3.360 2.221 2.177 2.265 . 0 0 "[ . 1]" 1
719 1 41 ALA MB 1 42 LYS H 3.400 . 4.080 2.905 2.723 3.108 . 0 0 "[ . 1]" 1
720 1 42 LYS HA 1 42 LYS HG2 . . 4.080 3.408 2.171 3.585 . 0 0 "[ . 1]" 1
721 1 42 LYS H 1 42 LYS HB3 3.400 . 4.080 3.350 3.180 3.551 . 0 0 "[ . 1]" 1
722 1 42 LYS H 1 42 LYS HB2 . . 3.360 2.106 2.064 2.283 . 0 0 "[ . 1]" 1
723 1 42 LYS H 1 42 LYS HG3 5.000 . 6.000 4.080 2.731 4.418 . 0 0 "[ . 1]" 1
724 1 42 LYS H 1 42 LYS HG2 5.000 . 6.000 4.239 3.528 4.432 . 0 0 "[ . 1]" 1
725 1 42 LYS HG2 1 43 GLY HA3 5.000 . 6.000 5.997 5.857 6.062 0.062 9 0 "[ . 1]" 1
726 1 42 LYS HG2 1 43 GLY HA2 5.000 . 6.000 5.965 5.797 6.023 0.023 10 0 "[ . 1]" 1
727 1 40 LEU MD1 1 44 GLU HB3 5.000 . 6.000 5.135 4.758 5.377 . 0 0 "[ . 1]" 1
728 1 40 LEU MD1 1 44 GLU HB2 5.000 . 6.000 4.790 4.497 5.096 . 0 0 "[ . 1]" 1
729 1 41 ALA H 1 44 GLU HB3 5.000 . 6.000 4.413 4.171 4.605 . 0 0 "[ . 1]" 1
730 1 41 ALA MB 1 44 GLU HB2 5.000 . 6.000 3.131 3.049 3.243 . 0 0 "[ . 1]" 1
731 1 41 ALA H 1 44 GLU HB2 5.000 . 6.000 3.320 2.967 3.569 . 0 0 "[ . 1]" 1
732 1 41 ALA MB 1 44 GLU HG3 5.000 . 6.000 2.375 2.127 2.547 . 0 0 "[ . 1]" 1
733 1 41 ALA MB 1 44 GLU HG2 5.000 . 6.000 2.848 2.675 3.061 . 0 0 "[ . 1]" 1
734 1 43 GLY HA3 1 44 GLU H 5.000 . 6.000 3.232 3.186 3.269 . 0 0 "[ . 1]" 1
735 1 43 GLY HA2 1 44 GLU H 5.000 . 6.000 3.296 3.270 3.336 . 0 0 "[ . 1]" 1
736 1 44 GLU HA 1 44 GLU HG3 . . 4.080 3.724 3.694 3.752 . 0 0 "[ . 1]" 1
737 1 44 GLU HB2 1 44 GLU HG2 2.800 . 3.360 2.434 2.397 2.472 . 0 0 "[ . 1]" 1
738 1 44 GLU H 1 44 GLU HB3 3.400 . 4.080 3.686 3.651 3.708 . 0 0 "[ . 1]" 1
739 1 44 GLU H 1 44 GLU HB2 3.400 . 4.080 2.491 2.423 2.547 . 0 0 "[ . 1]" 1
740 1 44 GLU H 1 44 GLU HG3 5.000 . 6.000 4.088 4.011 4.165 . 0 0 "[ . 1]" 1
741 1 44 GLU H 1 44 GLU HG2 5.000 . 6.000 2.835 2.689 2.988 . 0 0 "[ . 1]" 1
742 1 44 GLU HB2 1 45 LYS HE3 5.000 . 6.000 6.033 5.994 6.061 0.061 7 0 "[ . 1]" 1
743 1 44 GLU HB2 1 45 LYS HE2 5.000 . 6.000 6.055 6.043 6.066 0.066 5 0 "[ . 1]" 1
744 1 45 LYS HE3 1 45 LYS HG3 3.400 . 4.080 2.975 2.961 3.014 . 0 0 "[ . 1]" 1
745 1 45 LYS HE2 1 45 LYS HG3 3.400 . 4.080 2.411 2.374 2.447 . 0 0 "[ . 1]" 1
746 1 45 LYS H 1 45 LYS HG3 5.000 . 6.000 3.572 3.421 3.679 . 0 0 "[ . 1]" 1
747 1 45 LYS H 1 45 LYS HG2 5.000 . 6.000 4.648 4.553 4.715 . 0 0 "[ . 1]" 1
748 1 28 TYR HB3 1 46 ALA HA 5.000 . 6.000 3.641 3.501 3.821 . 0 0 "[ . 1]" 1
749 1 28 TYR HB2 1 46 ALA HA 5.000 . 6.000 4.278 4.155 4.456 . 0 0 "[ . 1]" 1
750 1 37 LEU MD2 1 46 ALA MB . . 4.080 3.834 3.761 3.875 . 0 0 "[ . 1]" 1
751 1 45 LYS HA 1 46 ALA MB 5.000 . 6.000 3.814 3.806 3.826 . 0 0 "[ . 1]" 1
752 1 45 LYS HB3 1 46 ALA H 5.000 . 6.000 2.093 1.999 2.157 . 0 0 "[ . 1]" 1
753 1 45 LYS HB2 1 46 ALA H 5.000 . 6.000 3.550 3.441 3.605 . 0 0 "[ . 1]" 1
754 1 45 LYS HG3 1 46 ALA H 5.000 . 6.000 4.113 4.011 4.177 . 0 0 "[ . 1]" 1
755 1 31 ALA HA 1 47 ASN HB3 5.000 . 6.000 4.151 3.644 4.598 . 0 0 "[ . 1]" 1
756 1 31 ALA HA 1 47 ASN HB2 5.000 . 6.000 3.669 3.444 3.888 . 0 0 "[ . 1]" 1
757 1 46 ALA MB 1 47 ASN H . . 3.360 3.099 3.079 3.121 . 0 0 "[ . 1]" 1
758 1 32 LEU HA 1 48 VAL MG1 5.000 . 6.000 4.568 4.414 4.641 . 0 0 "[ . 1]" 1
759 1 32 LEU H 1 48 VAL MG2 5.000 . 6.000 5.426 5.076 5.840 . 0 0 "[ . 1]" 1
760 1 34 ILE HA 1 48 VAL MG1 5.000 . 6.000 3.427 3.118 3.667 . 0 0 "[ . 1]" 1
761 1 34 ILE HB 1 48 VAL MG1 5.000 . 6.000 5.398 5.013 5.674 . 0 0 "[ . 1]" 1
762 1 34 ILE HG13 1 48 VAL MG1 5.000 . 6.000 3.998 3.491 4.378 . 0 0 "[ . 1]" 1
763 1 34 ILE HG12 1 48 VAL MG1 5.000 . 6.000 5.151 4.703 5.516 . 0 0 "[ . 1]" 1
764 1 34 ILE HA 1 48 VAL MG2 5.000 . 6.000 4.433 4.220 4.601 . 0 0 "[ . 1]" 1
765 1 34 ILE HG12 1 48 VAL MG2 5.000 . 6.000 4.853 4.446 5.350 . 0 0 "[ . 1]" 1
766 1 37 LEU MD2 1 48 VAL HA 5.000 . 6.000 5.050 4.853 5.259 . 0 0 "[ . 1]" 1
767 1 37 LEU MD2 1 48 VAL HB 5.000 . 6.000 3.431 3.283 3.653 . 0 0 "[ . 1]" 1
768 1 37 LEU MD1 1 48 VAL MG1 5.000 . 6.000 1.747 1.696 1.811 . 0 0 "[ . 1]" 1
769 1 37 LEU MD1 1 48 VAL MG2 5.000 . 6.000 2.822 2.676 3.014 . 0 0 "[ . 1]" 1
770 1 47 ASN HB3 1 48 VAL H 5.000 . 6.000 3.525 3.344 3.648 . 0 0 "[ . 1]" 1
771 1 47 ASN HB2 1 48 VAL H 5.000 . 6.000 4.347 4.288 4.390 . 0 0 "[ . 1]" 1
772 1 48 VAL HA 1 48 VAL MG2 3.400 . 4.080 3.188 3.183 3.193 . 0 0 "[ . 1]" 1
773 1 48 VAL HB 1 49 LEU H 5.000 . 6.000 2.872 2.656 3.082 . 0 0 "[ . 1]" 1
774 1 48 VAL MG1 1 49 LEU H 5.000 . 6.000 3.582 3.496 3.639 . 0 0 "[ . 1]" 1
775 1 49 LEU HA 1 49 LEU MD1 3.400 . 4.080 4.002 3.297 4.124 0.044 6 0 "[ . 1]" 1
776 1 49 LEU HB3 1 49 LEU MD1 3.400 . 4.080 2.480 2.290 2.565 . 0 0 "[ . 1]" 1
777 1 49 LEU HB2 1 49 LEU MD1 2.800 . 3.360 2.321 2.182 3.171 . 0 0 "[ . 1]" 1
778 1 49 LEU HA 1 49 LEU MD2 3.400 . 4.080 2.841 2.652 3.427 . 0 0 "[ . 1]" 1
779 1 49 LEU HB3 1 49 LEU MD2 3.400 . 4.080 2.356 2.230 3.195 . 0 0 "[ . 1]" 1
780 1 49 LEU HB3 1 49 LEU HG 2.800 . 3.360 2.961 2.540 3.012 . 0 0 "[ . 1]" 1
781 1 49 LEU H 1 49 LEU HG 5.000 . 6.000 1.825 1.577 3.541 . 0 0 "[ . 1]" 1
782 1 49 LEU HA 1 50 ILE HB 5.000 . 6.000 5.658 5.618 5.688 . 0 0 "[ . 1]" 1
783 1 49 LEU HA 1 50 ILE HG13 5.000 . 6.000 4.802 4.508 5.518 . 0 0 "[ . 1]" 1
784 1 49 LEU HA 1 50 ILE HG12 5.000 . 6.000 3.651 3.420 4.386 . 0 0 "[ . 1]" 1
785 1 49 LEU HA 1 50 ILE MG 5.000 . 6.000 3.879 3.573 4.060 . 0 0 "[ . 1]" 1
786 1 50 ILE HB 1 50 ILE MD 3.400 . 4.080 2.512 2.414 3.213 . 0 0 "[ . 1]" 1
787 1 50 ILE HA 1 50 ILE MG 3.400 . 4.080 2.236 2.197 2.303 . 0 0 "[ . 1]" 1
788 1 50 ILE HG12 1 50 ILE MG 3.400 . 4.080 2.482 2.380 3.188 . 0 0 "[ . 1]" 1
789 1 50 ILE H 1 50 ILE MD 5.000 . 6.000 3.463 1.593 3.791 . 0 0 "[ . 1]" 1
790 1 50 ILE H 1 50 ILE HG13 5.000 . 6.000 2.757 2.452 3.577 . 0 0 "[ . 1]" 1
791 1 50 ILE H 1 50 ILE HG12 3.400 . 4.080 2.023 1.726 2.307 . 0 0 "[ . 1]" 1
792 1 49 LEU HG 1 51 GLY H 5.000 . 6.000 5.282 5.005 5.535 . 0 0 "[ . 1]" 1
793 1 50 ILE HA 1 51 GLY HA3 5.000 . 6.000 4.850 4.444 5.080 . 0 0 "[ . 1]" 1
794 1 50 ILE HA 1 51 GLY HA2 5.000 . 6.000 4.506 4.415 4.956 . 0 0 "[ . 1]" 1
795 1 50 ILE MD 1 51 GLY H 5.000 . 6.000 4.597 3.591 4.841 . 0 0 "[ . 1]" 1
796 1 50 ILE MG 1 51 GLY H 5.000 . 6.000 4.302 4.160 4.388 . 0 0 "[ . 1]" 1
797 1 51 GLY HA3 1 52 GLN H 5.000 . 6.000 2.732 2.154 3.565 . 0 0 "[ . 1]" 1
798 1 51 GLY HA2 1 52 GLN H 5.000 . 6.000 3.139 2.658 3.507 . 0 0 "[ . 1]" 1
799 1 49 LEU MD1 1 53 GLY H 5.000 . 6.000 4.302 3.464 4.715 . 0 0 "[ . 1]" 1
800 1 49 LEU MD2 1 53 GLY H 5.000 . 6.000 4.663 3.531 5.170 . 0 0 "[ . 1]" 1
801 1 52 GLN HA 1 53 GLY HA2 5.000 . 6.000 4.421 4.322 4.909 . 0 0 "[ . 1]" 1
802 1 52 GLN HA 1 53 GLY H 3.400 . 4.080 2.577 2.152 3.063 . 0 0 "[ . 1]" 1
803 1 49 LEU MD1 1 54 ASP H 5.000 . 6.000 4.997 4.711 5.416 . 0 0 "[ . 1]" 1
804 1 49 LEU MD2 1 54 ASP H 5.000 . 6.000 4.638 4.092 5.446 . 0 0 "[ . 1]" 1
805 1 50 ILE MD 1 54 ASP HB3 5.000 . 6.000 3.307 2.732 3.829 . 0 0 "[ . 1]" 1
806 1 50 ILE HG13 1 54 ASP HB3 5.000 . 6.000 3.789 2.419 4.632 . 0 0 "[ . 1]" 1
807 1 50 ILE HG12 1 54 ASP HB3 5.000 . 6.000 3.680 1.997 4.306 . 0 0 "[ . 1]" 1
808 1 50 ILE MG 1 54 ASP HB3 5.000 . 6.000 5.445 4.061 5.996 . 0 0 "[ . 1]" 1
809 1 50 ILE HB 1 54 ASP HB2 5.000 . 6.000 5.172 4.743 6.020 0.020 10 0 "[ . 1]" 1
810 1 50 ILE MD 1 54 ASP HB2 5.000 . 6.000 2.902 1.815 3.753 . 0 0 "[ . 1]" 1
811 1 50 ILE HG13 1 54 ASP HB2 5.000 . 6.000 2.874 2.286 3.645 . 0 0 "[ . 1]" 1
