NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
403097 |
1wii   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1wii
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 1328
_Distance_constraint_stats_list.Viol_count 665
_Distance_constraint_stats_list.Viol_total 1296.038
_Distance_constraint_stats_list.Viol_max 0.892
_Distance_constraint_stats_list.Viol_rms 0.0293
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0024
_Distance_constraint_stats_list.Viol_average_violations_only 0.0974
_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 15 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 THR 0.193 0.067 3 0 "[ . 1 . 2]"
1 20 LEU 6.121 0.669 12 4 "[ . -* +* . 2]"
1 21 GLU 7.276 0.521 20 1 "[ . 1 . +]"
1 22 THR 0.276 0.064 1 0 "[ . 1 . 2]"
1 23 GLN 3.016 0.733 20 2 "[ . - . +]"
1 24 PHE 0.476 0.188 10 0 "[ . 1 . 2]"
1 25 THR 2.075 0.389 12 0 "[ . 1 . 2]"
1 26 CYS 1.484 0.132 14 0 "[ . 1 . 2]"
1 27 PRO 0.006 0.004 8 0 "[ . 1 . 2]"
1 28 PHE 0.044 0.010 10 0 "[ . 1 . 2]"
1 29 CYS 0.057 0.022 4 0 "[ . 1 . 2]"
1 30 ASN 2.075 0.389 12 0 "[ . 1 . 2]"
1 31 HIS 0.180 0.036 1 0 "[ . 1 . 2]"
1 32 GLU 0.031 0.018 18 0 "[ . 1 . 2]"
1 33 LYS 0.002 0.002 15 0 "[ . 1 . 2]"
1 34 SER 0.133 0.036 1 0 "[ . 1 . 2]"
1 35 CYS 0.889 0.733 20 1 "[ . 1 . +]"
1 36 ASP 3.561 0.556 20 3 "[ . * - . +]"
1 37 VAL 0.510 0.128 17 0 "[ . 1 . 2]"
1 38 LYS 0.492 0.150 8 0 "[ . 1 . 2]"
1 39 MET 1.685 0.312 18 0 "[ . 1 . 2]"
1 40 ASP 0.069 0.021 12 0 "[ . 1 . 2]"
1 41 ARG 4.976 0.312 18 0 "[ . 1 . 2]"
1 42 ALA 1.037 0.302 9 0 "[ . 1 . 2]"
1 43 ARG 1.788 0.666 18 1 "[ . 1 . + 2]"
1 44 ASN 0.036 0.013 18 0 "[ . 1 . 2]"
1 45 THR 1.809 0.666 18 1 "[ . 1 . + 2]"
1 46 GLY 0.005 0.005 14 0 "[ . 1 . 2]"
1 47 VAL 0.444 0.102 20 0 "[ . 1 . 2]"
1 48 ILE 1.403 0.087 6 0 "[ . 1 . 2]"
1 49 SER 1.681 0.471 7 0 "[ . 1 . 2]"
1 50 CYS 3.467 0.168 17 0 "[ . 1 . 2]"
1 51 THR 2.975 0.533 7 1 "[ . + 1 . 2]"
1 52 VAL 0.024 0.007 2 0 "[ . 1 . 2]"
1 53 CYS 0.250 0.038 14 0 "[ . 1 . 2]"
1 54 LEU 0.033 0.013 5 0 "[ . 1 . 2]"
1 55 GLU 2.971 0.892 5 2 "[ + 1 - 2]"
1 56 GLU 0.111 0.034 20 0 "[ . 1 . 2]"
1 57 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 GLN 2.604 0.306 14 0 "[ . 1 . 2]"
1 59 THR 0.161 0.057 20 0 "[ . 1 . 2]"
1 60 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 ILE 0.393 0.038 20 0 "[ . 1 . 2]"
1 62 THR 0.078 0.065 17 0 "[ . 1 . 2]"
1 63 TYR 5.109 0.819 17 5 "[ * . * - . + *2]"
1 64 LEU 11.470 0.770 17 3 "[ . 1 - . + *2]"
1 65 SER 3.313 0.819 17 4 "[ * . - * . + 2]"
1 66 GLU 2.757 0.830 8 2 "[ . +*1 . 2]"
1 67 PRO 2.213 0.830 8 2 "[ . + - . 2]"
1 68 VAL 0.016 0.009 10 0 "[ . 1 . 2]"
1 69 ASP 1.056 0.162 14 0 "[ . 1 . 2]"
1 70 VAL 0.037 0.017 20 0 "[ . 1 . 2]"
1 71 TYR 0.112 0.015 20 0 "[ . 1 . 2]"
1 72 SER 0.042 0.022 6 0 "[ . 1 . 2]"
1 73 ASP 0.096 0.014 15 0 "[ . 1 . 2]"
1 74 TRP 2.107 0.892 5 2 "[ + 1 - 2]"
1 75 ILE 0.137 0.022 6 0 "[ . 1 . 2]"
1 76 ASP 2.634 0.545 20 4 "[ * . 1 * . - +]"
1 77 ALA 0.044 0.011 16 0 "[ . 1 . 2]"
1 78 CYS 3.074 0.659 2 5 "[*+ . 1 - . * *]"
1 79 GLU 8.600 0.659 2 5 "[*+ . 1 * . - *]"
1 80 SER 0.951 0.390 10 0 "[ . 1 . 2]"
1 81 GLY 1.077 0.187 11 0 "[ . 1 . 2]"
1 82 PRO 1.077 0.187 11 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 15 LYS H 1 15 LYS HB2 . . 3.800 2.859 2.168 3.776 . 0 0 "[ . 1 . 2]" 1
2 1 17 THR HA 1 17 THR MG . . 3.590 2.673 2.224 3.205 . 0 0 "[ . 1 . 2]" 1
3 1 19 THR H 1 19 THR MG . . 4.190 3.264 1.953 4.031 . 0 0 "[ . 1 . 2]" 1
4 1 19 THR HA 1 19 THR MG . . 3.280 2.672 2.206 3.205 . 0 0 "[ . 1 . 2]" 1
5 1 19 THR HA 1 20 LEU H . . 3.130 2.332 2.158 3.176 0.046 3 0 "[ . 1 . 2]" 1
6 1 19 THR HA 1 20 LEU HB2 . . 4.630 4.250 3.803 4.636 0.006 14 0 "[ . 1 . 2]" 1
7 1 19 THR HB 1 20 LEU H . . 4.270 3.830 1.994 4.337 0.067 3 0 "[ . 1 . 2]" 1
8 1 19 THR MG 1 20 LEU H . . 4.330 2.727 1.873 3.944 . 0 0 "[ . 1 . 2]" 1
9 1 19 THR MG 1 21 GLU H . . 4.810 3.875 3.213 4.853 0.043 9 0 "[ . 1 . 2]" 1
10 1 20 LEU H 1 20 LEU HB2 . . 3.260 2.483 2.056 3.240 . 0 0 "[ . 1 . 2]" 1
11 1 20 LEU H 1 20 LEU MD2 . . 4.790 4.339 2.527 4.781 . 0 0 "[ . 1 . 2]" 1
12 1 20 LEU H 1 20 LEU HG . . 4.460 4.026 2.891 4.516 0.056 9 0 "[ . 1 . 2]" 1
13 1 20 LEU H 1 21 GLU H . . 4.170 3.853 2.525 4.203 0.033 19 0 "[ . 1 . 2]" 1
14 1 20 LEU HA 1 20 LEU MD1 . . 4.060 3.259 2.256 3.836 . 0 0 "[ . 1 . 2]" 1
15 1 20 LEU HA 1 20 LEU MD2 . . 3.270 3.110 1.891 3.939 0.669 12 2 "[ . 1 +- . 2]" 1
16 1 20 LEU HA 1 20 LEU HG . . 3.340 2.411 2.131 3.592 0.252 9 0 "[ . 1 . 2]" 1
17 1 20 LEU HA 1 21 GLU H . . 3.160 2.341 2.145 2.904 . 0 0 "[ . 1 . 2]" 1
18 1 20 LEU HA 1 21 GLU QG . . 5.000 4.048 3.716 4.827 . 0 0 "[ . 1 . 2]" 1
19 1 20 LEU HB2 1 20 LEU MD1 . . 3.620 2.156 1.958 3.152 . 0 0 "[ . 1 . 2]" 1
20 1 20 LEU HB2 1 21 GLU H . . 5.020 4.530 3.392 4.658 . 0 0 "[ . 1 . 2]" 1
21 1 20 LEU HB3 1 21 GLU H . . 5.290 4.073 1.892 4.469 . 0 0 "[ . 1 . 2]" 1
22 1 20 LEU HB3 1 21 GLU HA . . 5.100 4.642 4.276 5.076 . 0 0 "[ . 1 . 2]" 1
23 1 20 LEU HB3 1 67 PRO HG3 . . 5.500 4.250 2.678 5.741 0.241 10 0 "[ . 1 . 2]" 1
24 1 20 LEU MD1 1 21 GLU H . . 5.450 4.927 3.439 5.486 0.036 5 0 "[ . 1 . 2]" 1
25 1 20 LEU MD1 1 66 GLU QB . . 5.300 3.819 2.554 5.408 0.108 19 0 "[ . 1 . 2]" 1
26 1 20 LEU MD1 1 66 GLU HG2 . . 5.260 3.635 2.776 4.760 . 0 0 "[ . 1 . 2]" 1
27 1 20 LEU MD1 1 66 GLU HG3 . . 5.410 4.600 2.723 5.956 0.546 9 1 "[ . +1 . 2]" 1
28 1 20 LEU MD2 1 21 GLU H . . 4.920 4.230 1.845 5.309 0.389 18 0 "[ . 1 . 2]" 1
29 1 20 LEU MD2 1 67 PRO HG2 . . 4.860 2.408 1.771 3.655 . 0 0 "[ . 1 . 2]" 1
30 1 20 LEU MD2 1 67 PRO HG3 . . 4.640 2.577 1.868 3.373 . 0 0 "[ . 1 . 2]" 1
31 1 20 LEU HG 1 67 PRO HG3 . . 5.500 4.392 2.561 6.109 0.609 10 1 "[ . + . 2]" 1
32 1 21 GLU H 1 21 GLU HB2 . . 3.390 3.597 2.172 3.800 0.410 6 0 "[ . 1 . 2]" 1
33 1 21 GLU H 1 21 GLU HB3 . . 3.780 2.830 2.457 3.323 . 0 0 "[ . 1 . 2]" 1
34 1 21 GLU H 1 21 GLU QG . . 3.730 2.187 1.898 3.545 . 0 0 "[ . 1 . 2]" 1
35 1 21 GLU HA 1 22 THR H . . 3.170 2.402 2.141 3.029 . 0 0 "[ . 1 . 2]" 1
36 1 21 GLU HA 1 22 THR MG . . 4.590 3.681 3.024 4.011 . 0 0 "[ . 1 . 2]" 1
37 1 21 GLU HA 1 23 GLN H . . 4.550 4.149 3.894 4.336 . 0 0 "[ . 1 . 2]" 1
38 1 21 GLU HA 1 23 GLN HB2 . . 5.500 5.148 4.686 6.021 0.521 20 1 "[ . 1 . +]" 1
39 1 21 GLU HB3 1 22 THR H . . 4.570 4.165 3.388 4.634 0.064 1 0 "[ . 1 . 2]" 1
40 1 21 GLU HB3 1 23 GLN H . . 5.380 4.514 3.593 4.815 . 0 0 "[ . 1 . 2]" 1
41 1 21 GLU QG 1 22 THR H . . 4.810 3.764 3.150 4.180 . 0 0 "[ . 1 . 2]" 1
42 1 21 GLU QG 1 22 THR HA . . 5.270 4.408 3.843 5.026 . 0 0 "[ . 1 . 2]" 1
43 1 21 GLU QG 1 23 GLN H . . 4.410 2.365 1.919 3.485 . 0 0 "[ . 1 . 2]" 1