812 1 50 ILE HG12 1 54 ASP HB2 5.000 . 6.000 2.945 2.580 3.593 . 0 0 "[ . 1]" 1
813 1 50 ILE MG 1 54 ASP HB2 5.000 . 6.000 4.808 4.497 5.357 . 0 0 "[ . 1]" 1
814 1 53 GLY HA3 1 54 ASP H 5.000 . 6.000 3.316 2.973 3.562 . 0 0 "[ . 1]" 1
815 1 53 GLY HA2 1 54 ASP H 5.000 . 6.000 3.145 2.714 3.482 . 0 0 "[ . 1]" 1
816 1 54 ASP H 1 54 ASP HB3 3.400 . 4.080 3.591 2.622 3.885 . 0 0 "[ . 1]" 1
817 1 54 ASP H 1 54 ASP HB2 3.400 . 4.080 3.031 2.515 3.862 . 0 0 "[ . 1]" 1
818 1 47 ASN HB3 1 55 VAL MG1 5.000 . 6.000 2.149 2.021 2.329 . 0 0 "[ . 1]" 1
819 1 47 ASN HB2 1 55 VAL MG1 . . 4.080 3.418 3.276 3.623 . 0 0 "[ . 1]" 1
820 1 48 VAL HA 1 55 VAL MG1 5.000 . 6.000 3.942 3.515 4.205 . 0 0 "[ . 1]" 1
821 1 48 VAL H 1 55 VAL MG1 5.000 . 6.000 3.786 3.465 4.010 . 0 0 "[ . 1]" 1
822 1 48 VAL H 1 55 VAL MG2 5.000 . 6.000 5.645 5.481 5.821 . 0 0 "[ . 1]" 1
823 1 49 LEU HA 1 55 VAL MG1 5.000 . 6.000 4.092 3.684 4.266 . 0 0 "[ . 1]" 1
824 1 49 LEU HA 1 55 VAL MG2 5.000 . 6.000 3.705 3.457 3.946 . 0 0 "[ . 1]" 1
825 1 54 ASP HB2 1 55 VAL H 5.000 . 6.000 4.242 3.901 4.478 . 0 0 "[ . 1]" 1
826 1 55 VAL HA 1 55 VAL MG2 3.400 . 4.080 2.397 2.372 2.417 . 0 0 "[ . 1]" 1
827 1 55 VAL H 1 55 VAL MG1 . . 3.760 3.798 3.788 3.810 0.050 4 0 "[ . 1]" 1
828 1 23 LYS HA 1 56 VAL HA 3.400 . 4.080 2.129 2.011 2.235 . 0 0 "[ . 1]" 1
829 1 23 LYS HA 1 56 VAL MG1 5.000 . 6.000 2.486 2.404 2.729 . 0 0 "[ . 1]" 1
830 1 24 GLU HA 1 56 VAL HA 5.000 . 6.000 6.087 6.064 6.124 0.124 4 0 "[ . 1]" 1
831 1 47 ASN HA 1 56 VAL HA 5.000 . 6.000 4.228 4.162 4.295 . 0 0 "[ . 1]" 1
832 1 48 VAL HB 1 56 VAL MG2 5.000 . 6.000 5.285 4.992 5.500 . 0 0 "[ . 1]" 1
833 1 48 VAL H 1 56 VAL MG2 5.000 . 6.000 3.719 3.618 3.893 . 0 0 "[ . 1]" 1
834 1 55 VAL HA 1 56 VAL MG2 5.000 . 6.000 3.805 3.714 3.933 . 0 0 "[ . 1]" 1
835 1 55 VAL MG1 1 56 VAL H 5.000 . 6.000 3.105 3.060 3.147 . 0 0 "[ . 1]" 1
836 1 55 VAL MG2 1 56 VAL H 5.000 . 6.000 4.176 4.135 4.234 . 0 0 "[ . 1]" 1
837 1 56 VAL HA 1 56 VAL MG1 3.400 . 4.080 2.384 2.345 2.421 . 0 0 "[ . 1]" 1
838 1 56 VAL H 1 56 VAL MG2 3.400 . 4.080 2.222 2.179 2.266 . 0 0 "[ . 1]" 1
839 1 25 ASP HB3 1 57 LEU HG 3.400 . 4.080 4.207 4.164 4.225 0.145 9 0 "[ . 1]" 1
840 1 25 ASP HB2 1 57 LEU HG 5.000 . 6.000 5.163 5.045 5.284 . 0 0 "[ . 1]" 1
841 1 28 TYR HB3 1 57 LEU MD1 5.000 . 6.000 4.889 4.587 5.101 . 0 0 "[ . 1]" 1
842 1 48 VAL HA 1 57 LEU QB 6.000 . 7.200 6.262 6.192 6.390 . 0 0 "[ . 1]" 1
843 1 49 LEU QD 1 57 LEU H 6.000 . 7.200 7.230 7.136 7.275 0.075 8 0 "[ . 1]" 1
844 1 56 VAL MG1 1 57 LEU H 5.000 . 6.000 3.863 3.785 3.946 . 0 0 "[ . 1]" 1
845 1 56 VAL MG2 1 57 LEU H 5.000 . 6.000 3.756 3.540 3.920 . 0 0 "[ . 1]" 1
846 1 57 LEU H 1 57 LEU HG . . 3.360 2.534 2.278 2.614 . 0 0 "[ . 1]" 1
847 1 18 PHE HB3 1 58 VAL HB 5.000 . 6.000 2.303 2.113 2.438 . 0 0 "[ . 1]" 1
848 1 18 PHE HB2 1 58 VAL HB 5.000 . 6.000 3.761 3.528 3.894 . 0 0 "[ . 1]" 1
849 1 18 PHE HB3 1 58 VAL MG1 5.000 . 6.000 2.063 2.027 2.102 . 0 0 "[ . 1]" 1
850 1 18 PHE HB2 1 58 VAL MG1 5.000 . 6.000 2.530 2.299 2.635 . 0 0 "[ . 1]" 1
851 1 18 PHE HB2 1 58 VAL MG2 5.000 . 6.000 4.138 3.886 4.310 . 0 0 "[ . 1]" 1
852 1 20 ILE HA 1 58 VAL HA 3.400 . 4.080 3.842 3.102 4.104 0.024 10 0 "[ . 1]" 1
853 1 21 LEU H 1 58 VAL HA 5.000 . 6.000 2.826 2.601 3.252 . 0 0 "[ . 1]" 1
854 1 21 LEU H 1 58 VAL MG1 5.000 . 6.000 3.434 3.262 4.028 . 0 0 "[ . 1]" 1
855 1 45 LYS HA 1 58 VAL MG1 5.000 . 6.000 5.696 5.585 5.754 . 0 0 "[ . 1]" 1
856 1 45 LYS QB 1 58 VAL MG1 5.000 . 6.000 5.907 5.756 6.000 0.000 4 0 "[ . 1]" 1
857 1 45 LYS QD 1 58 VAL MG1 5.700 . 6.700 6.566 6.498 6.707 0.007 4 0 "[ . 1]" 1
858 1 45 LYS HG3 1 58 VAL MG1 5.200 . 6.200 6.248 6.222 6.289 0.089 2 0 "[ . 1]" 1
859 1 45 LYS HG2 1 58 VAL MG1 5.000 . 6.000 5.543 5.469 5.683 . 0 0 "[ . 1]" 1
860 1 45 LYS HA 1 58 VAL MG2 5.000 . 6.000 4.294 4.241 4.370 . 0 0 "[ . 1]" 1
861 1 45 LYS QB 1 58 VAL MG2 5.000 . 6.000 4.718 4.589 4.782 . 0 0 "[ . 1]" 1
862 1 47 ASN HA 1 58 VAL H 5.000 . 6.000 3.937 3.855 4.042 . 0 0 "[ . 1]" 1
863 1 48 VAL HA 1 58 VAL MG1 5.500 . 6.700 6.830 6.803 6.867 0.167 6 0 "[ . 1]" 1
864 1 48 VAL HA 1 58 VAL MG2 5.000 . 6.000 5.132 5.054 5.188 . 0 0 "[ . 1]" 1
865 1 57 LEU HG 1 58 VAL H 5.000 . 6.000 4.258 4.169 4.611 . 0 0 "[ . 1]" 1
866 1 58 VAL HA 1 58 VAL MG1 3.400 . 4.080 2.064 2.043 2.098 . 0 0 "[ . 1]" 1
867 1 58 VAL H 1 58 VAL MG2 . . 3.360 1.963 1.914 1.990 . 0 0 "[ . 1]" 1
868 1 45 LYS HA 1 59 MET HA 3.400 . 4.080 2.832 2.701 2.879 . 0 0 "[ . 1]" 1
869 1 58 VAL MG1 1 59 MET HG2 5.000 . 6.000 6.037 6.008 6.113 0.113 6 0 "[ . 1]" 1
870 1 59 MET HA 1 59 MET ME 5.000 . 6.000 2.540 2.475 2.645 . 0 0 "[ . 1]" 1
871 1 59 MET ME 1 59 MET HG3 3.400 . 4.080 3.389 3.340 3.406 . 0 0 "[ . 1]" 1
872 1 59 MET H 1 59 MET ME 5.000 . 6.000 4.445 4.370 4.521 . 0 0 "[ . 1]" 1
873 1 59 MET H 1 59 MET HG3 5.000 . 6.000 4.530 4.447 4.723 . 0 0 "[ . 1]" 1
874 1 59 MET H 1 59 MET HG2 5.000 . 6.000 4.246 4.207 4.366 . 0 0 "[ . 1]" 1
875 1 59 MET ME 1 60 LYS HA 5.000 . 6.000 3.635 3.347 3.790 . 0 0 "[ . 1]" 1
876 1 59 MET QG 1 60 LYS HA 5.000 . 6.000 5.678 5.544 5.745 . 0 0 "[ . 1]" 1
877 1 59 MET HG2 1 60 LYS HA 5.000 . 6.000 6.009 5.869 6.073 0.073 2 0 "[ . 1]" 1
878 1 59 MET H 1 60 LYS QD 5.000 . 6.000 5.008 4.498 5.720 . 0 0 "[ . 1]" 1
879 1 59 MET QG 1 60 LYS QG 5.000 . 6.000 4.440 4.246 4.663 . 0 0 "[ . 1]" 1
880 1 59 MET HG3 1 60 LYS H 5.000 . 6.000 5.049 4.785 5.246 . 0 0 "[ . 1]" 1
881 1 59 MET HG2 1 60 LYS H 5.000 . 6.000 3.633 3.372 3.829 . 0 0 "[ . 1]" 1
882 1 60 LYS HA 1 60 LYS HD3 5.000 . 6.000 2.985 2.311 5.437 . 0 0 "[ . 1]" 1
883 1 60 LYS HA 1 60 LYS HD2 5.000 . 6.000 3.924 2.545 4.504 . 0 0 "[ . 1]" 1
884 1 60 LYS H 1 60 LYS HG2 5.000 . 6.000 1.527 1.473 1.582 . 0 0 "[ . 1]" 1
885 1 59 MET ME 1 61 ARG HA 5.000 . 6.000 3.830 2.132 4.478 . 0 0 "[ . 1]" 1
886 1 59 MET ME 1 61 ARG H 5.000 . 6.000 3.863 1.980 4.527 . 0 0 "[ . 1]" 1
887 1 60 LYS HA 1 61 ARG HG2 5.000 . 6.000 4.896 3.264 5.642 . 0 0 "[ . 1]" 1
888 1 60 LYS HB3 1 61 ARG H 5.000 . 6.000 3.041 2.374 4.621 . 0 0 "[ . 1]" 1
889 1 60 LYS HB2 1 61 ARG H 5.000 . 6.000 3.113 2.431 4.270 . 0 0 "[ . 1]" 1
890 1 60 LYS HG3 1 61 ARG H 5.000 . 6.000 4.958 4.570 5.860 . 0 0 "[ . 1]" 1
891 1 60 LYS HG2 1 61 ARG H 5.000 . 6.000 4.752 4.579 5.152 . 0 0 "[ . 1]" 1
892 1 61 ARG HB2 1 61 ARG HD3 . . 4.080 3.367 2.914 4.210 0.130 4 0 "[ . 1]" 1
893 1 61 ARG HB2 1 61 ARG HD2 3.400 . 4.080 2.842 2.356 3.718 . 0 0 "[ . 1]" 1
894 1 61 ARG HA 1 61 ARG HG3 3.400 . 4.080 3.286 3.039 3.816 . 0 0 "[ . 1]" 1
895 1 61 ARG HB3 1 61 ARG HG3 2.800 . 3.360 2.903 2.448 3.016 . 0 0 "[ . 1]" 1
896 1 61 ARG H 1 61 ARG HB3 . . 4.080 3.524 3.097 3.632 . 0 0 "[ . 1]" 1
897 1 61 ARG H 1 61 ARG HG3 5.000 . 6.000 2.735 1.955 4.126 . 0 0 "[ . 1]" 1
898 1 61 ARG H 1 61 ARG HG2 . . 3.360 3.292 3.110 3.385 0.025 9 0 "[ . 1]" 1
899 1 61 ARG HB3 1 62 LYS H 5.000 . 6.000 3.119 2.520 3.807 . 0 0 "[ . 1]" 1
900 1 62 LYS H 1 62 LYS HG3 5.000 . 6.000 3.804 2.835 4.874 . 0 0 "[ . 1]" 1
901 1 62 LYS H 1 62 LYS HG2 5.000 . 6.000 3.432 1.943 5.364 . 0 0 "[ . 1]" 1
902 1 61 ARG HA 1 63 ARG QB 5.000 . 6.000 5.903 4.670 6.202 0.202 7 0 "[ . 1]" 1
903 1 62 LYS HG3 1 63 ARG HB2 3.400 . 4.080 3.368 2.779 4.141 0.061 10 0 "[ . 1]" 1
904 1 62 LYS HG2 1 63 ARG HB3 3.000 . 3.600 3.179 2.773 3.607 0.007 6 0 "[ . 1]" 1
905 1 66 SER HA 1 67 ILE HG12 5.500 . 6.500 5.612 4.174 6.688 0.188 9 0 "[ . 1]" 1
906 1 66 SER HA 1 67 ILE H . . 3.560 3.409 2.243 3.573 0.013 4 0 "[ . 1]" 1
907 1 67 ILE HB 1 67 ILE MD 2.800 . 3.360 2.423 2.324 2.665 . 0 0 "[ . 1]" 1
908 1 67 ILE HA 1 67 ILE HG12 3.400 . 4.080 3.657 2.406 3.883 . 0 0 "[ . 1]" 1
909 1 67 ILE HA 1 67 ILE MG 3.400 . 4.080 2.511 2.364 3.173 . 0 0 "[ . 1]" 1
910 1 67 ILE HG12 1 67 ILE MG 3.400 . 4.080 2.376 2.284 2.610 . 0 0 "[ . 1]" 1
911 1 67 ILE H 1 67 ILE MD 5.000 . 6.000 4.048 3.628 5.011 . 0 0 "[ . 1]" 1
912 1 67 ILE H 1 67 ILE HG13 5.000 . 6.000 3.370 3.036 4.842 . 0 0 "[ . 1]" 1
913 1 67 ILE H 1 67 ILE HG12 5.000 . 6.000 2.591 2.123 4.561 . 0 0 "[ . 1]" 1
914 1 67 ILE HA 1 68 LEU HA 4.300 . 4.980 5.157 5.105 5.247 0.267 8 0 "[ . 1]" 1
915 1 67 ILE HB 1 68 LEU HA 5.000 . 6.000 5.803 5.506 5.997 . 0 0 "[ . 1]" 1
916 1 68 LEU HA 1 68 LEU MD2 3.400 . 4.080 1.969 1.872 2.073 . 0 0 "[ . 1]" 1
917 1 68 LEU H 1 68 LEU HG 5.000 . 6.000 3.726 3.005 4.563 . 0 0 "[ . 1]" 1
918 1 69 THR HA 1 69 THR MG 3.400 . 4.080 2.388 2.137 3.205 . 0 0 "[ . 1]" 1
919 1 69 THR HA 1 70 ASP H 5.000 . 6.000 2.296 2.137 2.617 . 0 0 "[ . 1]" 1
920 1 69 THR HB 1 70 ASP H 5.000 . 6.000 3.480 2.243 4.239 . 0 0 "[ . 1]" 1
921 1 71 SER HA 1 72 GLN H 5.000 . 6.000 2.227 2.166 2.418 . 0 0 "[ . 1]" 1
922 1 71 SER HB2 1 72 GLN H 5.000 . 6.000 3.802 2.402 4.230 . 0 0 "[ . 1]" 1
923 1 72 GLN HA 1 73 THR H 3.400 . 4.080 3.215 3.109 3.435 . 0 0 "[ . 1]" 1
924 1 73 THR HA 1 74 ALA MB 5.000 . 6.000 4.802 4.351 4.990 . 0 0 "[ . 1]" 1
925 1 73 THR MG 1 74 ALA MB 5.000 . 6.000 2.802 2.419 3.187 . 0 0 "[ . 1]" 1
926 1 73 THR HA 1 74 ALA H 5.000 . 6.000 3.299 2.819 3.500 . 0 0 "[ . 1]" 1
927 1 75 THR HA 1 75 THR MG 3.400 . 4.080 2.336 2.244 2.372 . 0 0 "[ . 1]" 1
928 1 75 THR HA 1 76 LYS H 5.000 . 6.000 3.453 3.133 3.538 . 0 0 "[ . 1]" 1
929 1 75 THR HB 1 76 LYS H 5.000 . 6.000 3.033 2.677 3.774 . 0 0 "[ . 1]" 1
930 1 76 LYS HA 1 77 ARG H 5.000 . 6.000 3.170 2.318 3.543 . 0 0 "[ . 1]" 1
931 1 76 LYS QB 1 77 ARG H 5.000 . 6.000 2.910 2.191 3.874 . 0 0 "[ . 1]" 1
932 1 59 MET HA 1 78 ILE HB 6.000 . 7.200 7.074 6.923 7.230 0.030 4 0 "[ . 1]" 1
933 1 77 ARG HA 1 78 ILE MD 5.000 . 6.000 4.888 3.369 5.793 . 0 0 "[ . 1]" 1
934 1 77 ARG HA 1 78 ILE QG 5.000 . 6.000 4.470 4.005 5.370 . 0 0 "[ . 1]" 1
935 1 77 ARG HA 1 78 ILE MG 5.000 . 6.000 3.663 3.462 3.984 . 0 0 "[ . 1]" 1
936 1 77 ARG HG3 1 78 ILE MG 5.000 . 6.000 5.822 5.563 6.026 0.026 9 0 "[ . 1]" 1
937 1 77 ARG H 1 78 ILE MG 5.000 . 6.000 5.293 5.107 5.480 . 0 0 "[ . 1]" 1
938 1 78 ILE HG13 1 78 ILE MG 3.400 . 4.080 2.889 2.342 3.206 . 0 0 "[ . 1]" 1
939 1 78 ILE HG12 1 78 ILE MG . . 3.360 2.589 2.209 3.207 . 0 0 "[ . 1]" 1
940 1 78 ILE H 1 78 ILE HG13 5.000 . 6.000 3.257 1.852 3.892 . 0 0 "[ . 1]" 1
941 1 78 ILE MG 1 80 MET HB3 5.000 . 6.000 4.867 4.216 5.289 . 0 0 "[ . 1]" 1
942 1 81 ALA MB 1 82 ILE MG 5.000 . 6.000 4.611 3.904 5.360 . 0 0 "[ . 1]" 1
943 1 81 ALA HA 1 82 ILE H 5.000 . 6.000 2.360 2.136 2.750 . 0 0 "[ . 1]" 1
944 1 82 ILE HB 1 82 ILE MD 3.400 . 4.080 2.629 2.269 3.238 . 0 0 "[ . 1]" 1
945 1 82 ILE HA 1 82 ILE MG 3.400 . 4.080 2.412 2.283 3.211 . 0 0 "[ . 1]" 1
946 1 82 ILE HG13 1 82 ILE MG 3.400 . 4.080 2.859 2.349 3.207 . 0 0 "[ . 1]" 1
947 1 82 ILE MD 1 83 ASN H 5.000 . 6.000 3.770 2.489 4.638 . 0 0 "[ . 1]" 1
948 1 82 ILE HG13 1 83 ASN H 5.000 . 6.000 4.131 2.448 5.476 . 0 0 "[ . 1]" 1
949 1 82 ILE HG12 1 83 ASN H 5.000 . 6.000 4.419 2.628 5.156 . 0 0 "[ . 1]" 1
950 1 21 LEU H 1 21 LEU HB3 3.400 . 4.080 2.658 2.078 2.763 . 0 0 "[ . 1]" 1
951 1 40 LEU MD2 1 60 LYS H 5.200 . 6.200 6.252 6.235 6.274 0.074 2 0 "[ . 1]" 1
952 1 60 LYS H 1 60 LYS HB2 3.400 . 4.080 2.784 2.638 3.322 . 0 0 "[ . 1]" 1
953 1 44 GLU HA 1 60 LYS H 5.000 . 6.000 5.277 5.183 5.414 . 0 0 "[ . 1]" 1
954 1 43 GLY QA 1 60 LYS H 5.000 . 6.000 4.700 4.478 5.049 . 0 0 "[ . 1]" 1
955 1 41 ALA H 1 44 GLU QB 3.400 . 4.080 3.229 2.907 3.454 . 0 0 "[ . 1]" 1
956 1 67 ILE MG 1 68 LEU H 3.200 . 3.760 3.724 2.557 3.917 0.157 5 0 "[ . 1]" 1
957 1 79 ARG H 1 79 ARG QB 2.800 . 3.360 2.911 2.848 3.046 . 0 0 "[ . 1]" 1
958 1 31 ALA H 1 32 LEU H 5.000 . 6.000 3.008 2.675 3.396 . 0 0 "[ . 1]" 1
959 1 32 LEU H 1 46 ALA MB 5.000 . 6.000 4.697 4.248 5.150 . 0 0 "[ . 1]" 1
960 1 25 ASP H 1 57 LEU QD 5.000 . 6.000 3.975 3.893 4.072 . 0 0 "[ . 1]" 1
961 1 25 ASP H 1 57 LEU QB 6.000 . 7.200 6.930 6.854 7.208 0.008 4 0 "[ . 1]" 1
962 1 45 LYS QD 1 57 LEU H 5.200 . 6.200 6.100 5.947 6.181 . 0 0 "[ . 1]" 1
963 1 23 LYS HB2 1 57 LEU H 5.000 . 6.000 5.966 5.670 6.036 0.036 3 0 "[ . 1]" 1
964 1 24 GLU HA 1 57 LEU H 5.200 . 6.400 6.329 6.286 6.392 . 0 0 "[ . 1]" 1
965 1 23 LYS HA 1 57 LEU H 5.000 . 6.000 3.449 3.238 3.548 . 0 0 "[ . 1]" 1
966 1 47 ASN HA 1 57 LEU H 5.000 . 6.000 3.385 3.339 3.549 . 0 0 "[ . 1]" 1
967 1 19 LEU MD2 1 20 ILE H 2.800 . 3.360 2.462 1.891 2.927 . 0 0 "[ . 1]" 1
968 1 20 ILE H 1 79 ARG HG3 4.400 . 5.280 5.315 5.266 5.343 0.063 2 0 "[ . 1]" 1
969 1 30 PRO HA 1 31 ALA H 2.800 . 3.360 2.247 2.244 2.252 . 0 0 "[ . 1]" 1
970 1 49 LEU QD 1 50 ILE H 2.800 . 3.360 2.669 1.586 2.948 . 0 0 "[ . 1]" 1
971 1 49 LEU HB2 1 50 ILE H 3.400 . 4.080 2.604 2.407 3.055 . 0 0 "[ . 1]" 1
972 1 53 GLY HA3 1 55 VAL H 5.000 . 6.000 5.918 5.836 6.017 0.017 1 0 "[ . 1]" 1
973 1 10 VAL HB 1 11 GLU H 2.800 . 3.360 2.303 1.825 2.577 . 0 0 "[ . 1]" 1
974 1 77 ARG HB3 1 78 ILE H 2.800 . 3.360 2.721 1.925 3.226 . 0 0 "[ . 1]" 1
975 1 69 THR HA 1 70 ASP H 3.400 . 4.080 2.202 2.122 2.321 . 0 0 "[ . 1]" 1
976 1 76 LYS QD 1 77 ARG H 5.000 . 6.000 3.641 2.992 4.035 . 0 0 "[ . 1]" 1
977 1 76 LYS HA 1 77 ARG H 2.800 . 3.360 2.520 2.039 2.752 . 0 0 "[ . 1]" 1
978 1 19 LEU H 1 60 LYS HA 5.000 . 6.000 3.975 3.661 4.355 . 0 0 "[ . 1]" 1
979 1 19 LEU H 1 58 VAL HA 5.000 . 6.000 4.162 3.862 4.475 . 0 0 "[ . 1]" 1
980 1 61 ARG HB3 1 62 LYS H 3.400 . 4.080 2.855 2.479 3.256 . 0 0 "[ . 1]" 1
981 1 34 ILE H 1 34 ILE MD 2.800 . 3.360 2.037 1.973 2.088 . 0 0 "[ . 1]" 1
982 1 32 LEU HA 1 34 ILE H 5.000 . 6.000 5.041 4.991 5.099 . 0 0 "[ . 1]" 1
983 1 37 LEU HA 1 40 LEU H 3.400 . 4.080 3.718 3.454 3.864 . 0 0 "[ . 1]" 1
984 1 48 VAL H 1 48 VAL QG 2.800 . 3.360 2.157 2.077 2.226 . 0 0 "[ . 1]" 1
985 1 14 VAL MG2 1 16 ARG H 5.000 . 6.000 4.216 3.860 4.772 . 0 0 "[ . 1]" 1
986 1 15 LEU HB3 1 16 ARG H 3.400 . 4.080 2.947 1.750 3.591 . 0 0 "[ . 1]" 1
987 1 46 ALA H 1 58 VAL MG2 2.800 . 3.360 3.255 3.189 3.341 . 0 0 "[ . 1]" 1
988 1 46 ALA H 1 57 LEU HG 3.600 . 4.280 4.427 4.414 4.485 0.205 4 0 "[ . 1]" 1
989 1 41 ALA MB 1 42 LYS H 2.800 . 3.360 2.789 2.389 2.999 . 0 0 "[ . 1]" 1
990 1 46 ALA H 1 47 ASN HA 5.000 . 6.000 4.012 3.994 4.026 . 0 0 "[ . 1]" 1
991 1 23 LYS H 1 57 LEU HG 5.000 . 6.000 6.040 5.944 6.069 0.069 6 0 "[ . 1]" 1
992 1 22 GLY HA3 1 23 LYS H 2.800 . 3.360 2.338 2.312 2.377 . 0 0 "[ . 1]" 1
993 1 22 GLY H 1 23 LYS H 5.000 . 6.000 3.427 3.344 3.558 . 0 0 "[ . 1]" 1
994 1 15 LEU H 1 15 LEU QB 3.400 . 4.080 2.281 2.094 2.527 . 0 0 "[ . 1]" 1
995 1 9 GLY QA 1 10 VAL H 2.800 . 3.360 2.201 2.024 2.508 . 0 0 "[ . 1]" 1
996 1 10 VAL H 1 71 SER HA 5.000 . 6.000 5.877 5.046 6.033 0.033 10 0 "[ . 1]" 1
997 1 55 VAL MG1 1 56 VAL H 2.800 . 3.360 2.122 2.096 2.158 . 0 0 "[ . 1]" 1
998 1 49 LEU HB2 1 56 VAL H 5.000 . 6.000 5.999 5.541 6.089 0.089 2 0 "[ . 1]" 1