44 1 21 GLU QG 1 24 PHE QD . . 5.290 4.690 4.343 5.001 . 0 0 "[ . 1 . 2]" 1
45 1 21 GLU QG 1 24 PHE QE . . 5.120 4.222 3.800 4.459 . 0 0 "[ . 1 . 2]" 1
46 1 21 GLU QG 1 24 PHE HZ . . 5.500 4.566 3.946 4.900 . 0 0 "[ . 1 . 2]" 1
47 1 22 THR H 1 22 THR MG . . 3.950 2.539 1.963 3.154 . 0 0 "[ . 1 . 2]" 1
48 1 22 THR H 1 23 GLN H . . 3.700 3.014 2.268 3.386 . 0 0 "[ . 1 . 2]" 1
49 1 22 THR H 1 23 GLN HB2 . . 5.460 4.382 3.374 5.079 . 0 0 "[ . 1 . 2]" 1
50 1 22 THR HA 1 22 THR MG . . 3.300 2.449 2.164 3.198 . 0 0 "[ . 1 . 2]" 1
51 1 22 THR HA 1 23 GLN HB2 . . 5.360 5.110 4.839 5.360 . 1 0 "[ . 1 . 2]" 1
52 1 22 THR HA 1 24 PHE QE . . 4.030 2.947 2.383 3.510 . 0 0 "[ . 1 . 2]" 1
53 1 22 THR HA 1 24 PHE HZ . . 4.550 3.981 2.878 4.554 0.004 2 0 "[ . 1 . 2]" 1
54 1 22 THR HA 1 37 VAL HB . . 5.060 3.823 2.942 4.694 . 0 0 "[ . 1 . 2]" 1
55 1 22 THR HA 1 37 VAL MG2 . . 4.670 3.938 3.360 4.679 0.009 2 0 "[ . 1 . 2]" 1
56 1 22 THR HA 1 67 PRO HB2 . . 4.050 3.003 1.989 3.687 . 0 0 "[ . 1 . 2]" 1
57 1 22 THR HA 1 67 PRO HG2 . . 5.500 4.315 3.130 5.032 . 0 0 "[ . 1 . 2]" 1
58 1 22 THR HB 1 23 GLN H . . 5.310 4.464 4.403 4.640 . 0 0 "[ . 1 . 2]" 1
59 1 22 THR HB 1 37 VAL H . . 5.270 3.615 2.164 5.272 0.002 4 0 "[ . 1 . 2]" 1
60 1 22 THR HB 1 37 VAL HB . . 5.250 4.002 2.853 4.923 . 0 0 "[ . 1 . 2]" 1
61 1 22 THR HB 1 67 PRO HB2 . . 5.500 4.591 2.730 5.508 0.008 1 0 "[ . 1 . 2]" 1
62 1 22 THR MG 1 23 GLN H . . 4.680 4.234 3.542 4.384 . 0 0 "[ . 1 . 2]" 1
63 1 22 THR MG 1 67 PRO HG2 . . 5.020 4.432 3.904 5.045 0.025 18 0 "[ . 1 . 2]" 1
64 1 22 THR MG 1 67 PRO HG3 . . 4.740 3.675 2.870 4.446 . 0 0 "[ . 1 . 2]" 1
65 1 23 GLN H 1 23 GLN HG2 . . 5.010 4.615 4.234 4.962 . 0 0 "[ . 1 . 2]" 1
66 1 23 GLN H 1 23 GLN HG3 . . 5.490 3.903 3.247 4.993 . 0 0 "[ . 1 . 2]" 1
67 1 23 GLN HA 1 23 GLN HG3 . . 4.250 2.655 2.069 3.459 . 0 0 "[ . 1 . 2]" 1
68 1 23 GLN HA 1 24 PHE QD . . 5.120 3.137 2.788 3.550 . 0 0 "[ . 1 . 2]" 1
69 1 23 GLN HA 1 36 ASP HA . . 4.670 3.654 2.763 4.158 . 0 0 "[ . 1 . 2]" 1
70 1 23 GLN HB2 1 23 GLN HE22 . . 5.330 4.313 3.509 4.870 . 0 0 "[ . 1 . 2]" 1
71 1 23 GLN HB3 1 23 GLN HE22 . . 5.500 4.411 3.299 5.264 . 0 0 "[ . 1 . 2]" 1
72 1 23 GLN HB3 1 24 PHE H . . 4.210 3.006 2.645 3.874 . 0 0 "[ . 1 . 2]" 1
73 1 23 GLN HB3 1 33 LYS HA . . 4.780 3.534 2.558 4.520 . 0 0 "[ . 1 . 2]" 1
74 1 23 GLN HB3 1 33 LYS QG . . 4.850 3.764 2.666 4.428 . 0 0 "[ . 1 . 2]" 1
75 1 23 GLN HB3 1 35 CYS H . . 4.800 4.230 3.491 5.533 0.733 20 1 "[ . 1 . +]" 1
76 1 23 GLN HG2 1 24 PHE H . . 5.500 3.540 1.881 4.659 . 0 0 "[ . 1 . 2]" 1
77 1 23 GLN HG2 1 36 ASP HA . . 5.190 4.540 3.070 5.194 0.004 7 0 "[ . 1 . 2]" 1
78 1 23 GLN HG3 1 24 PHE H . . 5.330 4.360 3.561 4.838 . 0 0 "[ . 1 . 2]" 1
79 1 23 GLN HG3 1 36 ASP HA . . 4.660 4.367 3.223 5.216 0.556 20 2 "[ . - . +]" 1
80 1 24 PHE H 1 24 PHE QD . . 4.230 2.972 2.705 3.257 . 0 0 "[ . 1 . 2]" 1
81 1 24 PHE H 1 33 LYS HA . . 5.370 3.807 3.348 4.434 . 0 0 "[ . 1 . 2]" 1
82 1 24 PHE H 1 35 CYS H . . 3.950 3.068 2.582 3.443 . 0 0 "[ . 1 . 2]" 1
83 1 24 PHE H 1 35 CYS HB2 . . 4.460 2.517 1.985 3.494 . 0 0 "[ . 1 . 2]" 1
84 1 24 PHE H 1 35 CYS HB3 . . 4.850 3.960 3.416 4.301 . 0 0 "[ . 1 . 2]" 1
85 1 24 PHE HA 1 24 PHE QD . . 4.160 3.058 2.885 3.223 . 0 0 "[ . 1 . 2]" 1
86 1 24 PHE HA 1 25 THR HB . . 5.500 5.093 5.006 5.237 . 0 0 "[ . 1 . 2]" 1
87 1 24 PHE HB2 1 35 CYS H . . 5.500 5.360 4.742 5.540 0.040 20 0 "[ . 1 . 2]" 1
88 1 24 PHE HB2 1 35 CYS HB2 . . 4.370 3.102 2.588 3.851 . 0 0 "[ . 1 . 2]" 1
89 1 24 PHE HB2 1 35 CYS HB3 . . 4.920 3.885 3.327 4.519 . 0 0 "[ . 1 . 2]" 1
90 1 24 PHE HB2 1 48 ILE MD . . 4.330 3.235 2.932 3.774 . 0 0 "[ . 1 . 2]" 1
91 1 24 PHE HB2 1 71 TYR QD . . 5.500 3.569 3.329 3.942 . 0 0 "[ . 1 . 2]" 1
92 1 24 PHE HB3 1 25 THR H . . 5.160 2.453 2.276 2.667 . 0 0 "[ . 1 . 2]" 1
93 1 24 PHE HB3 1 37 VAL MG2 . . 5.500 5.123 4.707 5.481 . 0 0 "[ . 1 . 2]" 1
94 1 24 PHE HB3 1 48 ILE MD . . 5.500 4.497 4.125 5.108 . 0 0 "[ . 1 . 2]" 1
95 1 24 PHE HB3 1 71 TYR QD . . 4.780 3.215 2.843 3.760 . 0 0 "[ . 1 . 2]" 1
96 1 24 PHE HB3 1 71 TYR HE1 . . 4.620 4.176 3.849 4.630 0.010 18 0 "[ . 1 . 2]" 1
97 1 24 PHE QD 1 35 CYS HB2 . . 5.050 3.723 3.103 4.823 . 0 0 "[ . 1 . 2]" 1
98 1 24 PHE QD 1 35 CYS HB3 . . 5.350 4.143 3.696 4.718 . 0 0 "[ . 1 . 2]" 1
99 1 24 PHE QD 1 36 ASP HA . . 5.500 4.720 4.213 5.308 . 0 0 "[ . 1 . 2]" 1
100 1 24 PHE QD 1 37 VAL MG2 . . 3.680 2.443 2.203 2.743 . 0 0 "[ . 1 . 2]" 1
101 1 24 PHE QD 1 48 ILE MD . . 3.770 3.147 2.729 3.544 . 0 0 "[ . 1 . 2]" 1
102 1 24 PHE QD 1 68 VAL MG2 . . 4.820 3.565 3.241 3.809 . 0 0 "[ . 1 . 2]" 1
103 1 24 PHE QD 1 71 TYR HB2 . . 5.380 3.265 3.016 3.629 . 0 0 "[ . 1 . 2]" 1
104 1 24 PHE QD 1 71 TYR HB3 . . 4.970 3.684 3.098 4.291 . 0 0 "[ . 1 . 2]" 1
105 1 24 PHE QE 1 37 VAL HB . . 5.040 3.207 2.821 3.479 . 0 0 "[ . 1 . 2]" 1
106 1 24 PHE QE 1 37 VAL MG1 . . 4.860 3.872 3.592 4.099 . 0 0 "[ . 1 . 2]" 1
107 1 24 PHE QE 1 37 VAL MG2 . . 3.450 1.993 1.909 2.242 . 0 0 "[ . 1 . 2]" 1
108 1 24 PHE QE 1 67 PRO HA . . 5.200 4.398 4.080 4.663 . 0 0 "[ . 1 . 2]" 1
109 1 24 PHE QE 1 67 PRO HB2 . . 4.190 2.848 2.423 3.124 . 0 0 "[ . 1 . 2]" 1
110 1 24 PHE QE 1 67 PRO HB3 . . 4.620 4.317 3.983 4.568 . 0 0 "[ . 1 . 2]" 1
111 1 24 PHE QE 1 67 PRO HG3 . . 5.280 5.227 4.852 5.468 0.188 10 0 "[ . 1 . 2]" 1
112 1 24 PHE QE 1 68 VAL HA . . 3.770 2.327 1.988 2.728 . 0 0 "[ . 1 . 2]" 1
113 1 24 PHE QE 1 68 VAL HB . . 4.320 2.853 2.379 3.162 . 0 0 "[ . 1 . 2]" 1
114 1 24 PHE QE 1 68 VAL MG1 . . 4.400 4.140 3.864 4.303 . 0 0 "[ . 1 . 2]" 1
115 1 24 PHE QE 1 68 VAL MG2 . . 3.550 2.075 1.968 2.228 . 0 0 "[ . 1 . 2]" 1
116 1 24 PHE HZ 1 37 VAL MG2 . . 4.790 3.791 3.465 4.148 . 0 0 "[ . 1 . 2]" 1
117 1 24 PHE HZ 1 67 PRO HB2 . . 4.520 2.927 2.695 3.150 . 0 0 "[ . 1 . 2]" 1
118 1 24 PHE HZ 1 67 PRO HB3 . . 4.810 4.624 4.408 4.817 0.007 14 0 "[ . 1 . 2]" 1
119 1 24 PHE HZ 1 68 VAL H . . 4.090 3.607 3.422 3.839 . 0 0 "[ . 1 . 2]" 1
120 1 24 PHE HZ 1 68 VAL HA . . 3.490 2.179 2.001 2.348 . 0 0 "[ . 1 . 2]" 1
121 1 24 PHE HZ 1 68 VAL HB . . 3.930 2.970 2.354 3.192 . 0 0 "[ . 1 . 2]" 1
122 1 24 PHE HZ 1 68 VAL MG1 . . 4.540 4.185 3.744 4.375 . 0 0 "[ . 1 . 2]" 1
123 1 24 PHE HZ 1 68 VAL MG2 . . 3.890 3.607 3.432 3.833 . 0 0 "[ . 1 . 2]" 1
124 1 25 THR H 1 25 THR HB . . 3.770 2.712 2.592 2.798 . 0 0 "[ . 1 . 2]" 1
125 1 25 THR HB 1 30 ASN HA . . 5.500 4.957 4.436 5.336 . 0 0 "[ . 1 . 2]" 1
126 1 25 THR MG 1 26 CYS HB2 . . 5.500 4.500 4.310 4.785 . 0 0 "[ . 1 . 2]" 1
127 1 25 THR MG 1 26 CYS HB3 . . 4.980 3.955 3.662 4.183 . 0 0 "[ . 1 . 2]" 1
128 1 25 THR MG 1 27 PRO HA . . 4.840 4.261 4.001 4.512 . 0 0 "[ . 1 . 2]" 1