999 1 48 VAL HB 1 56 VAL H 5.000 . 6.000 5.629 5.554 5.698 . 0 0 "[ . 1]" 1
1000 1 47 ASN HA 1 56 VAL H 5.000 . 6.000 4.297 4.138 4.541 . 0 0 "[ . 1]" 1
1001 1 55 VAL H 1 56 VAL H 5.000 . 6.000 3.846 3.820 3.866 . 0 0 "[ . 1]" 1
1002 1 47 ASN H 1 57 LEU QD 5.000 . 6.000 3.843 3.614 3.900 . 0 0 "[ . 1]" 1
1003 1 47 ASN H 1 57 LEU HG 5.000 . 6.000 6.027 5.961 6.053 0.053 5 0 "[ . 1]" 1
1004 1 29 GLY HA2 1 47 ASN H 5.000 . 6.000 6.028 5.959 6.054 0.054 8 0 "[ . 1]" 1
1005 1 34 ILE MG 1 37 LEU H 3.400 . 4.080 3.921 3.883 3.977 . 0 0 "[ . 1]" 1
1006 1 37 LEU H 1 37 LEU QB 2.800 . 3.360 1.990 1.978 2.005 . 0 0 "[ . 1]" 1
1007 1 35 ASN HB2 1 37 LEU H 5.000 . 6.000 5.064 4.944 5.633 . 0 0 "[ . 1]" 1
1008 1 36 GLU H 1 37 LEU H 2.800 . 3.360 2.008 1.977 2.058 . 0 0 "[ . 1]" 1
1009 1 35 ASN H 1 37 LEU H 5.000 . 6.000 3.999 3.931 4.078 . 0 0 "[ . 1]" 1
1010 1 33 SER H 1 37 LEU H 5.000 . 6.000 4.998 4.889 5.074 . 0 0 "[ . 1]" 1
1011 1 58 VAL H 1 60 LYS QG 5.200 . 6.200 6.340 6.262 6.390 0.190 9 0 "[ . 1]" 1
1012 1 15 LEU MD1 1 18 PHE H 5.000 . 6.000 4.161 3.743 4.647 . 0 0 "[ . 1]" 1
1013 1 18 PHE H 1 19 LEU HB3 5.000 . 6.000 5.529 5.068 5.943 . 0 0 "[ . 1]" 1
1014 1 18 PHE H 1 60 LYS HA 5.000 . 6.000 5.428 4.706 5.728 . 0 0 "[ . 1]" 1
1015 1 16 ARG HA 1 18 PHE H 5.500 . 6.600 4.240 3.717 5.180 . 0 0 "[ . 1]" 1
1016 1 15 LEU HA 1 18 PHE H 5.000 . 6.000 5.986 5.749 6.072 0.072 7 0 "[ . 1]" 1
1017 1 16 ARG H 1 18 PHE H 5.500 . 6.600 3.828 2.757 4.273 . 0 0 "[ . 1]" 1
1018 1 34 ILE MG 1 36 GLU H 3.400 . 4.080 4.193 4.174 4.233 0.153 8 0 "[ . 1]" 1
1019 1 36 GLU H 1 37 LEU QB 3.400 . 4.080 3.638 3.588 3.735 . 0 0 "[ . 1]" 1
1020 1 35 ASN QB 1 36 GLU H 3.400 . 4.080 3.017 2.920 3.053 . 0 0 "[ . 1]" 1
1021 1 32 LEU HA 1 36 GLU H 3.400 . 4.080 3.393 3.386 3.416 . 0 0 "[ . 1]" 1
1022 1 33 SER HA 1 36 GLU H 5.000 . 6.000 4.768 4.633 4.864 . 0 0 "[ . 1]" 1
1023 1 21 LEU QD 1 24 GLU H 3.400 . 4.080 3.672 3.593 3.808 . 0 0 "[ . 1]" 1
1024 1 24 GLU H 1 24 GLU HB3 2.800 . 3.360 2.576 2.519 2.606 . 0 0 "[ . 1]" 1
1025 1 34 ILE MG 1 39 ASN H 5.000 . 6.000 4.877 4.775 4.959 . 0 0 "[ . 1]" 1
1026 1 37 LEU HA 1 39 ASN H 3.400 . 4.080 3.111 2.898 3.346 . 0 0 "[ . 1]" 1
1027 1 36 GLU HA 1 39 ASN H 3.400 . 4.080 3.113 3.031 3.185 . 0 0 "[ . 1]" 1
1028 1 34 ILE MD 1 35 ASN H 3.400 . 4.080 2.900 2.840 2.964 . 0 0 "[ . 1]" 1
1029 1 68 LEU HB2 1 69 THR H 5.000 . 6.000 3.748 2.058 4.315 . 0 0 "[ . 1]" 1
1030 1 28 TYR H 1 57 LEU QD 5.000 . 6.000 4.511 4.309 4.595 . 0 0 "[ . 1]" 1
1031 1 27 ARG HA 1 28 TYR H 3.400 . 4.080 3.359 3.315 3.389 . 0 0 "[ . 1]" 1
1032 1 43 GLY H 1 60 LYS HD3 5.000 . 6.000 5.574 5.047 5.979 . 0 0 "[ . 1]" 1
1033 1 42 LYS HB2 1 43 GLY H 3.400 . 4.080 4.116 3.963 4.219 0.139 6 0 "[ . 1]" 1
1034 1 43 GLY H 1 60 LYS HB3 5.000 . 6.000 4.245 3.674 5.090 . 0 0 "[ . 1]" 1
1035 1 43 GLY H 1 59 MET HG2 5.000 . 6.000 5.992 5.829 6.055 0.055 6 0 "[ . 1]" 1
1036 1 42 LYS HA 1 43 GLY H 2.800 . 3.360 2.047 2.027 2.057 . 0 0 "[ . 1]" 1
1037 1 42 LYS H 1 43 GLY H 5.000 . 6.000 2.602 2.526 2.667 . 0 0 "[ . 1]" 1
1038 1 34 ILE MG 1 38 SER H 5.000 . 6.000 4.247 3.944 4.765 . 0 0 "[ . 1]" 1
1039 1 37 LEU HB3 1 38 SER H 5.000 . 6.000 3.029 2.879 3.238 . 0 0 "[ . 1]" 1
1040 1 37 LEU HA 1 38 SER H 2.800 . 3.360 2.331 2.217 2.506 . 0 0 "[ . 1]" 1
1041 1 37 LEU H 1 38 SER H 2.800 . 3.360 2.412 2.349 2.467 . 0 0 "[ . 1]" 1
1042 1 49 LEU QD 1 51 GLY H 3.400 . 4.080 4.120 4.040 4.187 0.107 2 0 "[ . 1]" 1
1043 1 49 LEU QD 1 53 GLY H 3.400 . 4.080 3.960 3.115 4.165 0.085 8 0 "[ . 1]" 1
1044 1 52 GLN HG2 1 53 GLY H 5.000 . 6.000 4.127 3.586 4.768 . 0 0 "[ . 1]" 1
1045 1 52 GLN HA 1 53 GLY H 2.800 . 3.360 2.350 2.096 2.638 . 0 0 "[ . 1]" 1
1046 1 27 ARG HG2 1 29 GLY H 5.000 . 6.000 5.671 5.456 6.002 0.002 7 0 "[ . 1]" 1
1047 1 26 ARG HG3 1 29 GLY H 5.000 . 6.000 5.474 5.284 6.039 0.039 5 0 "[ . 1]" 1
1048 1 29 GLY H 1 30 PRO QG 5.000 . 6.000 4.219 4.140 4.285 . 0 0 "[ . 1]" 1
1049 1 22 GLY H 1 45 LYS HD2 5.000 . 6.000 6.077 6.047 6.099 0.099 6 0 "[ . 1]" 1
1050 1 21 LEU HB3 1 22 GLY H 2.800 . 3.360 1.736 1.519 3.382 0.022 4 0 "[ . 1]" 1
1051 1 22 GLY H 1 58 VAL HA 5.000 . 6.000 4.636 4.420 5.555 . 0 0 "[ . 1]" 1
1052 1 22 GLY H 1 56 VAL H 6.000 . 7.200 6.631 6.490 7.206 0.006 4 0 "[ . 1]" 1
1053 1 75 THR HA 1 76 LYS H 5.000 . 6.000 2.812 2.601 2.989 . 0 0 "[ . 1]" 1
1054 1 24 GLU QG 1 47 ASN QD 5.500 . 6.600 5.785 5.516 6.047 . 0 0 "[ . 1]" 1
1055 1 28 TYR QB 1 47 ASN QD 5.000 . 6.000 2.156 1.821 3.498 . 0 0 "[ . 1]" 1
1056 1 36 GLU HA 1 39 ASN QD 5.000 . 6.000 2.793 1.689 4.055 . 0 0 "[ . 1]" 1
1057 1 36 GLU HA 1 39 ASN HD22 5.000 . 6.000 3.313 2.586 4.641 . 0 0 "[ . 1]" 1
1058 1 52 GLN HE21 1 52 GLN HG2 2.800 . 3.360 2.370 1.994 3.108 . 0 0 "[ . 1]" 1
1059 1 21 LEU MD1 1 24 GLU HB2 5.400 . 6.400 4.923 4.722 5.397 . 0 0 "[ . 1]" 1
1060 1 57 LEU HG 1 77 ARG HG2 4.400 . 5.280 5.330 5.315 5.345 0.065 5 0 "[ . 1]" 1
1061 1 37 LEU HA 1 40 LEU MD1 3.400 . 4.080 2.218 2.012 2.534 . 0 0 "[ . 1]" 1
1062 1 49 LEU MD1 1 53 GLY QA 5.000 . 6.000 5.049 4.144 5.439 . 0 0 "[ . 1]" 1
1063 1 49 LEU MD2 1 53 GLY QA 5.000 . 6.000 5.049 4.426 5.889 . 0 0 "[ . 1]" 1
1064 1 15 LEU QD 1 18 PHE HB3 5.000 . 6.000 2.621 2.180 2.950 . 0 0 "[ . 1]" 1
1065 1 15 LEU MD1 1 18 PHE HB3 5.000 . 6.000 2.687 2.237 2.964 . 0 0 "[ . 1]" 1
1066 1 40 LEU QB 1 44 GLU QB 5.000 . 6.000 3.472 3.348 3.550 . 0 0 "[ . 1]" 1
1067 1 31 ALA MB 1 47 ASN HA 5.500 . 6.000 6.020 5.997 6.034 0.034 8 0 "[ . 1]" 1
1068 1 40 LEU QD 1 42 LYS HA 5.000 . 6.000 5.661 5.444 5.785 . 0 0 "[ . 1]" 1
1069 1 45 LYS HD2 1 57 LEU QD . . 3.360 1.955 1.871 2.231 . 0 0 "[ . 1]" 1
1070 1 31 ALA MB 1 55 VAL MG1 . . 4.080 3.696 3.327 3.933 . 0 0 "[ . 1]" 1
1071 1 23 LYS QB 1 50 ILE MD 5.000 . 6.000 4.933 4.681 5.146 . 0 0 "[ . 1]" 1
1072 1 49 LEU QD 1 53 GLY QA 5.000 . 6.000 4.483 3.803 4.900 . 0 0 "[ . 1]" 1
1073 1 49 LEU MD1 1 51 GLY QA 5.000 . 6.000 4.467 3.988 4.602 . 0 0 "[ . 1]" 1
1074 1 20 ILE MD 1 22 GLY QA 5.000 . 6.000 3.680 3.469 3.861 . 0 0 "[ . 1]" 1
1075 1 49 LEU QD 1 51 GLY HA3 5.000 . 6.000 5.063 4.908 5.134 . 0 0 "[ . 1]" 1
1076 1 42 LYS HB2 1 43 GLY HA3 5.000 . 6.000 4.966 4.637 5.047 . 0 0 "[ . 1]" 1
1077 1 20 ILE MD 1 22 GLY HA3 5.000 . 6.000 4.745 4.557 5.075 . 0 0 "[ . 1]" 1
1078 1 19 LEU HB2 1 59 MET QB 5.000 . 6.000 1.887 1.685 2.325 . 0 0 "[ . 1]" 1
1079 1 19 LEU HB3 1 80 MET HB3 5.000 . 6.000 5.568 4.967 6.041 0.041 8 0 "[ . 1]" 1
1080 1 19 LEU HB3 1 78 ILE HB 5.000 . 6.000 3.146 2.798 3.508 . 0 0 "[ . 1]" 1
1081 1 45 LYS HD2 1 57 LEU HB3 5.000 . 6.000 5.330 5.252 5.375 . 0 0 "[ . 1]" 1
1082 1 40 LEU QB 1 46 ALA MB 3.400 . 4.080 3.775 3.615 3.929 . 0 0 "[ . 1]" 1
1083 1 49 LEU HB2 1 50 ILE H 5.000 . 6.000 3.360 2.851 3.611 . 0 0 "[ . 1]" 1
1084 1 48 VAL HA 1 49 LEU QB 5.000 . 6.000 4.446 4.205 4.515 . 0 0 "[ . 1]" 1
1085 1 49 LEU HB3 1 50 ILE H 5.000 . 6.000 3.288 3.053 3.512 . 0 0 "[ . 1]" 1
1086 1 48 VAL HA 1 49 LEU QB 5.000 . 6.000 4.777 4.642 4.814 . 0 0 "[ . 1]" 1
1087 1 77 ARG QD 1 78 ILE MG 5.000 . 6.000 5.280 4.848 5.873 . 0 0 "[ . 1]" 1
1088 1 36 GLU HA 1 60 LYS QE 5.500 . 6.600 5.700 3.151 6.405 . 0 0 "[ . 1]" 1
1089 1 15 LEU HG 1 60 LYS QE 5.200 . 6.200 5.927 5.061 6.475 0.275 4 0 "[ . 1]" 1
1090 1 41 ALA HA 1 42 LYS QE 5.000 . 6.000 6.218 5.763 6.743 0.743 7 2 "[ .-+ 1]" 1
1091 1 42 LYS HA 1 42 LYS QE 5.000 . 6.000 3.622 3.379 4.283 . 0 0 "[ . 1]" 1
1092 1 18 PHE HB3 1 58 VAL MG2 5.000 . 6.000 3.534 3.400 3.666 . 0 0 "[ . 1]" 1
1093 1 50 ILE MD 1 54 ASP HB2 5.000 . 6.000 2.868 1.814 3.657 . 0 0 "[ . 1]" 1
1094 1 54 ASP HB3 1 55 VAL H 5.000 . 6.000 3.964 3.466 4.418 . 0 0 "[ . 1]" 1
1095 1 50 ILE MD 1 54 ASP HB3 5.000 . 6.000 3.278 2.692 3.787 . 0 0 "[ . 1]" 1
1096 1 45 LYS QB 1 45 LYS HE3 3.400 . 4.080 1.955 1.909 1.984 . 0 0 "[ . 1]" 1
1097 1 45 LYS QB 1 45 LYS HE2 3.400 . 4.080 2.947 2.931 2.964 . 0 0 "[ . 1]" 1
1098 1 67 ILE MG 1 70 ASP QB 5.500 . 6.600 5.641 4.581 6.312 . 0 0 "[ . 1]" 1
1099 1 18 PHE QE 1 37 LEU HB2 5.000 . 6.000 3.528 3.416 3.774 . 0 0 "[ . 1]" 1
1100 1 18 PHE QE 1 37 LEU HB3 5.000 . 6.000 2.004 1.837 2.303 . 0 0 "[ . 1]" 1
1101 1 34 ILE MD 1 37 LEU HB3 5.000 . 6.000 3.367 3.160 3.686 . 0 0 "[ . 1]" 1
1102 1 29 GLY QA 1 47 ASN HB2 5.000 . 6.000 4.577 4.464 4.702 . 0 0 "[ . 1]" 1
1103 1 31 ALA MB 1 47 ASN HB2 5.000 . 6.000 3.930 3.795 4.023 . 0 0 "[ . 1]" 1
1104 1 47 ASN HB3 1 48 VAL HA 5.000 . 6.000 4.428 4.330 4.553 . 0 0 "[ . 1]" 1
1105 1 29 GLY HA2 1 47 ASN HB3 5.000 . 6.000 5.859 5.681 5.996 . 0 0 "[ . 1]" 1
1106 1 31 ALA MB 1 47 ASN HB3 5.000 . 6.000 4.371 4.218 4.570 . 0 0 "[ . 1]" 1
1107 1 19 LEU HB2 1 59 MET QB 3.400 . 4.080 1.889 1.687 2.331 . 0 0 "[ . 1]" 1
1108 1 45 LYS HD3 1 59 MET QB 5.000 . 6.000 3.765 3.177 4.079 . 0 0 "[ . 1]" 1
1109 1 59 MET QB 1 78 ILE MG 2.800 . 3.360 1.939 1.823 2.175 . 0 0 "[ . 1]" 1
1110 1 35 ASN QB 1 36 GLU H 5.000 . 6.000 3.013 2.916 3.050 . 0 0 "[ . 1]" 1
1111 1 35 ASN HB3 1 36 GLU H 5.000 . 6.000 3.100 3.002 3.138 . 0 0 "[ . 1]" 1
1112 1 35 ASN HB2 1 36 GLU QG 5.000 . 6.000 4.505 4.051 4.680 . 0 0 "[ . 1]" 1
1113 1 44 GLU HG2 1 45 LYS H 5.000 . 6.000 4.727 4.664 4.766 . 0 0 "[ . 1]" 1
1114 1 44 GLU HG2 1 82 ILE MG 5.500 . 6.000 5.831 5.550 6.022 0.022 9 0 "[ . 1]" 1
1115 1 44 GLU HG3 1 45 LYS H 5.000 . 6.000 4.539 4.486 4.579 . 0 0 "[ . 1]" 1
1116 1 40 LEU QD 1 44 GLU HG3 5.000 . 6.000 4.799 4.655 4.926 . 0 0 "[ . 1]" 1
1117 1 12 SER HA 1 58 VAL HB 5.000 . 6.000 5.881 5.703 6.013 0.013 3 0 "[ . 1]" 1
1118 1 11 GLU HG2 1 14 VAL MG2 5.000 . 6.000 5.630 5.051 5.959 . 0 0 "[ . 1]" 1
1119 1 11 GLU HG2 1 50 ILE MG 5.000 . 6.000 2.767 2.052 4.075 . 0 0 "[ . 1]" 1
1120 1 11 GLU HG3 1 20 ILE MG 5.000 . 6.000 4.624 2.986 5.480 . 0 0 "[ . 1]" 1
1121 1 11 GLU HG3 1 50 ILE MG 5.000 . 6.000 2.842 2.137 3.787 . 0 0 "[ . 1]" 1
1122 1 21 LEU MD1 1 24 GLU HG2 5.000 . 6.000 3.135 2.917 3.709 . 0 0 "[ . 1]" 1
1123 1 21 LEU MD1 1 24 GLU HG3 5.000 . 6.000 3.017 2.799 3.512 . 0 0 "[ . 1]" 1
1124 1 23 LYS HA 1 56 VAL HB 5.000 . 6.000 3.690 3.534 3.816 . 0 0 "[ . 1]" 1
1125 1 54 ASP HA 1 55 VAL HB 5.000 . 6.000 4.214 4.192 4.242 . 0 0 "[ . 1]" 1
1126 1 18 PHE HE2 1 60 LYS HB2 5.000 . 6.000 5.510 4.423 5.693 . 0 0 "[ . 1]" 1
1127 1 44 GLU HB2 1 45 LYS H 5.000 . 6.000 3.469 3.379 3.569 . 0 0 "[ . 1]" 1
1128 1 41 ALA MB 1 44 GLU HB2 5.000 . 6.000 3.128 3.047 3.235 . 0 0 "[ . 1]" 1
1129 1 40 LEU QD 1 44 GLU QB 5.000 . 6.000 3.432 3.329 3.540 . 0 0 "[ . 1]" 1
1130 1 44 GLU HB3 1 45 LYS H 5.000 . 6.000 2.217 2.197 2.241 . 0 0 "[ . 1]" 1
1131 1 41 ALA MB 1 44 GLU HB3 . . 4.080 4.040 3.968 4.103 0.023 7 0 "[ . 1]" 1
1132 1 61 ARG QB 1 63 ARG HA 3.400 . 4.080 4.136 4.091 4.198 0.118 7 0 "[ . 1]" 1
1133 1 61 ARG HB3 1 68 LEU MD2 5.000 . 6.000 3.467 1.692 4.289 . 0 0 "[ . 1]" 1
1134 1 21 LEU MD1 1 24 GLU HB2 5.000 . 6.000 5.040 4.811 5.613 . 0 0 "[ . 1]" 1
1135 1 45 LYS QG 1 59 MET QG 5.000 . 6.000 1.778 1.734 1.810 . 0 0 "[ . 1]" 1
1136 1 45 LYS HG2 1 59 MET HG2 5.000 . 6.000 2.749 2.666 3.021 . 0 0 "[ . 1]" 1
1137 1 19 LEU HB2 1 59 MET QG 5.000 . 6.000 3.458 2.964 4.053 . 0 0 "[ . 1]" 1
1138 1 19 LEU MD1 1 59 MET HG3 5.000 . 6.000 4.108 3.822 4.290 . 0 0 "[ . 1]" 1
1139 1 11 GLU QB 1 19 LEU MD2 5.000 . 6.000 3.993 3.547 4.931 . 0 0 "[ . 1]" 1
1140 1 20 ILE HG12 1 20 ILE MG 2.800 . 3.360 2.932 2.506 3.209 . 0 0 "[ . 1]" 1
1141 1 37 LEU HA 1 40 LEU HG 5.000 . 6.000 2.409 2.165 2.556 . 0 0 "[ . 1]" 1
1142 1 32 LEU HG 1 46 ALA MB 5.000 . 6.000 3.762 3.331 4.225 . 0 0 "[ . 1]" 1
1143 1 77 ARG HA 1 78 ILE HG13 5.000 . 6.000 4.507 3.989 5.343 . 0 0 "[ . 1]" 1
1144 1 19 LEU HG 1 79 ARG QD 5.000 . 6.000 5.481 5.225 5.803 . 0 0 "[ . 1]" 1
1145 1 49 LEU HG 1 50 ILE H 5.000 . 6.000 4.870 4.830 4.977 . 0 0 "[ . 1]" 1
1146 1 49 LEU HG 1 50 ILE HA 5.000 . 6.000 5.953 5.629 6.022 0.022 7 0 "[ . 1]" 1
1147 1 32 LEU MD2 1 37 LEU HG 5.000 . 6.000 5.302 4.848 5.471 . 0 0 "[ . 1]" 1
1148 1 37 LEU HG 1 48 VAL MG2 5.000 . 6.000 2.801 2.635 2.921 . 0 0 "[ . 1]" 1
1149 1 21 LEU MD1 1 59 MET HG3 5.200 . 6.240 4.595 3.918 4.853 . 0 0 "[ . 1]" 1
1150 1 21 LEU MD1 1 23 LYS HB3 5.500 . 6.600 6.536 6.456 6.652 0.052 4 0 "[ . 1]" 1
1151 1 21 LEU MD1 1 59 MET HB3 5.000 . 6.000 2.674 2.319 2.941 . 0 0 "[ . 1]" 1
1152 1 38 SER QB 1 40 LEU MD1 5.400 . 6.480 5.684 5.583 5.816 . 0 0 "[ . 1]" 1
1153 1 40 LEU MD1 1 58 VAL MG2 5.000 . 6.000 3.243 3.121 3.329 . 0 0 "[ . 1]" 1
1154 1 11 GLU HG2 1 15 LEU MD1 5.000 . 6.000 3.191 2.018 4.418 . 0 0 "[ . 1]" 1
1155 1 49 LEU MD1 1 50 ILE H 4.400 . 5.280 4.979 4.861 5.180 . 0 0 "[ . 1]" 1
1156 1 33 SER HB2 1 49 LEU MD1 5.000 . 6.000 6.044 6.008 6.065 0.065 4 0 "[ . 1]" 1
1157 1 49 LEU MD1 1 53 GLY HA2 5.000 . 6.000 5.305 4.249 5.740 . 0 0 "[ . 1]" 1
1158 1 49 LEU MD2 1 50 ILE H 3.400 . 4.080 3.908 3.793 4.069 . 0 0 "[ . 1]" 1
1159 1 33 SER HB2 1 49 LEU MD1 5.000 . 6.000 5.542 4.918 5.673 . 0 0 "[ . 1]" 1
1160 1 19 LEU MD1 1 80 MET HA 5.000 . 6.000 4.974 4.484 5.419 . 0 0 "[ . 1]" 1
1161 1 19 LEU MD1 1 59 MET QB 5.000 . 6.000 2.129 1.871 2.259 . 0 0 "[ . 1]" 1
1162 1 22 GLY HA2 1 23 LYS QG 5.000 . 6.000 3.653 3.560 3.717 . 0 0 "[ . 1]" 1
1163 1 23 LYS HA 1 57 LEU QD 5.000 . 6.000 2.942 2.626 3.043 . 0 0 "[ . 1]" 1
1164 1 46 ALA MB 1 47 ASN HA 5.000 . 6.000 4.430 4.420 4.436 . 0 0 "[ . 1]" 1
1165 1 44 GLU HG2 1 46 ALA MB 5.000 . 6.000 5.525 5.506 5.545 . 0 0 "[ . 1]" 1
1166 1 32 LEU HG 1 46 ALA MB 5.000 . 6.000 3.743 3.325 4.182 . 0 0 "[ . 1]" 1
1167 1 32 LEU HB2 1 46 ALA MB 5.000 . 6.000 5.055 4.777 5.234 . 0 0 "[ . 1]" 1
1168 1 32 LEU MD2 1 46 ALA MB 2.800 . 3.360 2.104 1.936 2.222 . 0 0 "[ . 1]" 1
1169 1 46 ALA MB 1 48 VAL MG2 3.400 . 4.080 3.715 3.503 3.872 . 0 0 "[ . 1]" 1
1170 1 40 LEU MD2 1 46 ALA MB 2.800 . 3.360 2.139 1.946 2.248 . 0 0 "[ . 1]" 1
1171 1 40 LEU MD2 1 48 VAL MG2 5.000 . 6.000 4.720 4.486 4.840 . 0 0 "[ . 1]" 1
1172 1 24 GLU H 1 55 VAL MG1 5.000 . 6.000 5.385 5.077 5.706 . 0 0 "[ . 1]" 1
1173 1 47 ASN HA 1 55 VAL MG1 5.000 . 6.000 3.673 3.556 3.842 . 0 0 "[ . 1]" 1
1174 1 24 GLU HA 1 55 VAL MG1 5.500 . 6.600 6.250 5.903 6.613 0.013 4 0 "[ . 1]" 1
1175 1 49 LEU HG 1 55 VAL MG1 5.000 . 6.000 5.067 4.410 5.978 . 0 0 "[ . 1]" 1
1176 1 15 LEU MD2 1 34 ILE HG12 5.000 . 6.000 3.301 2.418 4.234 . 0 0 "[ . 1]" 1
1177 1 35 ASN HA 1 37 LEU MD2 5.000 . 6.000 6.043 5.901 6.089 0.089 9 0 "[ . 1]" 1
1178 1 31 ALA H 1 48 VAL MG2 5.000 . 6.000 4.118 4.041 4.193 . 0 0 "[ . 1]" 1
1179 1 48 VAL MG2 1 50 ILE HA 5.000 . 6.000 4.761 4.218 5.159 . 0 0 "[ . 1]" 1
1180 1 37 LEU HA 1 48 VAL MG2 5.000 . 6.000 5.611 5.525 5.743 . 0 0 "[ . 1]" 1
1181 1 48 VAL MG2 1 56 VAL HB 5.000 . 6.000 5.366 5.112 5.621 . 0 0 "[ . 1]" 1
1182 1 21 LEU HA 1 21 LEU MD2 2.800 . 3.360 2.042 1.873 3.382 0.022 4 0 "[ . 1]" 1