129 1 25 THR MG 1 27 PRO HD3 . . 5.500 4.616 4.259 4.962 . 0 0 "[ . 1 . 2]" 1
130 1 25 THR MG 1 30 ASN H . . 4.480 4.159 3.847 4.357 . 0 0 "[ . 1 . 2]" 1
131 1 25 THR MG 1 30 ASN HA . . 3.360 2.461 2.075 2.742 . 0 0 "[ . 1 . 2]" 1
132 1 25 THR MG 1 30 ASN HB2 . . 4.570 4.456 4.085 4.959 0.389 12 0 "[ . 1 . 2]" 1
133 1 25 THR MG 1 30 ASN HB3 . . 4.920 3.253 2.707 3.937 . 0 0 "[ . 1 . 2]" 1
134 1 25 THR MG 1 30 ASN HD21 . . 5.370 3.712 2.239 5.251 . 0 0 "[ . 1 . 2]" 1
135 1 25 THR MG 1 30 ASN HD22 . . 5.270 4.503 2.900 5.371 0.101 20 0 "[ . 1 . 2]" 1
136 1 25 THR MG 1 31 HIS H . . 4.790 3.149 2.557 3.950 . 0 0 "[ . 1 . 2]" 1
137 1 25 THR MG 1 31 HIS HA . . 5.320 4.614 3.876 5.222 . 0 0 "[ . 1 . 2]" 1
138 1 25 THR MG 1 32 GLU HA . . 3.600 2.751 2.144 3.147 . 0 0 "[ . 1 . 2]" 1
139 1 25 THR MG 1 32 GLU QB . . 5.500 4.293 2.757 4.624 . 0 0 "[ . 1 . 2]" 1
140 1 25 THR MG 1 32 GLU QG . . 5.240 4.122 3.503 4.567 . 0 0 "[ . 1 . 2]" 1
141 1 26 CYS HA 1 27 PRO HG2 . . 5.200 4.178 4.148 4.236 . 0 0 "[ . 1 . 2]" 1
142 1 26 CYS HA 1 27 PRO HG3 . . 5.500 4.318 4.315 4.324 . 0 0 "[ . 1 . 2]" 1
143 1 26 CYS HA 1 28 PHE H . . 5.360 3.586 3.438 3.838 . 0 0 "[ . 1 . 2]" 1
144 1 26 CYS HA 1 35 CYS HG . . 4.820 3.869 2.567 4.461 . 0 0 "[ . 1 . 2]" 1
145 1 26 CYS HA 1 74 TRP HZ3 . . 4.620 2.960 2.520 3.370 . 0 0 "[ . 1 . 2]" 1
146 1 26 CYS HB2 1 29 CYS H . . 5.060 4.434 4.344 4.516 . 0 0 "[ . 1 . 2]" 1
147 1 26 CYS HB2 1 30 ASN H . . 4.650 4.034 3.847 4.486 . 0 0 "[ . 1 . 2]" 1
148 1 26 CYS HB2 1 30 ASN HA . . 5.430 4.669 4.310 5.227 . 0 0 "[ . 1 . 2]" 1
149 1 26 CYS HB2 1 31 HIS H . . 4.530 4.205 3.918 4.494 . 0 0 "[ . 1 . 2]" 1
150 1 26 CYS HB2 1 35 CYS HG . . 4.480 2.287 1.989 2.948 . 0 0 "[ . 1 . 2]" 1
151 1 26 CYS HB2 1 50 CYS HA . . 4.740 4.182 4.058 4.280 . 0 0 "[ . 1 . 2]" 1
152 1 26 CYS HB2 1 50 CYS HB2 . . 4.630 3.714 3.618 3.807 . 0 0 "[ . 1 . 2]" 1
153 1 26 CYS HB2 1 50 CYS HB3 . . 5.370 4.997 4.849 5.088 . 0 0 "[ . 1 . 2]" 1
154 1 26 CYS HB3 1 29 CYS H . . 3.810 3.107 2.888 3.348 . 0 0 "[ . 1 . 2]" 1
155 1 26 CYS HB3 1 30 ASN H . . 3.860 2.299 2.100 2.784 . 0 0 "[ . 1 . 2]" 1
156 1 26 CYS HB3 1 30 ASN HA . . 4.810 3.224 2.829 3.788 . 0 0 "[ . 1 . 2]" 1
157 1 26 CYS HB3 1 31 HIS H . . 4.130 3.026 2.635 3.334 . 0 0 "[ . 1 . 2]" 1
158 1 26 CYS HB3 1 35 CYS HG . . 4.970 3.731 3.432 4.106 . 0 0 "[ . 1 . 2]" 1
159 1 26 CYS HB3 1 50 CYS HA . . 5.500 5.574 5.517 5.632 0.132 14 0 "[ . 1 . 2]" 1
160 1 27 PRO HA 1 30 ASN H . . 5.330 4.553 3.968 4.993 . 0 0 "[ . 1 . 2]" 1
161 1 27 PRO HA 1 30 ASN HD21 . . 5.400 3.439 2.391 5.058 . 0 0 "[ . 1 . 2]" 1
162 1 27 PRO HA 1 75 ILE MD . . 4.730 4.191 3.540 4.662 . 0 0 "[ . 1 . 2]" 1
163 1 27 PRO HB2 1 75 ILE MD . . 3.550 3.384 3.115 3.554 0.004 8 0 "[ . 1 . 2]" 1
164 1 27 PRO HB2 1 75 ILE MG . . 5.110 4.024 3.627 4.290 . 0 0 "[ . 1 . 2]" 1
165 1 27 PRO HB3 1 71 TYR HE1 . . 5.500 4.386 3.920 4.825 . 0 0 "[ . 1 . 2]" 1
166 1 27 PRO HB3 1 75 ILE MD . . 3.880 2.433 1.929 2.910 . 0 0 "[ . 1 . 2]" 1
167 1 27 PRO HD2 1 28 PHE H . . 4.120 2.738 2.647 2.980 . 0 0 "[ . 1 . 2]" 1
168 1 27 PRO HD2 1 28 PHE QD . . 4.910 2.684 2.295 3.970 . 0 0 "[ . 1 . 2]" 1
169 1 27 PRO HD2 1 28 PHE QE . . 5.400 3.916 2.888 5.216 . 0 0 "[ . 1 . 2]" 1
170 1 27 PRO HD2 1 74 TRP HE3 . . 5.100 3.777 3.292 4.134 . 0 0 "[ . 1 . 2]" 1
171 1 27 PRO HD2 1 74 TRP HH2 . . 4.330 3.582 2.761 4.132 . 0 0 "[ . 1 . 2]" 1
172 1 27 PRO HD2 1 74 TRP HZ3 . . 4.030 3.002 2.320 3.401 . 0 0 "[ . 1 . 2]" 1
173 1 27 PRO HD3 1 71 TYR HE1 . . 4.090 2.208 2.000 2.588 . 0 0 "[ . 1 . 2]" 1
174 1 27 PRO HD3 1 74 TRP HE3 . . 5.500 4.036 3.479 4.565 . 0 0 "[ . 1 . 2]" 1
175 1 27 PRO HD3 1 75 ILE MD . . 4.360 2.563 2.087 3.035 . 0 0 "[ . 1 . 2]" 1
176 1 27 PRO HG2 1 28 PHE H . . 4.360 2.778 2.407 3.278 . 0 0 "[ . 1 . 2]" 1
177 1 27 PRO HG2 1 28 PHE QD . . 4.260 2.325 2.029 3.834 . 0 0 "[ . 1 . 2]" 1
178 1 27 PRO HG2 1 28 PHE QE . . 4.810 2.902 2.292 4.445 . 0 0 "[ . 1 . 2]" 1
179 1 27 PRO HG2 1 78 CYS HB3 . . 5.500 4.530 3.969 5.083 . 0 0 "[ . 1 . 2]" 1
180 1 27 PRO HG3 1 71 TYR HE1 . . 4.730 3.557 3.016 4.308 . 0 0 "[ . 1 . 2]" 1
181 1 27 PRO HG3 1 74 TRP HE3 . . 5.500 4.437 3.809 4.863 . 0 0 "[ . 1 . 2]" 1
182 1 27 PRO HG3 1 75 ILE HA . . 5.150 3.020 2.535 3.479 . 0 0 "[ . 1 . 2]" 1
183 1 27 PRO HG3 1 75 ILE MD . . 3.400 1.868 1.771 2.177 . 0 0 "[ . 1 . 2]" 1
184 1 27 PRO HG3 1 75 ILE HG12 . . 5.330 4.239 3.842 4.445 . 0 0 "[ . 1 . 2]" 1
185 1 27 PRO HG3 1 75 ILE HG13 . . 5.500 4.568 4.392 4.988 . 0 0 "[ . 1 . 2]" 1
186 1 27 PRO HG3 1 78 CYS HB3 . . 5.500 4.780 4.017 5.503 0.003 11 0 "[ . 1 . 2]" 1
187 1 28 PHE H 1 28 PHE HB2 . . 3.670 2.360 2.258 2.503 . 0 0 "[ . 1 . 2]" 1
188 1 28 PHE H 1 28 PHE HB3 . . 3.970 3.582 3.538 3.654 . 0 0 "[ . 1 . 2]" 1
189 1 28 PHE H 1 28 PHE QD . . 4.090 2.077 1.886 3.252 . 0 0 "[ . 1 . 2]" 1
190 1 28 PHE H 1 28 PHE QE . . 5.260 4.318 4.168 4.922 . 0 0 "[ . 1 . 2]" 1
191 1 28 PHE H 1 29 CYS H . . 3.340 2.694 2.495 2.941 . 0 0 "[ . 1 . 2]" 1
192 1 28 PHE H 1 30 ASN H . . 4.410 3.726 3.063 4.118 . 0 0 "[ . 1 . 2]" 1
193 1 28 PHE H 1 74 TRP HZ2 . . 5.500 5.206 4.638 5.509 0.009 2 0 "[ . 1 . 2]" 1
194 1 28 PHE HA 1 28 PHE QD . . 4.050 3.047 2.162 3.189 . 0 0 "[ . 1 . 2]" 1
195 1 28 PHE HA 1 28 PHE QE . . 5.140 4.616 4.239 4.754 . 0 0 "[ . 1 . 2]" 1
196 1 28 PHE HB2 1 29 CYS H . . 3.540 2.325 2.104 2.565 . 0 0 "[ . 1 . 2]" 1
197 1 28 PHE HB2 1 55 GLU QG . . 4.540 3.349 2.937 4.176 . 0 0 "[ . 1 . 2]" 1
198 1 28 PHE HB3 1 29 CYS H . . 3.740 3.175 2.885 3.461 . 0 0 "[ . 1 . 2]" 1
199 1 28 PHE HB3 1 55 GLU QG . . 4.650 3.380 2.736 4.183 . 0 0 "[ . 1 . 2]" 1
200 1 28 PHE QD 1 29 CYS H . . 5.130 4.054 3.758 4.268 . 0 0 "[ . 1 . 2]" 1
201 1 28 PHE QD 1 55 GLU HB2 . . 5.050 4.451 3.611 4.881 . 0 0 "[ . 1 . 2]" 1
202 1 28 PHE QD 1 55 GLU HB3 . . 5.010 4.418 3.612 4.822 . 0 0 "[ . 1 . 2]" 1
203 1 28 PHE QD 1 55 GLU QG . . 4.780 2.954 2.195 3.741 . 0 0 "[ . 1 . 2]" 1
204 1 28 PHE QD 1 74 TRP HE1 . . 4.840 4.730 4.258 4.850 0.010 10 0 "[ . 1 . 2]" 1
205 1 28 PHE QD 1 74 TRP HZ2 . . 5.010 3.268 2.080 3.645 . 0 0 "[ . 1 . 2]" 1
206 1 28 PHE QE 1 55 GLU HB3 . . 5.030 4.404 3.950 4.863 . 0 0 "[ . 1 . 2]" 1
207 1 28 PHE QE 1 74 TRP HE1 . . 4.250 2.728 2.219 3.165 . 0 0 "[ . 1 . 2]" 1
208 1 28 PHE HZ 1 74 TRP HE1 . . 3.600 2.721 2.008 3.583 . 0 0 "[ . 1 . 2]" 1
209 1 28 PHE HZ 1 78 CYS HA . . 5.180 4.384 2.963 5.167 . 0 0 "[ . 1 . 2]" 1
210 1 28 PHE HZ 1 78 CYS HB2 . . 5.230 3.075 2.147 4.019 . 0 0 "[ . 1 . 2]" 1
211 1 28 PHE HZ 1 78 CYS HB3 . . 5.480 4.325 2.820 5.290 . 0 0 "[ . 1 . 2]" 1
212 1 29 CYS H 1 29 CYS HB3 . . 3.970 2.982 2.855 3.171 . 0 0 "[ . 1 . 2]" 1