1183 1 21 LEU MD2 1 59 MET QB 3.400 . 4.080 2.598 2.282 2.837 . 0 0 "[ . 1]" 1
1184 1 24 GLU H 1 56 VAL MG1 5.000 . 6.000 4.373 4.252 4.606 . 0 0 "[ . 1]" 1
1185 1 54 ASP HA 1 55 VAL MG2 5.000 . 6.000 3.699 3.581 3.849 . 0 0 "[ . 1]" 1
1186 1 49 LEU HB3 1 55 VAL MG2 5.000 . 6.000 3.427 2.889 3.710 . 0 0 "[ . 1]" 1
1187 1 54 ASP HB2 1 75 THR MG 5.500 . 6.600 6.527 6.114 6.635 0.035 10 0 "[ . 1]" 1
1188 1 72 GLN HB2 1 75 THR MG 5.000 . 6.000 5.519 4.341 6.029 0.029 9 0 "[ . 1]" 1
1189 1 75 THR MG 1 76 LYS QB 5.000 . 6.000 4.937 4.475 5.261 . 0 0 "[ . 1]" 1
1190 1 23 LYS QD 1 75 THR MG 3.400 . 4.080 4.038 3.637 4.100 0.020 10 0 "[ . 1]" 1
1191 1 23 LYS QG 1 75 THR MG 3.400 . 4.080 3.347 3.081 3.750 . 0 0 "[ . 1]" 1
1192 1 72 GLN QB 1 73 THR MG 5.000 . 6.000 5.191 5.112 5.335 . 0 0 "[ . 1]" 1
1193 1 73 THR MG 1 79 ARG QG 3.400 . 4.080 4.061 3.842 4.117 0.037 9 0 "[ . 1]" 1
1194 1 14 VAL H 1 14 VAL MG1 2.800 . 3.360 2.253 2.217 2.322 . 0 0 "[ . 1]" 1
1195 1 13 ALA HA 1 14 VAL MG1 5.000 . 6.000 5.146 5.003 5.250 . 0 0 "[ . 1]" 1
1196 1 14 VAL H 1 14 VAL MG2 3.400 . 4.080 1.640 1.592 1.689 . 0 0 "[ . 1]" 1
1197 1 14 VAL HA 1 14 VAL MG2 2.800 . 3.360 3.204 3.198 3.207 . 0 0 "[ . 1]" 1
1198 1 31 ALA H 1 48 VAL MG1 5.000 . 6.000 4.183 3.993 4.375 . 0 0 "[ . 1]" 1
1199 1 47 ASN HA 1 48 VAL MG1 . . 4.080 4.083 4.027 4.107 0.027 8 0 "[ . 1]" 1
1200 1 41 ALA MB 1 44 GLU H 5.000 . 6.000 4.226 4.171 4.258 . 0 0 "[ . 1]" 1
1201 1 41 ALA MB 1 44 GLU QB 3.400 . 4.080 3.030 2.958 3.127 . 0 0 "[ . 1]" 1
1202 1 10 VAL MG1 1 11 GLU HG3 5.000 . 6.000 5.069 4.385 5.926 . 0 0 "[ . 1]" 1
1203 1 37 LEU HG 1 58 VAL MG2 3.400 . 4.080 2.826 2.647 2.957 . 0 0 "[ . 1]" 1
1204 1 13 ALA MB 1 14 VAL H 3.400 . 4.080 2.200 2.164 2.233 . 0 0 "[ . 1]" 1
1205 1 13 ALA MB 1 67 ILE HB 5.000 . 6.000 5.489 4.561 6.016 0.016 7 0 "[ . 1]" 1
1206 1 13 ALA MB 1 15 LEU QB 5.000 . 6.000 5.308 5.114 5.411 . 0 0 "[ . 1]" 1
1207 1 20 ILE HB 1 56 VAL MG2 5.000 . 6.000 4.270 4.015 4.869 . 0 0 "[ . 1]" 1
1208 1 49 LEU HG 1 56 VAL QG 5.000 . 6.000 3.689 3.418 4.095 . 0 0 "[ . 1]" 1
1209 1 48 VAL HB 1 50 ILE MG 5.500 . 6.600 4.611 4.114 5.219 . 0 0 "[ . 1]" 1
1210 1 34 ILE QG 1 50 ILE QG 5.000 . 6.000 4.909 4.286 5.362 . 0 0 "[ . 1]" 1
1211 1 11 GLU HG2 1 20 ILE MG 3.400 . 4.080 3.990 3.669 4.118 0.038 1 0 "[ . 1]" 1
1212 1 20 ILE MG 1 78 ILE HB 5.000 . 6.000 5.928 5.706 6.084 0.084 10 0 "[ . 1]" 1
1213 1 59 MET ME 1 62 LYS HA 5.000 . 6.000 4.199 3.717 4.921 . 0 0 "[ . 1]" 1
1214 1 59 MET ME 1 62 LYS QE 5.000 . 6.000 5.412 4.473 5.854 . 0 0 "[ . 1]" 1
1215 1 59 MET ME 1 60 LYS QB 3.400 . 4.080 3.350 3.060 3.836 . 0 0 "[ . 1]" 1
1216 1 19 LEU MD1 1 59 MET ME 2.800 . 3.360 3.184 3.099 3.272 . 0 0 "[ . 1]" 1
1217 1 59 MET ME 1 60 LYS QG 2.800 . 3.360 2.913 2.807 3.053 . 0 0 "[ . 1]" 1
1218 1 11 GLU HG2 1 20 ILE MD 5.000 . 6.000 2.941 2.220 3.379 . 0 0 "[ . 1]" 1
1219 1 33 SER HB3 1 36 GLU QB 5.000 . 6.000 2.270 1.995 2.605 . 0 0 "[ . 1]" 1
1220 1 33 SER HB2 1 36 GLU QB 5.000 . 6.000 3.586 3.323 3.803 . 0 0 "[ . 1]" 1
1221 1 34 ILE HA 1 34 ILE HG13 3.400 . 4.080 2.410 2.389 2.446 . 0 0 "[ . 1]" 1
1222 1 34 ILE HA 1 34 ILE MD 2.800 . 3.360 2.232 2.189 2.268 . 0 0 "[ . 1]" 1
1223 1 12 SER QB 1 15 LEU QB 5.000 . 6.000 3.749 3.523 4.138 . 0 0 "[ . 1]" 1
1224 1 12 SER HB3 1 19 LEU MD2 5.000 . 6.000 4.346 4.121 4.749 . 0 0 "[ . 1]" 1
1225 1 12 SER QB 1 67 ILE MD 5.000 . 6.000 5.494 4.770 5.766 . 0 0 "[ . 1]" 1
1226 1 75 THR HA 1 76 LYS QB 5.000 . 6.000 5.363 4.950 5.512 . 0 0 "[ . 1]" 1
1227 1 73 THR HA 1 73 THR MG 2.800 . 3.360 3.208 3.205 3.210 . 0 0 "[ . 1]" 1
1228 1 20 ILE MG 1 73 THR HA 5.000 . 6.000 5.821 4.838 6.039 0.039 4 0 "[ . 1]" 1
1229 1 67 ILE HA 1 68 LEU HG 5.000 . 6.000 5.460 4.013 6.036 0.036 4 0 "[ . 1]" 1
1230 1 50 ILE HA 1 50 ILE MD 2.800 . 3.360 2.226 2.190 2.292 . 0 0 "[ . 1]" 1
1231 1 12 SER HA 1 15 LEU H 5.000 . 6.000 3.548 3.432 3.729 . 0 0 "[ . 1]" 1
1232 1 12 SER HA 1 68 LEU QB 5.000 . 6.000 5.727 5.509 5.906 . 0 0 "[ . 1]" 1
1233 1 12 SER HA 1 15 LEU MD1 5.000 . 6.000 2.571 1.725 3.339 . 0 0 "[ . 1]" 1
1234 1 71 SER HA 1 74 ALA MB 5.500 . 6.600 6.064 5.907 6.147 . 0 0 "[ . 1]" 1
1235 1 65 SER HA 1 68 LEU HG 5.000 . 6.000 5.074 4.244 5.789 . 0 0 "[ . 1]" 1
1236 1 65 SER HA 1 67 ILE MG 5.400 . 6.000 6.024 5.857 6.149 0.149 3 0 "[ . 1]" 1
1237 1 42 LYS HA 1 44 GLU H 5.000 . 6.000 2.977 2.897 3.105 . 0 0 "[ . 1]" 1
1238 1 42 LYS HA 1 60 LYS HB3 5.000 . 6.000 3.084 2.630 4.445 . 0 0 "[ . 1]" 1
1239 1 16 ARG HA 1 17 GLY H 5.000 . 6.000 2.603 2.187 3.552 . 0 0 "[ . 1]" 1
1240 1 11 GLU HA 1 20 ILE QG 5.000 . 6.000 4.956 4.485 5.338 . 0 0 "[ . 1]" 1
1241 1 61 ARG HA 1 82 ILE MG 5.000 . 7.000 5.823 4.352 7.234 0.234 1 0 "[ . 1]" 1
1242 1 18 PHE QE 1 37 LEU HA 5.000 . 6.000 3.493 3.361 3.756 . 0 0 "[ . 1]" 1
1243 1 49 LEU QD 1 52 GLN HA 5.000 . 6.000 3.850 2.367 5.970 . 0 0 "[ . 1]" 1
1244 1 42 LYS QG 1 62 LYS HA 3.400 . 4.080 3.296 1.871 4.005 . 0 0 "[ . 1]" 1
1245 1 35 ASN HB2 1 36 GLU HA 5.000 . 6.000 3.799 3.360 5.067 . 0 0 "[ . 1]" 1
1246 1 32 LEU MD2 1 36 GLU HA 5.000 . 6.000 4.431 4.213 5.258 . 0 0 "[ . 1]" 1
1247 1 22 GLY HA2 1 23 LYS HA 5.000 . 6.000 3.869 3.854 3.877 . 0 0 "[ . 1]" 1
1248 1 74 ALA MB 1 79 ARG HA 5.000 . 6.000 3.831 3.363 4.360 . 0 0 "[ . 1]" 1
1249 1 78 ILE MG 1 79 ARG HA 5.000 . 6.000 5.566 5.452 5.640 . 0 0 "[ . 1]" 1
1250 1 40 LEU HA 1 44 GLU HB3 5.000 . 6.000 6.027 6.012 6.039 0.039 6 0 "[ . 1]" 1
1251 1 35 ASN HA 1 36 GLU H 5.000 . 6.000 3.276 3.249 3.337 . 0 0 "[ . 1]" 1
1252 1 21 LEU HA 1 21 LEU HB3 2.800 . 3.360 2.809 2.258 2.877 . 0 0 "[ . 1]" 1
1253 1 45 LYS HA 1 59 MET QB 5.000 . 6.000 4.791 4.647 4.849 . 0 0 "[ . 1]" 1
1254 1 13 ALA HA 1 14 VAL H 3.400 . 4.080 3.463 3.438 3.491 . 0 0 "[ . 1]" 1
1255 1 13 ALA HA 1 67 ILE HB 5.000 . 6.000 4.691 3.965 5.861 . 0 0 "[ . 1]" 1
1256 1 13 ALA HA 1 15 LEU QB 5.000 . 6.000 5.074 4.907 5.276 . 0 0 "[ . 1]" 1
1257 1 10 VAL QG 1 13 ALA HA 5.000 . 6.000 4.269 4.188 4.324 . 0 0 "[ . 1]" 1
1258 1 74 ALA HA 1 79 ARG QB 5.000 . 6.000 5.113 4.415 5.911 . 0 0 "[ . 1]" 1
1259 1 31 ALA H 1 47 ASN HA 5.000 . 6.000 4.892 4.755 5.011 . 0 0 "[ . 1]" 1
1260 1 47 ASN HA 1 48 VAL HA 3.600 . 4.280 4.340 4.331 4.347 0.067 1 0 "[ . 1]" 1
1261 1 47 ASN HA 1 48 VAL MG2 5.000 . 6.000 2.968 2.632 3.033 . 0 0 "[ . 1]" 1
1262 1 46 ALA HA 1 57 LEU QD 5.000 . 6.000 3.863 3.749 3.915 . 0 0 "[ . 1]" 1
1263 1 32 LEU QD 1 46 ALA HA 5.000 . 6.000 3.772 3.566 3.928 . 0 0 "[ . 1]" 1
1264 1 29 GLY HA2 1 30 PRO HD2 3.400 . 4.080 2.935 2.898 2.979 . 0 0 "[ . 1]" 1
1265 1 29 GLY HA2 1 30 PRO HD3 3.400 . 4.080 2.969 2.935 3.006 . 0 0 "[ . 1]" 1
1266 1 20 ILE HA 1 58 VAL MG1 . . 3.360 3.206 2.894 3.378 0.018 10 0 "[ . 1]" 1
1267 1 19 LEU QB 1 58 VAL MG1 3.400 . 4.080 4.154 4.089 4.214 0.134 8 0 "[ . 1]" 1
1268 1 24 GLU HG3 1 25 ASP HB3 2.800 . 3.360 3.388 3.382 3.410 0.050 4 0 "[ . 1]" 1
1269 1 25 ASP HB3 1 57 LEU QD 5.000 . 6.000 1.906 1.756 1.975 . 0 0 "[ . 1]" 1
1270 1 34 ILE HB 1 35 ASN HA 5.000 . 6.000 4.477 4.413 4.504 . 0 0 "[ . 1]" 1
1271 1 34 ILE MD 1 37 LEU HB2 5.000 . 6.000 2.904 2.841 2.985 . 0 0 "[ . 1]" 1
1272 1 37 LEU HA 1 40 LEU MD2 5.000 . 6.000 3.672 3.531 3.750 . 0 0 "[ . 1]" 1
1273 1 40 LEU QD 1 41 ALA HA 5.000 . 6.000 4.037 3.918 4.077 . 0 0 "[ . 1]" 1
1274 1 42 LYS HB2 1 43 GLY HA2 5.000 . 6.000 5.313 5.009 5.408 . 0 0 "[ . 1]" 1