213 1 29 CYS H 1 30 ASN H . . 3.310 2.124 1.970 2.353 . 0 0 "[ . 1 . 2]" 1
214 1 29 CYS H 1 30 ASN HA . . 4.550 4.317 4.147 4.517 . 0 0 "[ . 1 . 2]" 1
215 1 29 CYS H 1 31 HIS H . . 5.280 4.970 4.407 5.302 0.022 4 0 "[ . 1 . 2]" 1
216 1 29 CYS HB2 1 31 HIS HD2 . . 4.790 3.263 2.618 3.523 . 0 0 "[ . 1 . 2]" 1
217 1 29 CYS HB2 1 52 VAL MG1 . . 4.400 2.892 2.523 3.588 . 0 0 "[ . 1 . 2]" 1
218 1 29 CYS HB3 1 31 HIS HD2 . . 5.210 4.947 4.276 5.207 . 0 0 "[ . 1 . 2]" 1
219 1 29 CYS HB3 1 52 VAL MG1 . . 5.290 3.540 3.051 4.309 . 0 0 "[ . 1 . 2]" 1
220 1 30 ASN H 1 30 ASN HB3 . . 4.130 4.075 4.042 4.104 . 0 0 "[ . 1 . 2]" 1
221 1 30 ASN H 1 31 HIS H . . 3.870 3.073 2.559 3.306 . 0 0 "[ . 1 . 2]" 1
222 1 30 ASN HA 1 30 ASN HD21 . . 4.830 3.411 2.589 4.362 . 0 0 "[ . 1 . 2]" 1
223 1 30 ASN HB2 1 31 HIS H . . 5.300 4.436 4.285 4.553 . 0 0 "[ . 1 . 2]" 1
224 1 30 ASN HB3 1 31 HIS H . . 5.350 4.175 4.006 4.492 . 0 0 "[ . 1 . 2]" 1
225 1 31 HIS H 1 31 HIS HB2 . . 3.380 2.525 2.265 2.724 . 0 0 "[ . 1 . 2]" 1
226 1 31 HIS H 1 31 HIS HB3 . . 3.830 3.326 3.108 3.646 . 0 0 "[ . 1 . 2]" 1
227 1 31 HIS H 1 31 HIS HD2 . . 4.700 4.423 3.863 4.709 0.009 1 0 "[ . 1 . 2]" 1
228 1 31 HIS H 1 32 GLU H . . 5.360 3.184 2.566 4.135 . 0 0 "[ . 1 . 2]" 1
229 1 31 HIS H 1 52 VAL HB . . 5.450 5.122 4.232 5.457 0.007 2 0 "[ . 1 . 2]" 1
230 1 31 HIS HA 1 31 HIS HD2 . . 5.080 3.220 2.942 3.522 . 0 0 "[ . 1 . 2]" 1
231 1 31 HIS HA 1 32 GLU H . . 3.270 2.592 2.145 2.936 . 0 0 "[ . 1 . 2]" 1
232 1 31 HIS HA 1 32 GLU QB . . 4.460 3.888 3.706 4.332 . 0 0 "[ . 1 . 2]" 1
233 1 31 HIS HA 1 52 VAL MG2 . . 4.840 4.377 4.203 4.842 0.002 7 0 "[ . 1 . 2]" 1
234 1 31 HIS HB2 1 32 GLU H . . 5.500 4.496 4.306 4.652 . 0 0 "[ . 1 . 2]" 1
235 1 31 HIS HB2 1 34 SER HB2 . . 4.230 3.265 2.546 4.052 . 0 0 "[ . 1 . 2]" 1
236 1 31 HIS HB2 1 34 SER HB3 . . 4.670 4.043 3.497 4.655 . 0 0 "[ . 1 . 2]" 1
237 1 31 HIS HB2 1 52 VAL MG1 . . 5.500 3.055 2.356 3.546 . 0 0 "[ . 1 . 2]" 1
238 1 31 HIS HB2 1 52 VAL MG2 . . 4.050 2.311 1.976 2.745 . 0 0 "[ . 1 . 2]" 1
239 1 31 HIS HB3 1 32 GLU H . . 5.250 4.136 3.792 4.283 . 0 0 "[ . 1 . 2]" 1
240 1 31 HIS HB3 1 34 SER HA . . 5.500 5.071 4.578 5.536 0.036 1 0 "[ . 1 . 2]" 1
241 1 31 HIS HB3 1 34 SER HB2 . . 4.140 2.918 2.365 3.458 . 0 0 "[ . 1 . 2]" 1
242 1 31 HIS HB3 1 34 SER HB3 . . 4.460 3.621 3.218 3.978 . 0 0 "[ . 1 . 2]" 1
243 1 31 HIS HB3 1 52 VAL HB . . 5.500 4.297 3.564 4.901 . 0 0 "[ . 1 . 2]" 1
244 1 31 HIS HB3 1 52 VAL MG1 . . 5.250 3.876 3.164 4.451 . 0 0 "[ . 1 . 2]" 1
245 1 31 HIS HB3 1 52 VAL MG2 . . 4.040 2.323 1.921 2.998 . 0 0 "[ . 1 . 2]" 1
246 1 31 HIS HD2 1 52 VAL MG1 . . 4.300 2.748 2.333 3.117 . 0 0 "[ . 1 . 2]" 1
247 1 31 HIS HD2 1 52 VAL MG2 . . 4.470 3.755 3.271 4.196 . 0 0 "[ . 1 . 2]" 1
248 1 31 HIS HE1 1 52 VAL MG1 . . 4.870 3.956 3.140 4.718 . 0 0 "[ . 1 . 2]" 1
249 1 32 GLU H 1 32 GLU QB . . 3.370 2.671 2.114 3.090 . 0 0 "[ . 1 . 2]" 1
250 1 32 GLU H 1 32 GLU QG . . 4.350 3.658 2.903 3.988 . 0 0 "[ . 1 . 2]" 1
251 1 32 GLU HA 1 33 LYS HA . . 4.860 4.411 4.331 4.620 . 0 0 "[ . 1 . 2]" 1
252 1 32 GLU HA 1 33 LYS QG . . 4.920 3.887 3.372 4.706 . 0 0 "[ . 1 . 2]" 1
253 1 32 GLU HA 1 34 SER H . . 5.500 5.133 4.057 5.518 0.018 18 0 "[ . 1 . 2]" 1
254 1 32 GLU QG 1 33 LYS QG . . 4.730 3.201 2.299 4.003 . 0 0 "[ . 1 . 2]" 1
255 1 33 LYS H 1 33 LYS QG . . 5.110 2.635 1.860 3.259 . 0 0 "[ . 1 . 2]" 1
256 1 33 LYS HA 1 34 SER HA . . 5.500 4.342 4.317 4.388 . 0 0 "[ . 1 . 2]" 1
257 1 33 LYS HA 1 35 CYS H . . 4.430 3.801 3.563 4.432 0.002 15 0 "[ . 1 . 2]" 1
258 1 34 SER H 1 35 CYS H . . 3.810 2.423 1.753 3.442 . 0 0 "[ . 1 . 2]" 1
259 1 34 SER HA 1 51 THR H . . 4.860 4.285 3.851 4.665 . 0 0 "[ . 1 . 2]" 1
260 1 34 SER HA 1 51 THR MG . . 5.240 3.075 2.433 3.705 . 0 0 "[ . 1 . 2]" 1
261 1 34 SER HA 1 52 VAL MG2 . . 4.550 4.176 3.737 4.503 . 0 0 "[ . 1 . 2]" 1
262 1 34 SER HB2 1 35 CYS H . . 5.370 4.230 2.814 4.505 . 0 0 "[ . 1 . 2]" 1
263 1 34 SER HB2 1 50 CYS HA . . 5.320 5.121 4.804 5.324 0.004 7 0 "[ . 1 . 2]" 1
264 1 34 SER HB2 1 51 THR H . . 4.770 3.926 3.576 4.127 . 0 0 "[ . 1 . 2]" 1
265 1 34 SER HB2 1 52 VAL H . . 5.500 5.233 4.795 5.501 0.001 14 0 "[ . 1 . 2]" 1
266 1 34 SER HB2 1 52 VAL HB . . 5.460 4.357 4.029 4.610 . 0 0 "[ . 1 . 2]" 1
267 1 34 SER HB2 1 52 VAL MG2 . . 3.870 2.858 2.605 3.322 . 0 0 "[ . 1 . 2]" 1
268 1 34 SER HB3 1 35 CYS H . . 5.320 4.371 3.721 4.471 . 0 0 "[ . 1 . 2]" 1
269 1 34 SER HB3 1 50 CYS HA . . 4.840 4.550 4.170 4.816 . 0 0 "[ . 1 . 2]" 1
270 1 34 SER HB3 1 51 THR H . . 4.380 2.750 2.471 3.083 . 0 0 "[ . 1 . 2]" 1
271 1 34 SER HB3 1 52 VAL H . . 4.760 4.102 3.624 4.515 . 0 0 "[ . 1 . 2]" 1
272 1 34 SER HB3 1 52 VAL HB . . 5.140 3.953 3.556 4.355 . 0 0 "[ . 1 . 2]" 1
273 1 34 SER HB3 1 52 VAL MG2 . . 3.710 2.141 1.956 2.434 . 0 0 "[ . 1 . 2]" 1
274 1 34 SER HG 1 51 THR MG . . 5.050 4.523 3.844 5.055 0.005 14 0 "[ . 1 . 2]" 1
275 1 35 CYS H 1 35 CYS HB2 . . 3.780 2.769 2.327 2.956 . 0 0 "[ . 1 . 2]" 1
276 1 35 CYS H 1 35 CYS HB3 . . 4.120 3.831 3.577 3.935 . 0 0 "[ . 1 . 2]" 1
277 1 35 CYS H 1 35 CYS HG . . 3.910 3.573 3.029 3.899 . 0 0 "[ . 1 . 2]" 1
278 1 35 CYS H 1 36 ASP H . . 5.210 4.339 4.177 4.483 . 0 0 "[ . 1 . 2]" 1
279 1 35 CYS H 1 50 CYS HA . . 5.280 4.798 4.368 4.992 . 0 0 "[ . 1 . 2]" 1
280 1 35 CYS HA 1 36 ASP HB2 . . 5.500 4.439 4.047 5.491 . 0 0 "[ . 1 . 2]" 1
281 1 35 CYS HA 1 36 ASP HB3 . . 5.500 4.791 4.072 5.465 . 0 0 "[ . 1 . 2]" 1
282 1 35 CYS HA 1 50 CYS HA . . 3.560 2.324 2.138 2.513 . 0 0 "[ . 1 . 2]" 1
283 1 35 CYS HA 1 50 CYS HB2 . . 5.500 4.568 4.309 4.839 . 0 0 "[ . 1 . 2]" 1
284 1 35 CYS HA 1 51 THR H . . 4.230 3.672 3.269 3.886 . 0 0 "[ . 1 . 2]" 1
285 1 35 CYS HA 1 51 THR MG . . 4.630 2.978 2.252 3.561 . 0 0 "[ . 1 . 2]" 1
286 1 35 CYS HB2 1 36 ASP H . . 5.150 4.030 3.535 4.294 . 0 0 "[ . 1 . 2]" 1
287 1 35 CYS HB2 1 48 ILE MD . . 4.130 3.382 2.959 3.627 . 0 0 "[ . 1 . 2]" 1
288 1 35 CYS HB2 1 48 ILE HG12 . . 5.000 4.712 4.162 4.998 . 0 0 "[ . 1 . 2]" 1
289 1 35 CYS HB2 1 48 ILE HG13 . . 4.850 4.713 4.432 4.865 0.015 10 0 "[ . 1 . 2]" 1
290 1 35 CYS HB2 1 50 CYS HA . . 4.980 4.654 4.216 4.992 0.012 2 0 "[ . 1 . 2]" 1
291 1 35 CYS HB2 1 74 TRP HZ3 . . 5.050 4.348 3.442 4.979 . 0 0 "[ . 1 . 2]" 1
292 1 35 CYS HB3 1 36 ASP H . . 4.640 2.940 2.438 3.387 . 0 0 "[ . 1 . 2]" 1
293 1 35 CYS HB3 1 48 ILE MD . . 3.740 2.488 2.174 2.944 . 0 0 "[ . 1 . 2]" 1
294 1 35 CYS HB3 1 48 ILE HG12 . . 4.450 3.071 2.547 3.340 . 0 0 "[ . 1 . 2]" 1
295 1 35 CYS HB3 1 48 ILE HG13 . . 4.460 3.216 2.908 3.543 . 0 0 "[ . 1 . 2]" 1
296 1 35 CYS HB3 1 48 ILE MG . . 5.450 4.701 4.296 4.991 . 0 0 "[ . 1 . 2]" 1