1275 1 40 LEU MD1 1 44 GLU QB 5.000 . 6.000 4.402 4.111 4.654 . 0 0 "[ . 1]" 1
1276 1 45 LYS HG2 1 46 ALA H 5.000 . 6.000 3.491 3.395 3.562 . 0 0 "[ . 1]" 1
1277 1 47 ASN HA 1 48 VAL MG2 5.000 . 6.000 3.434 3.311 3.525 . 0 0 "[ . 1]" 1
1278 1 56 VAL MG2 1 58 VAL HA 5.000 . 6.000 4.799 4.568 5.073 . 0 0 "[ . 1]" 1
1279 1 45 LYS HB2 1 59 MET HA 5.000 . 6.000 3.205 2.925 3.544 . 0 0 "[ . 1]" 1
1280 1 59 MET H 1 60 LYS QB 5.000 . 6.000 5.918 5.232 6.045 0.045 3 0 "[ . 1]" 1
1281 1 61 ARG QG 1 68 LEU MD2 2.800 . 3.360 3.004 1.813 3.415 0.055 3 0 "[ . 1]" 1
1282 1 66 SER QB 1 67 ILE MD 5.000 . 6.000 2.595 2.297 3.046 . 0 0 "[ . 1]" 1
1283 1 59 MET ME 1 68 LEU MD1 . . 4.080 3.809 3.579 3.936 . 0 0 "[ . 1]" 1
1284 1 73 THR MG 1 74 ALA HA 5.000 . 6.000 3.568 3.262 4.039 . 0 0 "[ . 1]" 1
1285 1 75 THR HA 1 78 ILE MG 5.000 . 6.000 6.049 6.021 6.066 0.066 1 0 "[ . 1]" 1
1286 1 14 VAL H 1 14 VAL HB 3.400 . 4.080 3.134 3.114 3.154 . 0 0 "[ . 1]" 1
1287 1 47 ASN HB2 1 48 VAL HA 5.000 . 6.000 4.854 4.759 4.908 . 0 0 "[ . 1]" 1
1288 1 47 ASN HA 1 48 VAL HB 5.000 . 6.000 5.697 5.635 5.733 . 0 0 "[ . 1]" 1
1289 1 82 ILE HA 1 82 ILE MD 3.400 . 4.080 2.285 1.939 2.844 . 0 0 "[ . 1]" 1
1290 1 49 LEU QD 1 53 GLY HA2 5.000 . 6.000 4.697 3.906 5.152 . 0 0 "[ . 1]" 1
1291 1 49 LEU QD 1 51 GLY HA2 5.000 . 6.000 4.870 4.192 5.070 . 0 0 "[ . 1]" 1
1292 1 20 ILE MD 1 22 GLY HA2 5.000 . 6.000 3.835 3.593 4.003 . 0 0 "[ . 1]" 1
1293 1 9 GLY QA 1 58 VAL MG1 5.000 . 6.000 6.031 5.948 6.067 0.067 2 0 "[ . 1]" 1
1294 1 49 LEU QD 1 53 GLY HA3 5.000 . 6.000 4.827 4.278 5.409 . 0 0 "[ . 1]" 1
1295 1 20 ILE MG 1 22 GLY HA3 5.000 . 6.000 4.820 4.607 5.248 . 0 0 "[ . 1]" 1
1296 1 19 LEU QB 1 80 MET HB2 6.000 . 7.200 5.338 4.663 5.785 . 0 0 "[ . 1]" 1
1297 1 19 LEU QB 1 78 ILE HB 5.000 . 6.000 3.081 2.756 3.426 . 0 0 "[ . 1]" 1
1298 1 40 LEU QB 1 58 VAL HB 5.500 . 6.600 5.984 5.910 6.217 . 0 0 "[ . 1]" 1
1299 1 48 VAL HA 1 49 LEU HB2 5.000 . 6.000 5.402 5.276 5.680 . 0 0 "[ . 1]" 1
1300 1 42 LYS QE 1 68 LEU QB 4.800 . 5.760 5.809 5.772 5.888 0.128 5 0 "[ . 1]" 1
1301 1 38 SER HA 1 60 LYS QE 5.000 . 6.000 5.791 3.154 6.526 0.526 4 2 "[ +. - 1]" 1
1302 1 29 GLY HA2 1 47 ASN HB2 5.000 . 6.000 4.712 4.592 4.844 . 0 0 "[ . 1]" 1
1303 1 47 ASN HB3 1 48 VAL HA 5.000 . 6.000 4.043 3.987 4.094 . 0 0 "[ . 1]" 1
1304 1 31 ALA MB 1 47 ASN QB 5.000 . 6.000 3.659 3.565 3.702 . 0 0 "[ . 1]" 1
1305 1 47 ASN HB3 1 55 VAL MG1 5.000 . 6.000 2.148 2.020 2.327 . 0 0 "[ . 1]" 1
1306 1 19 LEU HB2 1 59 MET QB 3.400 . 4.080 1.886 1.686 2.327 . 0 0 "[ . 1]" 1
1307 1 45 LYS HD3 1 59 MET QB 5.000 . 6.000 3.711 3.174 3.996 . 0 0 "[ . 1]" 1
1308 1 35 ASN HB2 1 36 GLU H 5.000 . 6.000 4.101 3.960 4.146 . 0 0 "[ . 1]" 1
1309 1 11 GLU HG2 1 14 VAL MG2 5.000 . 6.000 5.603 5.033 5.926 . 0 0 "[ . 1]" 1
1310 1 11 GLU HG2 1 21 LEU MD2 5.000 . 6.000 2.766 2.052 4.069 . 0 0 "[ . 1]" 1
1311 1 11 GLU HG3 1 19 LEU MD2 5.000 . 6.000 4.598 2.985 5.452 . 0 0 "[ . 1]" 1
1312 1 32 LEU QD 1 48 VAL HB 3.400 . 4.080 4.016 3.860 4.096 0.016 2 0 "[ . 1]" 1
1313 1 21 LEU MD1 1 24 GLU HG3 5.000 . 6.000 3.018 2.800 3.517 . 0 0 "[ . 1]" 1
1314 1 18 PHE QE 1 60 LYS HB2 5.000 . 6.000 5.422 4.315 5.606 . 0 0 "[ . 1]" 1
1315 1 21 LEU MD1 1 24 GLU HB3 5.000 . 6.000 5.064 4.818 5.668 . 0 0 "[ . 1]" 1
1316 1 17 GLY QA 1 61 ARG QB 5.000 . 6.000 5.373 4.580 6.022 0.022 10 0 "[ . 1]" 1
1317 1 61 ARG QB 1 61 ARG HD3 3.400 . 4.080 2.736 2.288 3.468 . 0 0 "[ . 1]" 1
1318 1 61 ARG QB 1 68 LEU MD2 5.000 . 6.000 3.238 1.686 4.089 . 0 0 "[ . 1]" 1
1319 1 21 LEU MD1 1 24 GLU QB 5.000 . 6.000 4.501 4.289 5.025 . 0 0 "[ . 1]" 1
1320 1 45 LYS HG3 1 59 MET HG2 5.000 . 6.000 1.818 1.770 1.854 . 0 0 "[ . 1]" 1
1321 1 21 LEU QB 1 59 MET HG3 5.000 . 6.000 3.384 2.947 3.829 . 0 0 "[ . 1]" 1
1322 1 19 LEU MD1 1 59 MET HG3 5.000 . 6.000 4.054 3.792 4.199 . 0 0 "[ . 1]" 1
1323 1 21 LEU MD2 1 59 MET HG3 5.000 . 6.000 1.935 1.735 2.290 . 0 0 "[ . 1]" 1
1324 1 11 GLU QB 1 19 LEU MD2 5.000 . 6.000 4.051 3.553 5.243 . 0 0 "[ . 1]" 1
1325 1 61 ARG HG2 1 68 LEU MD2 5.000 . 6.000 3.189 1.930 3.999 . 0 0 "[ . 1]" 1
1326 1 34 ILE HG12 1 35 ASN HA 5.400 . 6.400 6.470 6.454 6.490 0.090 3 0 "[ . 1]" 1
1327 1 20 ILE HG13 1 20 ILE MG 2.800 . 3.360 2.695 2.329 3.198 . 0 0 "[ . 1]" 1
1328 1 31 ALA H 1 49 LEU HG 5.000 . 6.000 4.808 4.751 4.947 . 0 0 "[ . 1]" 1
1329 1 21 LEU HG 1 58 VAL HA 5.000 . 6.000 4.540 3.742 4.745 . 0 0 "[ . 1]" 1
1330 1 45 LYS QD 1 57 LEU HG 3.800 . 4.560 3.872 3.789 3.956 . 0 0 "[ . 1]" 1
1331 1 32 LEU QD 1 37 LEU HG 5.000 . 6.000 3.869 3.778 3.932 . 0 0 "[ . 1]" 1
1332 1 32 LEU MD1 1 60 LYS QE 5.000 . 6.000 5.673 5.317 6.115 0.115 1 0 "[ . 1]" 1
1333 1 21 LEU MD1 1 25 ASP QB 3.400 . 4.080 3.343 3.215 3.685 . 0 0 "[ . 1]" 1
1334 1 21 LEU MD1 1 59 MET HB2 4.400 . 5.280 5.078 4.577 5.287 0.007 7 0 "[ . 1]" 1
1335 1 21 LEU MD1 1 45 LYS HD2 2.800 . 3.360 3.211 2.544 3.369 0.009 5 0 "[ . 1]" 1
1336 1 40 LEU MD1 1 48 VAL MG2 5.000 . 6.000 3.167 3.056 3.255 . 0 0 "[ . 1]" 1
1337 1 34 ILE MD 1 37 LEU MD1 2.800 . 3.360 3.443 3.424 3.460 0.100 6 0 "[ . 1]" 1
1338 1 19 LEU MD1 1 61 ARG HA 5.000 . 6.000 3.981 2.670 4.618 . 0 0 "[ . 1]" 1
1339 1 19 LEU MD1 1 59 MET QB 5.000 . 6.000 2.129 1.871 2.259 . 0 0 "[ . 1]" 1
1340 1 46 ALA MB 1 47 ASN HA 5.000 . 6.000 4.285 4.250 4.301 . 0 0 "[ . 1]" 1
1341 1 30 PRO QG 1 46 ALA MB 5.000 . 6.000 2.900 2.802 2.991 . 0 0 "[ . 1]" 1
1342 1 46 ALA MB 1 48 VAL MG2 3.400 . 4.080 2.654 2.418 2.794 . 0 0 "[ . 1]" 1
1343 1 40 LEU MD2 1 44 GLU QB 4.400 . 5.280 3.585 3.494 3.719 . 0 0 "[ . 1]" 1
1344 1 24 GLU H 1 55 VAL QG 5.000 . 6.000 5.271 4.981 5.559 . 0 0 "[ . 1]" 1
1345 1 15 LEU MD2 1 34 ILE HG12 5.000 . 6.000 3.294 2.418 4.220 . 0 0 "[ . 1]" 1
1346 1 35 ASN HA 1 37 LEU QD 5.000 . 6.000 5.512 5.380 5.604 . 0 0 "[ . 1]" 1
1347 1 32 LEU QD 1 37 LEU MD2 2.800 . 3.360 3.496 3.445 3.564 0.204 4 0 "[ . 1]" 1
1348 1 48 VAL MG2 1 56 VAL H 5.000 . 6.000 4.192 4.105 4.290 . 0 0 "[ . 1]" 1
1349 1 46 ALA MB 1 48 VAL QG 3.400 . 4.080 2.891 2.730 3.063 . 0 0 "[ . 1]" 1
1350 1 54 ASP QB 1 75 THR MG 5.500 . 6.600 5.546 5.134 6.088 . 0 0 "[ . 1]" 1
1351 1 72 GLN QB 1 75 THR MG 5.000 . 6.000 5.276 4.160 5.778 . 0 0 "[ . 1]" 1
1352 1 14 VAL H 1 14 VAL MG1 2.800 . 3.360 2.238 2.205 2.303 . 0 0 "[ . 1]" 1
1353 1 13 ALA MB 1 14 VAL QG 3.400 . 4.080 2.945 2.792 3.066 . 0 0 "[ . 1]" 1
1354 1 41 ALA MB 1 44 GLU H 5.000 . 6.000 4.210 4.165 4.239 . 0 0 "[ . 1]" 1
1355 1 29 GLY QA 1 31 ALA MB 3.800 . 4.560 4.186 4.143 4.233 . 0 0 "[ . 1]" 1
1356 1 37 LEU HB3 1 58 VAL MG2 3.400 . 4.080 2.799 2.624 2.923 . 0 0 "[ . 1]" 1
1357 1 50 ILE HB 1 56 VAL MG2 5.000 . 6.000 4.328 4.057 4.984 . 0 0 "[ . 1]" 1
1358 1 49 LEU HG 1 56 VAL MG2 5.000 . 6.000 3.869 3.595 4.274 . 0 0 "[ . 1]" 1
1359 1 34 ILE QG 1 50 ILE MG 5.500 . 6.600 5.165 4.461 5.715 . 0 0 "[ . 1]" 1
1360 1 11 GLU HG2 1 20 ILE MG 3.400 . 4.080 3.962 3.656 4.102 0.022 1 0 "[ . 1]" 1
1361 1 42 LYS QE 1 59 MET ME 5.000 . 6.000 5.136 4.752 5.331 . 0 0 "[ . 1]" 1
1362 1 45 LYS HE2 1 59 MET ME 5.000 . 6.000 3.664 3.411 3.905 . 0 0 "[ . 1]" 1
1363 1 19 LEU MD1 1 59 MET ME 4.000 . 4.800 2.560 2.120 2.994 . 0 0 "[ . 1]" 1
1364 1 34 ILE MD 1 48 VAL MG1 3.400 . 4.080 2.678 2.397 2.952 . 0 0 "[ . 1]" 1
1365 1 33 SER HB3 1 36 GLU QB 5.000 . 6.000 2.227 1.959 2.593 . 0 0 "[ . 1]" 1
1366 1 12 SER HB3 1 15 LEU QB 5.000 . 6.000 4.391 3.792 4.780 . 0 0 "[ . 1]" 1