297 1 35 CYS HB3 1 49 SER H . . 4.570 3.774 3.372 4.115 . 0 0 "[ . 1 . 2]" 1
298 1 35 CYS HB3 1 50 CYS HA . . 5.110 3.901 3.309 4.342 . 0 0 "[ . 1 . 2]" 1
299 1 35 CYS HB3 1 74 TRP HZ3 . . 4.810 3.615 3.159 3.956 . 0 0 "[ . 1 . 2]" 1
300 1 35 CYS HG 1 50 CYS HA . . 5.050 3.352 2.003 4.433 . 0 0 "[ . 1 . 2]" 1
301 1 36 ASP H 1 36 ASP HB2 . . 4.030 2.974 2.480 3.787 . 0 0 "[ . 1 . 2]" 1
302 1 36 ASP H 1 36 ASP HB3 . . 3.810 2.909 2.516 3.912 0.102 9 0 "[ . 1 . 2]" 1
303 1 36 ASP H 1 37 VAL H . . 4.980 4.350 4.131 4.469 . 0 0 "[ . 1 . 2]" 1
304 1 36 ASP H 1 49 SER H . . 4.180 2.812 2.544 3.062 . 0 0 "[ . 1 . 2]" 1
305 1 36 ASP H 1 50 CYS HA . . 4.450 3.737 3.558 3.959 . 0 0 "[ . 1 . 2]" 1
306 1 36 ASP H 1 51 THR H . . 5.500 5.419 5.259 5.507 0.007 3 0 "[ . 1 . 2]" 1
307 1 36 ASP H 1 51 THR MG . . 4.770 3.758 3.461 4.039 . 0 0 "[ . 1 . 2]" 1
308 1 36 ASP HA 1 37 VAL H . . 3.080 2.160 2.140 2.230 . 0 0 "[ . 1 . 2]" 1
309 1 36 ASP HA 1 37 VAL HB . . 5.450 4.607 4.552 4.701 . 0 0 "[ . 1 . 2]" 1
310 1 36 ASP HA 1 37 VAL MG2 . . 4.420 3.609 3.379 3.801 . 0 0 "[ . 1 . 2]" 1
311 1 36 ASP HB2 1 37 VAL H . . 4.550 4.191 3.365 4.490 . 0 0 "[ . 1 . 2]" 1
312 1 36 ASP HB2 1 51 THR MG . . 4.300 3.766 3.159 4.833 0.533 7 1 "[ . + 1 . 2]" 1
313 1 36 ASP HB3 1 37 VAL H . . 4.270 3.986 3.578 4.398 0.128 17 0 "[ . 1 . 2]" 1
314 1 36 ASP HB3 1 37 VAL MG2 . . 5.480 5.266 5.087 5.581 0.101 17 0 "[ . 1 . 2]" 1
315 1 36 ASP HB3 1 49 SER H . . 5.260 4.297 3.792 5.731 0.471 7 0 "[ . 1 . 2]" 1
316 1 36 ASP HB3 1 51 THR MG . . 4.820 4.334 3.403 4.834 0.014 14 0 "[ . 1 . 2]" 1
317 1 37 VAL H 1 37 VAL HB . . 3.470 2.536 2.490 2.591 . 0 0 "[ . 1 . 2]" 1
318 1 37 VAL H 1 37 VAL MG1 . . 4.390 3.807 3.784 3.825 . 0 0 "[ . 1 . 2]" 1
319 1 37 VAL H 1 37 VAL MG2 . . 3.660 2.566 2.449 2.736 . 0 0 "[ . 1 . 2]" 1
320 1 37 VAL H 1 38 LYS H . . 4.600 4.403 4.316 4.487 . 0 0 "[ . 1 . 2]" 1
321 1 37 VAL HA 1 37 VAL MG1 . . 3.380 2.347 2.277 2.441 . 0 0 "[ . 1 . 2]" 1
322 1 37 VAL HA 1 37 VAL MG2 . . 3.500 2.387 2.281 2.467 . 0 0 "[ . 1 . 2]" 1
323 1 37 VAL HA 1 38 LYS H . . 2.970 2.148 2.139 2.175 . 0 0 "[ . 1 . 2]" 1
324 1 37 VAL HA 1 38 LYS HB2 . . 5.130 4.157 4.079 4.209 . 0 0 "[ . 1 . 2]" 1
325 1 37 VAL HA 1 38 LYS HB3 . . 5.500 5.315 4.994 5.438 . 0 0 "[ . 1 . 2]" 1
326 1 37 VAL HA 1 47 VAL MG1 . . 5.500 5.330 5.137 5.502 0.002 20 0 "[ . 1 . 2]" 1
327 1 37 VAL HA 1 48 ILE HA . . 3.430 2.328 2.106 2.529 . 0 0 "[ . 1 . 2]" 1
328 1 37 VAL HA 1 48 ILE HB . . 4.500 3.285 3.076 3.678 . 0 0 "[ . 1 . 2]" 1
329 1 37 VAL HA 1 48 ILE MD . . 5.010 3.651 3.341 3.865 . 0 0 "[ . 1 . 2]" 1
330 1 37 VAL HA 1 48 ILE HG12 . . 5.380 4.483 4.270 4.715 . 0 0 "[ . 1 . 2]" 1
331 1 37 VAL HA 1 48 ILE HG13 . . 4.880 2.843 2.627 3.041 . 0 0 "[ . 1 . 2]" 1
332 1 37 VAL HA 1 48 ILE MG . . 5.140 4.599 4.459 4.819 . 0 0 "[ . 1 . 2]" 1
333 1 37 VAL HA 1 49 SER H . . 4.250 3.898 3.729 4.072 . 0 0 "[ . 1 . 2]" 1
334 1 37 VAL HA 1 70 VAL MG1 . . 4.810 4.041 3.706 4.574 . 0 0 "[ . 1 . 2]" 1
335 1 37 VAL HB 1 38 LYS H . . 4.900 4.232 4.085 4.349 . 0 0 "[ . 1 . 2]" 1
336 1 37 VAL HB 1 39 MET ME . . 5.500 5.424 5.200 5.513 0.013 7 0 "[ . 1 . 2]" 1
337 1 37 VAL HB 1 67 PRO HA . . 4.470 3.793 3.446 4.160 . 0 0 "[ . 1 . 2]" 1
338 1 37 VAL HB 1 67 PRO HB2 . . 3.770 3.296 2.756 3.571 . 0 0 "[ . 1 . 2]" 1
339 1 37 VAL MG1 1 38 LYS H . . 3.450 2.571 2.181 2.973 . 0 0 "[ . 1 . 2]" 1
340 1 37 VAL MG1 1 38 LYS HA . . 4.640 3.840 3.683 3.992 . 0 0 "[ . 1 . 2]" 1
341 1 37 VAL MG1 1 39 MET HA . . 5.060 3.779 3.693 3.868 . 0 0 "[ . 1 . 2]" 1
342 1 37 VAL MG1 1 39 MET ME . . 4.180 3.382 3.112 3.658 . 0 0 "[ . 1 . 2]" 1
343 1 37 VAL MG1 1 39 MET HG2 . . 3.670 2.487 2.265 2.913 . 0 0 "[ . 1 . 2]" 1
344 1 37 VAL MG1 1 40 ASP H . . 5.440 5.333 5.228 5.446 0.006 1 0 "[ . 1 . 2]" 1
345 1 37 VAL MG1 1 47 VAL H . . 4.040 3.940 3.775 4.068 0.028 18 0 "[ . 1 . 2]" 1
346 1 37 VAL MG1 1 48 ILE HA . . 4.400 3.783 3.585 3.915 . 0 0 "[ . 1 . 2]" 1
347 1 37 VAL MG1 1 48 ILE HB . . 4.000 3.396 3.074 3.689 . 0 0 "[ . 1 . 2]" 1
348 1 37 VAL MG1 1 49 SER H . . 5.500 5.454 5.275 5.524 0.024 14 0 "[ . 1 . 2]" 1
349 1 37 VAL MG1 1 67 PRO HA . . 3.230 2.332 2.022 2.521 . 0 0 "[ . 1 . 2]" 1
350 1 37 VAL MG1 1 67 PRO HB2 . . 3.780 3.475 3.253 3.783 0.003 14 0 "[ . 1 . 2]" 1
351 1 37 VAL MG1 1 67 PRO HB3 . . 4.460 3.011 2.666 3.439 . 0 0 "[ . 1 . 2]" 1
352 1 37 VAL MG1 1 69 ASP H . . 5.500 5.477 5.374 5.523 0.023 16 0 "[ . 1 . 2]" 1
353 1 37 VAL MG1 1 70 VAL H . . 4.680 4.168 4.014 4.345 . 0 0 "[ . 1 . 2]" 1
354 1 37 VAL MG1 1 70 VAL HB . . 3.620 2.379 2.083 2.701 . 0 0 "[ . 1 . 2]" 1
355 1 37 VAL MG2 1 38 LYS H . . 4.260 4.052 3.953 4.126 . 0 0 "[ . 1 . 2]" 1
356 1 37 VAL MG2 1 39 MET HG2 . . 5.240 5.076 4.968 5.239 . 0 0 "[ . 1 . 2]" 1
357 1 37 VAL MG2 1 48 ILE HA . . 3.900 3.572 3.240 3.909 0.009 14 0 "[ . 1 . 2]" 1
358 1 37 VAL MG2 1 48 ILE HB . . 3.410 2.887 2.564 3.230 . 0 0 "[ . 1 . 2]" 1
359 1 37 VAL MG2 1 48 ILE HG13 . . 3.680 2.541 2.041 2.991 . 0 0 "[ . 1 . 2]" 1
360 1 37 VAL MG2 1 48 ILE MG . . 4.400 3.994 3.758 4.266 . 0 0 "[ . 1 . 2]" 1
361 1 37 VAL MG2 1 49 SER H . . 4.780 4.224 3.892 4.592 . 0 0 "[ . 1 . 2]" 1
362 1 37 VAL MG2 1 67 PRO HA . . 3.950 3.655 3.419 3.936 . 0 0 "[ . 1 . 2]" 1
363 1 37 VAL MG2 1 67 PRO HB2 . . 3.680 3.452 3.103 3.676 . 0 0 "[ . 1 . 2]" 1
364 1 37 VAL MG2 1 67 PRO HG2 . . 5.500 5.324 5.001 5.508 0.008 13 0 "[ . 1 . 2]" 1
365 1 37 VAL MG2 1 70 VAL HB . . 3.960 2.968 2.610 3.242 . 0 0 "[ . 1 . 2]" 1
366 1 37 VAL MG2 1 71 TYR H . . 4.650 3.802 3.585 4.043 . 0 0 "[ . 1 . 2]" 1
367 1 37 VAL MG2 1 71 TYR HB2 . . 4.780 3.489 3.116 3.788 . 0 0 "[ . 1 . 2]" 1
368 1 37 VAL MG2 1 71 TYR HB3 . . 5.300 4.626 4.299 4.957 . 0 0 "[ . 1 . 2]" 1
369 1 37 VAL MG2 1 74 TRP HE3 . . 5.500 5.324 5.089 5.504 0.004 11 0 "[ . 1 . 2]" 1
370 1 38 LYS H 1 38 LYS HB2 . . 3.680 2.335 2.239 2.614 . 0 0 "[ . 1 . 2]" 1
371 1 38 LYS H 1 38 LYS HB3 . . 3.780 3.209 2.888 3.338 . 0 0 "[ . 1 . 2]" 1
372 1 38 LYS H 1 38 LYS HG2 . . 4.920 4.528 3.882 4.901 . 0 0 "[ . 1 . 2]" 1
373 1 38 LYS H 1 38 LYS HG3 . . 4.770 4.211 3.841 4.556 . 0 0 "[ . 1 . 2]" 1
374 1 38 LYS H 1 47 VAL H . . 3.700 3.262 3.087 3.555 . 0 0 "[ . 1 . 2]" 1
375 1 38 LYS H 1 47 VAL HB . . 4.320 4.008 3.719 4.154 . 0 0 "[ . 1 . 2]" 1
376 1 38 LYS H 1 47 VAL MG1 . . 4.630 4.406 4.206 4.539 . 0 0 "[ . 1 . 2]" 1
377 1 38 LYS H 1 48 ILE HA . . 4.150 2.981 2.793 3.181 . 0 0 "[ . 1 . 2]" 1
378 1 38 LYS H 1 48 ILE HB . . 5.190 4.356 4.132 4.690 . 0 0 "[ . 1 . 2]" 1
379 1 38 LYS H 1 49 SER H . . 5.240 5.045 4.852 5.232 . 0 0 "[ . 1 . 2]" 1
380 1 38 LYS HA 1 39 MET H . . 3.470 2.187 2.156 2.203 . 0 0 "[ . 1 . 2]" 1
381 1 38 LYS HA 1 39 MET HB2 . . 5.280 4.693 4.629 4.756 . 0 0 "[ . 1 . 2]" 1
382 1 38 LYS HA 1 39 MET HG2 . . 5.250 4.446 3.823 4.839 . 0 0 "[ . 1 . 2]" 1
383 1 38 LYS HA 1 39 MET HG3 . . 5.500 4.728 4.290 5.523 0.023 20 0 "[ . 1 . 2]" 1
384 1 38 LYS HB2 1 39 MET H . . 5.310 4.636 4.606 4.653 . 0 0 "[ . 1 . 2]" 1
385 1 38 LYS HB2 1 47 VAL H . . 4.180 3.663 3.427 3.958 . 0 0 "[ . 1 . 2]" 1
386 1 38 LYS HB2 1 47 VAL HB . . 3.820 3.025 2.709 3.217 . 0 0 "[ . 1 . 2]" 1
387 1 38 LYS HB2 1 47 VAL MG1 . . 4.000 3.772 3.540 3.914 . 0 0 "[ . 1 . 2]" 1
388 1 38 LYS HB2 1 48 ILE H . . 5.500 5.461 5.325 5.587 0.087 6 0 "[ . 1 . 2]" 1
389 1 38 LYS HB3 1 38 LYS HE2 . . 5.500 4.102 2.699 5.248 . 0 0 "[ . 1 . 2]" 1
390 1 38 LYS HB3 1 38 LYS HE3 . . 5.500 4.317 3.085 5.231 . 0 0 "[ . 1 . 2]" 1
391 1 38 LYS HB3 1 39 MET H . . 5.090 4.049 3.899 4.245 . 0 0 "[ . 1 . 2]" 1
392 1 38 LYS HB3 1 46 GLY HA2 . . 5.500 4.517 4.071 5.026 . 0 0 "[ . 1 . 2]" 1
393 1 38 LYS HB3 1 47 VAL H . . 4.290 3.075 2.422 3.491 . 0 0 "[ . 1 . 2]" 1
394 1 38 LYS HB3 1 47 VAL HA . . 5.470 5.247 4.536 5.477 0.007 19 0 "[ . 1 . 2]" 1
395 1 38 LYS HB3 1 47 VAL HB . . 3.840 2.845 2.257 3.123 . 0 0 "[ . 1 . 2]" 1
396 1 38 LYS HB3 1 47 VAL MG1 . . 4.620 4.207 3.768 4.443 . 0 0 "[ . 1 . 2]" 1
397 1 38 LYS HB3 1 47 VAL MG2 . . 4.840 3.913 3.452 4.237 . 0 0 "[ . 1 . 2]" 1
398 1 38 LYS HG3 1 39 MET H . . 5.290 4.415 3.628 5.440 0.150 8 0 "[ . 1 . 2]" 1
399 1 39 MET H 1 39 MET ME . . 5.500 4.715 4.568 4.871 . 0 0 "[ . 1 . 2]" 1
400 1 39 MET H 1 39 MET HG2 . . 4.390 2.771 2.123 3.133 . 0 0 "[ . 1 . 2]" 1
401 1 39 MET H 1 39 MET HG3 . . 4.750 2.886 2.468 3.714 . 0 0 "[ . 1 . 2]" 1
402 1 39 MET HA 1 39 MET ME . . 3.870 3.318 2.979 3.786 . 0 0 "[ . 1 . 2]" 1
403 1 39 MET HA 1 39 MET HG2 . . 4.190 2.638 2.382 3.132 . 0 0 "[ . 1 . 2]" 1
404 1 39 MET HA 1 40 ASP H . . 3.250 2.200 2.144 2.219 . 0 0 "[ . 1 . 2]" 1
405 1 39 MET HA 1 40 ASP HB2 . . 5.380 4.580 4.428 4.781 . 0 0 "[ . 1 . 2]" 1
406 1 39 MET HA 1 45 THR H . . 5.500 5.418 5.236 5.526 0.026 7 0 "[ . 1 . 2]" 1
407 1 39 MET HA 1 46 GLY H . . 5.390 4.928 4.705 5.122 . 0 0 "[ . 1 . 2]" 1
408 1 39 MET HA 1 46 GLY HA2 . . 3.690 2.643 2.310 2.858 . 0 0 "[ . 1 . 2]" 1
409 1 39 MET HA 1 46 GLY HA3 . . 4.280 3.593 3.281 3.800 . 0 0 "[ . 1 . 2]" 1
410 1 39 MET HA 1 47 VAL H . . 4.120 3.908 3.323 4.111 . 0 0 "[ . 1 . 2]" 1
411 1 39 MET HA 1 61 ILE MD . . 4.500 3.015 2.609 3.362 . 0 0 "[ . 1 . 2]" 1
412 1 39 MET HA 1 61 ILE HG12 . . 4.340 3.557 3.259 3.790 . 0 0 "[ . 1 . 2]" 1
413 1 39 MET HA 1 61 ILE MG . . 5.160 4.352 3.949 4.601 . 0 0 "[ . 1 . 2]" 1
414 1 39 MET HA 1 70 VAL MG2 . . 5.070 4.310 4.121 4.601 . 0 0 "[ . 1 . 2]" 1
415 1 39 MET HB2 1 39 MET ME . . 3.880 3.713 3.396 3.882 0.002 10 0 "[ . 1 . 2]" 1
416 1 39 MET HB2 1 40 ASP H . . 5.360 4.413 4.287 4.465 . 0 0 "[ . 1 . 2]" 1
417 1 39 MET HB2 1 41 ARG H . . 5.380 5.239 5.065 5.350 . 0 0 "[ . 1 . 2]" 1
418 1 39 MET HB2 1 61 ILE MD . . 4.690 4.221 3.967 4.682 . 0 0 "[ . 1 . 2]" 1
419 1 39 MET HB3 1 39 MET ME . . 4.370 2.544 2.074 2.751 . 0 0 "[ . 1 . 2]" 1
420 1 39 MET HB3 1 40 ASP H . . 5.290 3.879 3.612 3.948 . 0 0 "[ . 1 . 2]" 1
421 1 39 MET HB3 1 61 ILE MD . . 3.830 2.784 2.545 3.302 . 0 0 "[ . 1 . 2]" 1
422 1 39 MET ME 1 39 MET HG2 . . 3.490 2.538 2.098 3.376 . 0 0 "[ . 1 . 2]" 1
423 1 39 MET ME 1 39 MET HG3 . . 3.870 3.003 2.169 3.341 . 0 0 "[ . 1 . 2]" 1
424 1 39 MET ME 1 40 ASP H . . 5.040 4.830 4.586 5.048 0.008 20 0 "[ . 1 . 2]" 1
425 1 39 MET ME 1 41 ARG HD3 . . 5.280 5.040 4.399 5.592 0.312 18 0 "[ . 1 . 2]" 1
426 1 39 MET ME 1 46 GLY HA3 . . 4.370 4.016 3.675 4.342 . 0 0 "[ . 1 . 2]" 1
427 1 39 MET ME 1 61 ILE HB . . 4.550 2.978 2.553 3.247 . 0 0 "[ . 1 . 2]" 1
428 1 39 MET ME 1 61 ILE MD . . 2.860 2.225 1.940 2.447 . 0 0 "[ . 1 . 2]" 1
429 1 39 MET ME 1 61 ILE HG13 . . 4.960 4.518 4.242 4.705 . 0 0 "[ . 1 . 2]" 1
430 1 39 MET ME 1 61 ILE MG . . 3.130 2.969 2.596 3.139 0.009 11 0 "[ . 1 . 2]" 1
431 1 39 MET ME 1 62 THR H . . 4.690 4.106 3.716 4.438 . 0 0 "[ . 1 . 2]" 1
432 1 39 MET ME 1 65 SER H . . 5.160 4.583 4.157 4.912 . 0 0 "[ . 1 . 2]" 1
433 1 39 MET ME 1 65 SER HA . . 5.010 4.257 3.766 4.613 . 0 0 "[ . 1 . 2]" 1
434 1 39 MET ME 1 65 SER HB2 . . 3.280 2.823 2.339 3.152 . 0 0 "[ . 1 . 2]" 1
435 1 39 MET ME 1 65 SER HB3 . . 3.250 2.798 2.360 3.226 . 0 0 "[ . 1 . 2]" 1
436 1 39 MET ME 1 66 GLU H . . 4.050 3.164 2.703 3.560 . 0 0 "[ . 1 . 2]" 1
437 1 39 MET ME 1 66 GLU HA . . 3.200 2.671 2.323 2.992 . 0 0 "[ . 1 . 2]" 1
438 1 39 MET ME 1 67 PRO HA . . 3.420 2.830 2.572 3.101 . 0 0 "[ . 1 . 2]" 1
439 1 39 MET ME 1 67 PRO HD2 . . 4.210 4.122 3.935 4.232 0.022 7 0 "[ . 1 . 2]" 1
440 1 39 MET ME 1 67 PRO HD3 . . 3.600 3.221 2.904 3.462 . 0 0 "[ . 1 . 2]" 1
441 1 39 MET ME 1 68 VAL H . . 4.960 4.417 4.250 4.568 . 0 0 "[ . 1 . 2]" 1
442 1 39 MET ME 1 69 ASP HB2 . . 4.980 4.860 4.369 5.142 0.162 14 0 "[ . 1 . 2]" 1
443 1 39 MET ME 1 69 ASP HB3 . . 5.140 4.820 4.468 5.140 . 0 0 "[ . 1 . 2]" 1
444 1 39 MET ME 1 70 VAL H . . 4.520 4.179 3.917 4.421 . 0 0 "[ . 1 . 2]" 1
445 1 39 MET ME 1 70 VAL MG2 . . 3.020 2.642 2.404 2.968 . 0 0 "[ . 1 . 2]" 1
446 1 39 MET HG2 1 61 ILE MD . . 5.480 4.223 3.609 5.051 . 0 0 "[ . 1 . 2]" 1
447 1 39 MET HG2 1 67 PRO HA . . 5.380 3.550 3.148 4.079 . 0 0 "[ . 1 . 2]" 1
448 1 39 MET HG2 1 67 PRO HD3 . . 5.300 4.850 4.475 5.306 0.006 8 0 "[ . 1 . 2]" 1
449 1 39 MET HG3 1 61 ILE MD . . 5.500 4.810 4.263 5.455 . 0 0 "[ . 1 . 2]" 1
450 1 39 MET HG3 1 67 PRO HA . . 5.500 3.860 3.471 4.274 . 0 0 "[ . 1 . 2]" 1
451 1 39 MET HG3 1 67 PRO HD3 . . 5.470 4.120 3.389 4.669 . 0 0 "[ . 1 . 2]" 1
452 1 40 ASP H 1 40 ASP HB2 . . 3.790 2.608 2.492 2.786 . 0 0 "[ . 1 . 2]" 1
453 1 40 ASP H 1 40 ASP HB3 . . 3.750 2.690 2.507 2.772 . 0 0 "[ . 1 . 2]" 1
454 1 40 ASP H 1 45 THR H . . 4.290 3.689 3.535 3.886 . 0 0 "[ . 1 . 2]" 1
455 1 40 ASP H 1 45 THR HB . . 5.500 5.170 5.001 5.330 . 0 0 "[ . 1 . 2]" 1
456 1 40 ASP H 1 46 GLY HA2 . . 4.280 2.661 2.387 2.824 . 0 0 "[ . 1 . 2]" 1
457 1 40 ASP H 1 46 GLY HA3 . . 4.820 4.202 3.991 4.387 . 0 0 "[ . 1 . 2]" 1
458 1 40 ASP H 1 61 ILE MD . . 3.840 3.080 2.243 3.552 . 0 0 "[ . 1 . 2]" 1
459 1 40 ASP H 1 61 ILE HG12 . . 4.520 3.688 3.370 3.902 . 0 0 "[ . 1 . 2]" 1
460 1 40 ASP HA 1 41 ARG H . . 3.350 2.164 2.148 2.171 . 0 0 "[ . 1 . 2]" 1
461 1 40 ASP HB2 1 41 ARG H . . 4.610 4.528 4.439 4.554 . 0 0 "[ . 1 . 2]" 1
462 1 40 ASP HB2 1 43 ARG H . . 5.260 4.824 4.561 4.963 . 0 0 "[ . 1 . 2]" 1
463 1 40 ASP HB2 1 43 ARG HB2 . . 5.190 4.282 3.501 4.796 . 0 0 "[ . 1 . 2]" 1
464 1 40 ASP HB2 1 45 THR H . . 4.390 4.193 4.005 4.387 . 0 0 "[ . 1 . 2]" 1