1367 1 12 SER HB3 1 19 LEU MD2 5.000 . 6.000 4.171 3.951 4.450 . 0 0 "[ . 1]" 1
1368 1 12 SER HB2 1 15 LEU QB 5.000 . 6.000 4.191 3.712 4.973 . 0 0 "[ . 1]" 1
1369 1 12 SER HB2 1 67 ILE MD 5.000 . 6.000 5.827 5.057 6.044 0.044 7 0 "[ . 1]" 1
1370 1 75 THR HA 1 76 LYS QB 5.000 . 6.000 5.128 4.827 5.249 . 0 0 "[ . 1]" 1
1371 1 12 SER HA 1 15 LEU H 5.000 . 6.000 3.547 3.431 3.727 . 0 0 "[ . 1]" 1
1372 1 12 SER HA 1 20 ILE QG 5.000 . 6.000 4.877 3.846 5.516 . 0 0 "[ . 1]" 1
1373 1 27 ARG HA 1 27 ARG HB3 2.800 . 3.360 2.357 2.301 2.394 . 0 0 "[ . 1]" 1
1374 1 11 GLU HA 1 19 LEU MD2 5.000 . 6.000 6.003 5.647 6.105 0.105 10 0 "[ . 1]" 1
1375 1 19 LEU MD1 1 61 ARG HA 5.000 . 6.000 2.182 1.768 3.260 . 0 0 "[ . 1]" 1
1376 1 21 LEU MD1 1 24 GLU HA 5.000 . 6.000 5.519 5.407 5.815 . 0 0 "[ . 1]" 1
1377 1 34 ILE QG 1 37 LEU HA 4.400 . 5.280 4.994 4.906 5.117 . 0 0 "[ . 1]" 1
1378 1 42 LYS QG 1 62 LYS HA 3.400 . 4.080 3.366 1.871 4.116 0.036 1 0 "[ . 1]" 1
1379 1 32 LEU MD2 1 36 GLU HA 5.000 . 6.000 4.474 4.239 5.389 . 0 0 "[ . 1]" 1
1380 1 13 ALA HA 1 15 LEU HB3 5.500 . 6.600 6.588 6.433 6.670 0.070 9 0 "[ . 1]" 1
1381 1 74 ALA HA 1 76 LYS HB3 6.000 . 7.200 4.740 4.026 5.461 . 0 0 "[ . 1]" 1
1382 1 31 ALA H 1 47 ASN HA 5.500 . 6.600 4.936 4.788 5.065 . 0 0 "[ . 1]" 1
1383 1 47 ASN HA 1 48 VAL HA 3.400 . 4.080 3.814 3.780 3.846 . 0 0 "[ . 1]" 1
1384 1 32 LEU MD1 1 46 ALA HA 5.000 . 6.000 3.860 3.640 4.011 . 0 0 "[ . 1]" 1
1385 1 29 GLY QA 1 30 PRO HD3 3.400 . 4.080 2.863 2.833 2.895 . 0 0 "[ . 1]" 1
1386 1 19 LEU QB 1 58 VAL MG1 5.200 . 6.200 4.065 3.901 4.127 . 0 0 "[ . 1]" 1
1387 1 47 ASN HA 1 56 VAL MG2 5.000 . 6.000 4.222 4.087 4.345 . 0 0 "[ . 1]" 1
1388 1 61 ARG QG 1 68 LEU QD 2.800 . 3.360 2.113 1.675 2.742 . 0 0 "[ . 1]" 1
1389 1 19 LEU H 1 58 VAL MG2 5.000 . 6.000 4.840 4.649 5.046 . 0 0 "[ . 1]" 1
1390 1 49 LEU QD 1 54 ASP H 4.800 . 5.760 4.263 3.860 4.838 . 0 0 "[ . 1]" 1
1391 1 18 PHE HE2 1 40 LEU MD2 5.000 . 6.000 4.472 4.293 4.617 . 0 0 "[ . 1]" 1
1392 1 50 ILE QG 1 56 VAL MG2 5.000 . 6.000 2.591 2.167 3.678 . 0 0 "[ . 1]" 1
1393 1 50 ILE H 1 57 LEU HG 5.700 . 6.700 6.755 6.630 6.786 0.086 9 0 "[ . 1]" 1
1394 1 18 PHE QE 1 60 LYS HD3 5.000 . 6.000 2.359 2.068 3.375 . 0 0 "[ . 1]" 1
1395 1 81 ALA HA 1 82 ILE H 2.800 . 3.360 2.248 2.073 2.525 . 0 0 "[ . 1]" 1
1396 1 12 SER HA 1 59 MET H 5.300 . 6.300 6.300 6.115 6.361 0.061 3 0 "[ . 1]" 1
1397 1 40 LEU MD1 1 44 GLU HG2 5.000 . 6.000 5.527 5.308 5.689 . 0 0 "[ . 1]" 1
1398 1 19 LEU HG 1 79 ARG HD2 5.000 . 6.000 5.914 5.449 6.053 0.053 6 0 "[ . 1]" 1
1399 1 49 LEU MD1 1 52 GLN HA 5.000 . 6.000 3.713 2.380 4.510 . 0 0 "[ . 1]" 1
1400 1 49 LEU MD2 1 52 GLN HA 5.000 . 6.000 4.354 3.495 5.191 . 0 0 "[ . 1]" 1
1401 1 37 LEU HA 1 46 ALA MB 5.000 . 6.000 4.060 3.948 4.244 . 0 0 "[ . 1]" 1
1402 1 15 LEU MD2 1 18 PHE QB 5.000 . 6.000 3.189 2.181 4.252 . 0 0 "[ . 1]" 1
1403 1 23 LYS QG 1 50 ILE MD 5.000 . 6.000 5.994 5.901 6.018 0.018 10 0 "[ . 1]" 1
1404 1 19 LEU HB3 1 71 SER HA 5.000 . 6.000 6.004 5.858 6.053 0.053 9 0 "[ . 1]" 1
1405 1 40 LEU MD1 1 61 ARG HA 5.000 . 6.000 5.275 3.079 6.031 0.031 9 0 "[ . 1]" 1
1406 1 21 LEU MD1 1 59 MET H 5.000 . 6.000 6.030 5.487 6.128 0.128 2 0 "[ . 1]" 1
1407 1 34 ILE MG 1 35 ASN HA 5.000 . 6.000 2.934 2.901 2.975 . 0 0 "[ . 1]" 1
1408 1 45 LYS QE 1 59 MET ME 5.000 . 6.000 3.570 3.337 3.791 . 0 0 "[ . 1]" 1
1409 1 42 LYS HA 1 60 LYS QG 5.000 . 6.000 2.342 1.944 2.797 . 0 0 "[ . 1]" 1
1410 1 58 VAL HA 1 77 ARG QG 5.800 . 7.800 7.540 7.383 7.760 . 0 0 "[ . 1]" 1
1411 1 42 LYS HA 1 82 ILE HG13 5.000 . 6.000 5.839 5.662 6.065 0.065 5 0 "[ . 1]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 30
_Distance_constraint_stats_list.Viol_count 97
_Distance_constraint_stats_list.Viol_total 45.593
_Distance_constraint_stats_list.Viol_max 0.185
_Distance_constraint_stats_list.Viol_rms 0.0340
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0152
_Distance_constraint_stats_list.Viol_average_violations_only 0.0470
_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 10 VAL 0.110 0.049 6 0 "[ . 1]"
1 11 GLU 0.486 0.075 5 0 "[ . 1]"
1 12 SER 0.032 0.032 10 0 "[ . 1]"
1 14 VAL 0.110 0.049 6 0 "[ . 1]"
1 15 LEU 0.486 0.075 5 0 "[ . 1]"
1 16 ARG 0.032 0.032 10 0 "[ . 1]"
1 19 LEU 0.136 0.032 1 0 "[ . 1]"
1 21 LEU 0.648 0.148 4 0 "[ . 1]"
1 22 GLY 0.648 0.148 4 0 "[ . 1]"
1 33 SER 0.000 0.000 . 0 "[ . 1]"
1 36 GLU 0.000 0.000 . 0 "[ . 1]"
1 37 LEU 0.000 0.000 . 0 "[ . 1]"
1 41 ALA 0.125 0.042 7 0 "[ . 1]"
1 44 GLU 0.810 0.082 2 0 "[ . 1]"
1 46 ALA 1.622 0.185 4 0 "[ . 1]"
1 48 VAL 0.169 0.037 2 0 "[ . 1]"
1 50 ILE 0.545 0.060 6 0 "[ . 1]"
1 54 ASP 0.545 0.060 6 0 "[ . 1]"
1 56 VAL 0.169 0.037 2 0 "[ . 1]"
1 57 LEU 0.648 0.148 4 0 "[ . 1]"
1 58 VAL 1.622 0.185 4 0 "[ . 1]"
1 59 MET 0.136 0.032 1 0 "[ . 1]"
1 60 LYS 0.686 0.082 2 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 11 GLU O 1 15 LEU N 2.800 2.400 3.700 3.555 2.857 3.744 0.044 5 0 "[ . 1]" 2
2 1 11 GLU O 1 15 LEU H 1.800 . 2.700 2.603 1.916 2.775 0.075 5 0 "[ . 1]" 2
3 1 10 VAL O 1 14 VAL N 2.800 2.400 3.700 3.612 3.363 3.681 . 0 0 "[ . 1]" 2
4 1 10 VAL O 1 14 VAL H 1.800 . 2.700 2.657 2.415 2.749 0.049 6 0 "[ . 1]" 2
5 1 12 SER O 1 16 ARG N 2.800 2.400 3.700 2.775 2.575 3.188 . 0 0 "[ . 1]" 2
6 1 12 SER O 1 16 ARG H 1.800 . 2.700 1.973 1.796 2.732 0.032 10 0 "[ . 1]" 2
7 1 19 LEU O 1 59 MET N 3.000 2.300 3.300 3.165 2.877 3.332 0.032 1 0 "[ . 1]" 2
8 1 19 LEU O 1 59 MET H 2.100 . 2.400 2.276 1.996 2.419 0.019 7 0 "[ . 1]" 2
9 1 19 LEU N 1 59 MET O 3.000 2.300 3.300 2.627 2.546 2.746 . 0 0 "[ . 1]" 2
10 1 19 LEU H 1 59 MET O 2.100 . 2.400 1.996 1.844 2.146 . 0 0 "[ . 1]" 2
11 1 21 LEU N 1 57 LEU O 3.000 2.300 3.300 3.171 3.085 3.389 0.089 4 0 "[ . 1]" 2
12 1 21 LEU H 1 57 LEU O 2.100 . 2.400 2.455 2.390 2.548 0.148 4 0 "[ . 1]" 2
13 1 22 GLY O 1 57 LEU N 3.000 2.300 3.300 2.867 2.805 3.066 . 0 0 "[ . 1]" 2
14 1 22 GLY O 1 57 LEU H 2.100 . 2.400 2.001 1.950 2.151 . 0 0 "[ . 1]" 2
15 1 48 VAL N 1 56 VAL O 3.000 2.300 3.300 2.791 2.757 2.851 . 0 0 "[ . 1]" 2
16 1 48 VAL H 1 56 VAL O 2.100 . 2.400 1.840 1.796 1.889 0.004 2 0 "[ . 1]" 2
17 1 48 VAL O 1 56 VAL N 3.000 2.300 3.300 3.276 3.138 3.337 0.037 2 0 "[ . 1]" 2
18 1 48 VAL O 1 56 VAL H 2.100 . 2.400 2.347 2.210 2.411 0.011 8 0 "[ . 1]" 2
19 1 46 ALA O 1 58 VAL N 3.000 2.300 3.300 2.888 2.848 2.928 . 0 0 "[ . 1]" 2
20 1 46 ALA O 1 58 VAL H 2.100 . 2.400 2.060 2.014 2.121 . 0 0 "[ . 1]" 2
21 1 46 ALA N 1 58 VAL O 3.000 2.300 3.300 3.291 3.245 3.312 0.012 8 0 "[ . 1]" 2
22 1 46 ALA H 1 58 VAL O 2.100 . 2.400 2.558 2.527 2.585 0.185 4 0 "[ . 1]" 2
23 1 50 ILE N 1 54 ASP O 3.000 2.300 3.300 3.323 3.294 3.353 0.053 6 0 "[ . 1]" 2
24 1 50 ILE H 1 54 ASP O 2.100 . 2.400 2.430 2.413 2.460 0.060 6 0 "[ . 1]" 2
25 1 44 GLU O 1 60 LYS N 3.000 2.300 3.300 3.362 3.343 3.382 0.082 2 0 "[ . 1]" 2
26 1 44 GLU O 1 60 LYS H 2.100 . 2.400 2.399 2.372 2.443 0.043 6 0 "[ . 1]" 2
27 1 41 ALA O 1 44 GLU N 3.000 2.300 3.300 3.174 2.987 3.242 . 0 0 "[ . 1]" 2
28 1 41 ALA O 1 44 GLU H 2.100 . 2.400 2.383 2.188 2.442 0.042 7 0 "[ . 1]" 2
29 1 33 SER O 1 36 GLU H 1.800 . 2.700 2.083 1.878 2.260 . 0 0 "[ . 1]" 2
30 1 33 SER O 1 36 GLU N 2.800 2.400 3.700 2.801 2.588 2.907 . 0 0 "[ . 1]" 2
stop_
save_
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