465 1 40 ASP HB2 1 45 THR HB . . 4.940 4.776 4.593 4.949 0.009 5 0 "[ . 1 . 2]" 1
466 1 40 ASP HB2 1 45 THR MG . . 5.080 4.996 4.660 5.101 0.021 12 0 "[ . 1 . 2]" 1
467 1 40 ASP HB2 1 47 VAL MG2 . . 5.310 3.983 3.159 4.314 . 0 0 "[ . 1 . 2]" 1
468 1 40 ASP HB3 1 41 ARG H . . 5.000 4.299 4.239 4.393 . 0 0 "[ . 1 . 2]" 1
469 1 40 ASP HB3 1 43 ARG H . . 4.580 3.636 3.307 4.034 . 0 0 "[ . 1 . 2]" 1
470 1 40 ASP HB3 1 43 ARG HB2 . . 4.860 2.914 2.262 3.357 . 0 0 "[ . 1 . 2]" 1
471 1 40 ASP HB3 1 44 ASN H . . 4.510 3.808 3.488 4.361 . 0 0 "[ . 1 . 2]" 1
472 1 40 ASP HB3 1 45 THR H . . 3.630 2.525 2.358 2.749 . 0 0 "[ . 1 . 2]" 1
473 1 40 ASP HB3 1 45 THR HB . . 4.070 3.482 3.309 3.699 . 0 0 "[ . 1 . 2]" 1
474 1 40 ASP HB3 1 45 THR MG . . 4.650 4.327 4.104 4.485 . 0 0 "[ . 1 . 2]" 1
475 1 40 ASP HB3 1 47 VAL MG2 . . 5.270 4.266 3.709 4.525 . 0 0 "[ . 1 . 2]" 1
476 1 40 ASP HB3 1 61 ILE MD . . 5.500 4.315 4.042 4.560 . 0 0 "[ . 1 . 2]" 1
477 1 40 ASP HB3 1 61 ILE HG12 . . 5.500 5.128 4.852 5.402 . 0 0 "[ . 1 . 2]" 1
478 1 41 ARG H 1 41 ARG HB2 . . 3.760 2.307 2.248 2.446 . 0 0 "[ . 1 . 2]" 1
479 1 41 ARG H 1 41 ARG HB3 . . 4.050 3.557 3.531 3.595 . 0 0 "[ . 1 . 2]" 1
480 1 41 ARG H 1 41 ARG HD2 . . 4.830 4.256 3.211 4.723 . 0 0 "[ . 1 . 2]" 1
481 1 41 ARG H 1 41 ARG HD3 . . 5.310 3.917 1.873 5.091 . 0 0 "[ . 1 . 2]" 1
482 1 41 ARG H 1 41 ARG QG . . 3.800 2.862 2.339 3.490 . 0 0 "[ . 1 . 2]" 1
483 1 41 ARG H 1 43 ARG H . . 5.290 4.088 3.925 4.353 . 0 0 "[ . 1 . 2]" 1
484 1 41 ARG H 1 61 ILE MD . . 4.780 4.251 4.060 4.400 . 0 0 "[ . 1 . 2]" 1
485 1 41 ARG HA 1 41 ARG HD2 . . 3.950 2.875 2.141 3.850 . 0 0 "[ . 1 . 2]" 1
486 1 41 ARG HA 1 41 ARG HD3 . . 3.820 3.228 2.625 3.824 0.004 13 0 "[ . 1 . 2]" 1
487 1 41 ARG HA 1 41 ARG QG . . 3.690 2.492 2.242 2.779 . 0 0 "[ . 1 . 2]" 1
488 1 41 ARG HA 1 42 ALA HA . . 5.240 4.926 4.850 4.963 . 0 0 "[ . 1 . 2]" 1
489 1 41 ARG HA 1 43 ARG H . . 4.700 4.113 3.964 4.245 . 0 0 "[ . 1 . 2]" 1
490 1 41 ARG HA 1 44 ASN H . . 3.830 2.906 2.800 3.064 . 0 0 "[ . 1 . 2]" 1
491 1 41 ARG HA 1 44 ASN HA . . 3.820 2.695 2.562 2.994 . 0 0 "[ . 1 . 2]" 1
492 1 41 ARG HA 1 45 THR H . . 4.460 4.303 4.168 4.506 0.046 18 0 "[ . 1 . 2]" 1
493 1 41 ARG HA 1 61 ILE MD . . 3.580 3.081 2.877 3.260 . 0 0 "[ . 1 . 2]" 1
494 1 41 ARG HA 1 61 ILE HG13 . . 5.010 4.959 4.868 5.025 0.015 20 0 "[ . 1 . 2]" 1
495 1 41 ARG HB2 1 41 ARG HD2 . . 3.960 3.563 3.411 3.741 . 0 0 "[ . 1 . 2]" 1
496 1 41 ARG HB2 1 41 ARG HD3 . . 3.960 3.671 2.273 4.221 0.261 15 0 "[ . 1 . 2]" 1
497 1 41 ARG HB2 1 42 ALA H . . 5.020 2.415 2.184 2.705 . 0 0 "[ . 1 . 2]" 1
498 1 41 ARG HB3 1 41 ARG HD2 . . 4.080 2.866 2.061 4.228 0.148 9 0 "[ . 1 . 2]" 1
499 1 41 ARG HB3 1 42 ALA H . . 4.900 3.170 3.032 3.587 . 0 0 "[ . 1 . 2]" 1
500 1 41 ARG HD2 1 42 ALA H . . 5.500 5.280 4.978 5.802 0.302 9 0 "[ . 1 . 2]" 1
501 1 41 ARG HD2 1 61 ILE MD . . 4.230 3.776 3.100 4.253 0.023 19 0 "[ . 1 . 2]" 1
502 1 41 ARG HD2 1 63 TYR H . . 5.500 4.174 2.960 5.419 . 0 0 "[ . 1 . 2]" 1
503 1 41 ARG HD2 1 63 TYR HA . . 4.560 3.079 2.699 3.548 . 0 0 "[ . 1 . 2]" 1
504 1 41 ARG HD3 1 61 ILE MD . . 4.230 3.587 2.786 4.217 . 0 0 "[ . 1 . 2]" 1
505 1 41 ARG HD3 1 63 TYR HA . . 4.640 2.918 1.999 4.564 . 0 0 "[ . 1 . 2]" 1
506 1 41 ARG QG 1 61 ILE MD . . 3.970 3.541 3.414 3.724 . 0 0 "[ . 1 . 2]" 1
507 1 42 ALA H 1 42 ALA MB . . 3.540 2.171 2.068 2.259 . 0 0 "[ . 1 . 2]" 1
508 1 42 ALA H 1 43 ARG H . . 3.770 2.974 2.807 3.071 . 0 0 "[ . 1 . 2]" 1
509 1 42 ALA HA 1 44 ASN H . . 4.790 4.362 4.019 4.551 . 0 0 "[ . 1 . 2]" 1
510 1 42 ALA MB 1 43 ARG H . . 3.240 2.619 2.491 2.719 . 0 0 "[ . 1 . 2]" 1
511 1 42 ALA MB 1 43 ARG HA . . 4.370 3.928 3.827 4.020 . 0 0 "[ . 1 . 2]" 1
512 1 42 ALA MB 1 43 ARG HD2 . . 5.140 4.130 2.420 5.125 . 0 0 "[ . 1 . 2]" 1
513 1 42 ALA MB 1 43 ARG HD3 . . 5.350 3.523 2.557 5.307 . 0 0 "[ . 1 . 2]" 1
514 1 42 ALA MB 1 44 ASN H . . 4.580 4.233 4.159 4.385 . 0 0 "[ . 1 . 2]" 1
515 1 43 ARG H 1 43 ARG HB2 . . 3.340 2.587 2.266 2.718 . 0 0 "[ . 1 . 2]" 1
516 1 43 ARG H 1 43 ARG HB3 . . 3.770 3.681 3.519 3.749 . 0 0 "[ . 1 . 2]" 1
517 1 43 ARG H 1 43 ARG HD2 . . 5.200 4.301 2.168 5.206 0.006 18 0 "[ . 1 . 2]" 1
518 1 43 ARG H 1 43 ARG HD3 . . 5.480 4.000 2.659 4.973 . 0 0 "[ . 1 . 2]" 1
519 1 43 ARG H 1 43 ARG HG2 . . 4.180 2.677 2.179 4.153 . 0 0 "[ . 1 . 2]" 1
520 1 43 ARG H 1 43 ARG HG3 . . 4.090 3.782 3.267 4.192 0.102 5 0 "[ . 1 . 2]" 1
521 1 43 ARG H 1 44 ASN H . . 3.130 2.139 2.010 2.333 . 0 0 "[ . 1 . 2]" 1
522 1 43 ARG H 1 44 ASN HA . . 4.460 4.358 4.256 4.458 . 0 0 "[ . 1 . 2]" 1
523 1 43 ARG H 1 45 THR H . . 4.260 3.904 3.508 4.055 . 0 0 "[ . 1 . 2]" 1
524 1 43 ARG HA 1 43 ARG HD2 . . 4.840 2.944 2.003 4.705 . 0 0 "[ . 1 . 2]" 1
525 1 43 ARG HA 1 43 ARG HD3 . . 5.220 2.992 2.003 4.447 . 0 0 "[ . 1 . 2]" 1
526 1 43 ARG HA 1 43 ARG HG2 . . 3.510 3.148 2.338 3.659 0.149 5 0 "[ . 1 . 2]" 1
527 1 43 ARG HA 1 43 ARG HG3 . . 3.880 3.651 2.457 3.902 0.022 8 0 "[ . 1 . 2]" 1
528 1 43 ARG HA 1 45 THR H . . 5.270 4.891 4.459 5.074 . 0 0 "[ . 1 . 2]" 1
529 1 43 ARG HB2 1 44 ASN H . . 4.490 3.264 3.012 3.815 . 0 0 "[ . 1 . 2]" 1
530 1 43 ARG HB2 1 45 THR H . . 4.390 3.162 3.082 3.317 . 0 0 "[ . 1 . 2]" 1
531 1 43 ARG HB2 1 45 THR HB . . 4.540 3.137 2.776 3.787 . 0 0 "[ . 1 . 2]" 1
532 1 43 ARG HB2 1 45 THR MG . . 5.180 4.620 4.291 5.075 . 0 0 "[ . 1 . 2]" 1
533 1 43 ARG HB3 1 43 ARG HD2 . . 4.090 2.781 2.064 3.697 . 0 0 "[ . 1 . 2]" 1
534 1 43 ARG HB3 1 44 ASN H . . 4.750 4.157 3.700 4.458 . 0 0 "[ . 1 . 2]" 1
535 1 43 ARG HB3 1 45 THR H . . 4.900 4.203 3.190 4.524 . 0 0 "[ . 1 . 2]" 1
536 1 43 ARG HB3 1 45 THR HB . . 4.690 3.493 2.549 3.736 . 0 0 "[ . 1 . 2]" 1
537 1 43 ARG HB3 1 45 THR MG . . 4.930 4.758 4.079 4.959 0.029 11 0 "[ . 1 . 2]" 1
538 1 43 ARG HG2 1 44 ASN H . . 5.500 4.425 4.110 5.453 . 0 0 "[ . 1 . 2]" 1
539 1 43 ARG HG2 1 45 THR H . . 5.500 5.279 5.147 5.513 0.013 18 0 "[ . 1 . 2]" 1
540 1 43 ARG HG2 1 45 THR HB . . 5.470 5.340 4.616 5.506 0.036 20 0 "[ . 1 . 2]" 1
541 1 43 ARG HG3 1 44 ASN H . . 5.500 5.228 5.012 5.507 0.007 10 0 "[ . 1 . 2]" 1
542 1 43 ARG HG3 1 45 THR H . . 5.500 5.463 5.302 5.557 0.057 18 0 "[ . 1 . 2]" 1
543 1 43 ARG HG3 1 45 THR HB . . 4.820 4.795 4.627 5.486 0.666 18 1 "[ . 1 . + 2]" 1
544 1 44 ASN H 1 61 ILE MD . . 4.630 4.116 3.769 4.338 . 0 0 "[ . 1 . 2]" 1
545 1 44 ASN H 1 61 ILE HG13 . . 5.110 4.891 4.523 5.096 . 0 0 "[ . 1 . 2]" 1
546 1 44 ASN HA 1 44 ASN HD21 . . 4.850 3.507 2.337 4.334 . 0 0 "[ . 1 . 2]" 1
547 1 44 ASN HA 1 45 THR H . . 3.320 2.760 2.708 2.911 . 0 0 "[ . 1 . 2]" 1
548 1 44 ASN HA 1 45 THR HB . . 5.370 5.288 5.192 5.381 0.011 5 0 "[ . 1 . 2]" 1
549 1 44 ASN HA 1 61 ILE H . . 4.600 4.041 3.805 4.345 . 0 0 "[ . 1 . 2]" 1
550 1 44 ASN HA 1 61 ILE MD . . 3.820 2.657 2.287 3.024 . 0 0 "[ . 1 . 2]" 1
551 1 44 ASN HA 1 61 ILE HG12 . . 4.780 4.513 4.175 4.793 0.013 18 0 "[ . 1 . 2]" 1
552 1 44 ASN HA 1 61 ILE HG13 . . 3.870 3.138 2.904 3.260 . 0 0 "[ . 1 . 2]" 1
553 1 44 ASN HA 1 61 ILE MG . . 5.500 5.420 5.275 5.504 0.004 16 0 "[ . 1 . 2]" 1
554 1 44 ASN HB2 1 45 THR H . . 4.800 4.251 4.098 4.336 . 0 0 "[ . 1 . 2]" 1
555 1 44 ASN HB2 1 61 ILE H . . 5.090 4.357 4.050 4.688 . 0 0 "[ . 1 . 2]" 1
556 1 44 ASN HB2 1 61 ILE HG13 . . 5.260 4.870 4.419 5.229 . 0 0 "[ . 1 . 2]" 1
557 1 44 ASN HB3 1 45 THR H . . 5.390 4.475 4.398 4.530 . 0 0 "[ . 1 . 2]" 1
558 1 44 ASN HB3 1 61 ILE H . . 4.200 3.746 3.455 4.122 . 0 0 "[ . 1 . 2]" 1
559 1 44 ASN HB3 1 61 ILE MD . . 4.770 3.982 3.365 4.482 . 0 0 "[ . 1 . 2]" 1
560 1 44 ASN HB3 1 61 ILE HG13 . . 5.050 4.045 3.655 4.485 . 0 0 "[ . 1 . 2]" 1
561 1 45 THR H 1 45 THR HB . . 3.440 2.762 2.689 2.806 . 0 0 "[ . 1 . 2]" 1
562 1 45 THR H 1 45 THR HG1 . . 5.220 3.980 3.215 4.590 . 0 0 "[ . 1 . 2]" 1
563 1 45 THR H 1 45 THR MG . . 4.160 3.857 3.804 3.896 . 0 0 "[ . 1 . 2]" 1
564 1 45 THR H 1 46 GLY H . . 4.670 4.110 4.045 4.266 . 0 0 "[ . 1 . 2]" 1
565 1 45 THR H 1 47 VAL MG2 . . 5.380 5.131 4.937 5.264 . 0 0 "[ . 1 . 2]" 1
566 1 45 THR H 1 60 PRO HA . . 5.130 4.947 4.774 5.102 . 0 0 "[ . 1 . 2]" 1
567 1 45 THR H 1 61 ILE H . . 4.690 4.087 3.916 4.206 . 0 0 "[ . 1 . 2]" 1
568 1 45 THR H 1 61 ILE MD . . 3.700 3.348 3.198 3.489 . 0 0 "[ . 1 . 2]" 1
569 1 45 THR H 1 61 ILE HG12 . . 5.100 3.929 3.668 4.092 . 0 0 "[ . 1 . 2]" 1
570 1 45 THR H 1 61 ILE HG13 . . 4.450 3.159 3.052 3.243 . 0 0 "[ . 1 . 2]" 1
571 1 45 THR H 1 61 ILE MG . . 5.210 5.090 4.907 5.210 . 20 0 "[ . 1 . 2]" 1
572 1 45 THR HA 1 45 THR MG . . 3.270 2.459 2.398 2.535 . 0 0 "[ . 1 . 2]" 1
573 1 45 THR HA 1 46 GLY H . . 3.040 2.147 2.145 2.154 . 0 0 "[ . 1 . 2]" 1
574 1 45 THR HA 1 46 GLY HA3 . . 4.950 4.387 4.372 4.395 . 0 0 "[ . 1 . 2]" 1
575 1 45 THR HA 1 60 PRO HA . . 3.350 2.311 2.125 2.465 . 0 0 "[ . 1 . 2]" 1
576 1 45 THR HA 1 61 ILE H . . 3.580 2.215 1.908 2.358 . 0 0 "[ . 1 . 2]" 1
577 1 45 THR HA 1 61 ILE HG12 . . 4.490 3.320 3.059 3.466 . 0 0 "[ . 1 . 2]" 1
578 1 45 THR HA 1 61 ILE HG13 . . 4.710 2.599 2.432 2.721 . 0 0 "[ . 1 . 2]" 1
579 1 45 THR HB 1 46 GLY H . . 4.440 4.365 4.279 4.404 . 0 0 "[ . 1 . 2]" 1
580 1 45 THR HB 1 47 VAL MG2 . . 4.060 3.823 3.477 4.078 0.018 20 0 "[ . 1 . 2]" 1
581 1 45 THR HB 1 59 THR H . . 5.330 5.152 5.004 5.334 0.004 9 0 "[ . 1 . 2]" 1
582 1 45 THR HB 1 60 PRO HA . . 4.930 4.666 4.429 4.895 . 0 0 "[ . 1 . 2]" 1
583 1 45 THR HB 1 61 ILE MD . . 5.500 5.456 5.294 5.511 0.011 19 0 "[ . 1 . 2]" 1
584 1 45 THR HB 1 61 ILE HG12 . . 5.500 5.442 5.226 5.523 0.023 13 0 "[ . 1 . 2]" 1
585 1 45 THR MG 1 46 GLY H . . 3.530 2.854 2.669 2.981 . 0 0 "[ . 1 . 2]" 1
586 1 45 THR MG 1 46 GLY HA3 . . 5.500 4.198 4.040 4.309 . 0 0 "[ . 1 . 2]" 1
587 1 45 THR MG 1 58 GLN H . . 5.500 5.440 5.332 5.511 0.011 6 0 "[ . 1 . 2]" 1
588 1 45 THR MG 1 58 GLN HA . . 4.360 3.472 3.364 3.612 . 0 0 "[ . 1 . 2]" 1
589 1 45 THR MG 1 58 GLN HB2 . . 4.040 4.003 3.907 4.055 0.015 18 0 "[ . 1 . 2]" 1
590 1 45 THR MG 1 58 GLN HB3 . . 3.430 2.641 2.563 2.695 . 0 0 "[ . 1 . 2]" 1
591 1 45 THR MG 1 58 GLN HE21 . . 4.680 3.611 2.179 4.765 0.085 3 0 "[ . 1 . 2]" 1
592 1 45 THR MG 1 58 GLN HE22 . . 4.800 4.091 2.989 4.622 . 0 0 "[ . 1 . 2]" 1
593 1 45 THR MG 1 58 GLN HG2 . . 4.290 3.886 3.022 4.246 . 0 0 "[ . 1 . 2]" 1
594 1 45 THR MG 1 59 THR H . . 3.680 2.311 2.184 2.523 . 0 0 "[ . 1 . 2]" 1
595 1 45 THR MG 1 60 PRO HA . . 4.000 3.156 2.944 3.629 . 0 0 "[ . 1 . 2]" 1
596 1 46 GLY H 1 47 VAL H . . 4.780 4.483 4.357 4.599 . 0 0 "[ . 1 . 2]" 1
597 1 46 GLY H 1 47 VAL MG2 . . 4.950 4.488 4.307 4.629 . 0 0 "[ . 1 . 2]" 1
598 1 46 GLY H 1 58 GLN HA . . 5.500 5.387 5.113 5.505 0.005 14 0 "[ . 1 . 2]" 1
599 1 46 GLY H 1 59 THR H . . 3.690 3.557 3.347 3.686 . 0 0 "[ . 1 . 2]" 1
600 1 46 GLY H 1 59 THR MG . . 4.180 2.865 2.673 3.111 . 0 0 "[ . 1 . 2]" 1
601 1 46 GLY H 1 60 PRO HA . . 4.080 3.590 3.466 3.760 . 0 0 "[ . 1 . 2]" 1
602 1 46 GLY H 1 61 ILE H . . 4.760 3.185 3.028 3.319 . 0 0 "[ . 1 . 2]" 1
603 1 46 GLY H 1 61 ILE HA . . 5.500 4.663 4.477 4.812 . 0 0 "[ . 1 . 2]" 1
604 1 46 GLY H 1 61 ILE MD . . 4.470 3.848 3.746 4.023 . 0 0 "[ . 1 . 2]" 1
605 1 46 GLY H 1 61 ILE HG12 . . 4.120 2.239 2.155 2.417 . 0 0 "[ . 1 . 2]" 1
606 1 46 GLY H 1 61 ILE HG13 . . 5.480 2.794 2.632 3.088 . 0 0 "[ . 1 . 2]" 1
607 1 46 GLY H 1 61 ILE MG . . 3.600 2.217 1.989 2.406 . 0 0 "[ . 1 . 2]" 1
608 1 46 GLY H 1 70 VAL MG2 . . 4.730 3.889 3.584 4.083 . 0 0 "[ . 1 . 2]" 1
609 1 46 GLY HA2 1 47 VAL H . . 3.020 2.146 2.138 2.202 . 0 0 "[ . 1 . 2]" 1
610 1 46 GLY HA2 1 47 VAL MG2 . . 4.260 3.690 3.302 3.850 . 0 0 "[ . 1 . 2]" 1
611 1 46 GLY HA2 1 61 ILE MD . . 4.200 3.750 3.473 4.061 . 0 0 "[ . 1 . 2]" 1
612 1 46 GLY HA2 1 61 ILE HG12 . . 4.580 2.872 2.678 3.071 . 0 0 "[ . 1 . 2]" 1
613 1 46 GLY HA2 1 61 ILE MG . . 3.930 3.471 3.293 3.799 . 0 0 "[ . 1 . 2]" 1
614 1 46 GLY HA2 1 70 VAL MG1 . . 5.200 4.326 3.944 4.731 . 0 0 "[ . 1 . 2]" 1
615 1 46 GLY HA2 1 70 VAL MG2 . . 4.100 3.781 3.505 4.061 . 0 0 "[ . 1 . 2]" 1
616 1 46 GLY HA3 1 47 VAL H . . 3.400 3.226 3.028 3.337 . 0 0 "[ . 1 . 2]" 1
617 1 46 GLY HA3 1 59 THR H . . 4.710 4.397 4.230 4.553 . 0 0 "[ . 1 . 2]" 1
618 1 46 GLY HA3 1 59 THR MG . . 4.730 2.902 2.733 3.077 . 0 0 "[ . 1 . 2]" 1
619 1 46 GLY HA3 1 61 ILE MD . . 4.340 3.944 3.677 4.244 . 0 0 "[ . 1 . 2]" 1
620 1 46 GLY HA3 1 61 ILE HG12 . . 4.480 2.595 2.308 2.844 . 0 0 "[ . 1 . 2]" 1
621 1 46 GLY HA3 1 61 ILE HG13 . . 5.500 4.157 3.876 4.430 . 0 0 "[ . 1 . 2]" 1
622 1 46 GLY HA3 1 61 ILE MG . . 3.500 2.227 2.030 2.596 . 0 0 "[ . 1 . 2]" 1
623 1 46 GLY HA3 1 70 VAL MG1 . . 4.190 3.124 2.669 3.521 . 0 0 "[ . 1 . 2]" 1
624 1 46 GLY HA3 1 70 VAL MG2 . . 3.390 2.451 2.084 2.748 . 0 0 "[ . 1 . 2]" 1
625 1 47 VAL H 1 47 VAL HB . . 3.370 2.603 2.534 2.767 . 0 0 "[ . 1 . 2]" 1
626 1 47 VAL H 1 47 VAL MG2 . . 3.250 2.685 2.469 2.843 . 0 0 "[ . 1 . 2]" 1
627 1 47 VAL H 1 61 ILE HG12 . . 5.400 4.996 4.794 5.199 . 0 0 "[ . 1 . 2]" 1
628 1 47 VAL H 1 61 ILE MG . . 5.310 5.065 4.907 5.324 0.014 12 0 "[ . 1 . 2]" 1
629 1 47 VAL HA 1 47 VAL MG1 . . 3.200 2.410 2.329 2.468 . 0 0 "[ . 1 . 2]" 1
630 1 47 VAL HA 1 47 VAL MG2 . . 3.430 2.362 2.258 2.481 . 0 0 "[ . 1 . 2]" 1
631 1 47 VAL HA 1 48 ILE H . . 2.880 2.142 2.140 2.152 . 0 0 "[ . 1 . 2]" 1
632 1 47 VAL HA 1 48 ILE HB . . 5.500 4.552 4.504 4.603 . 0 0 "[ . 1 . 2]" 1
633 1 47 VAL HA 1 48 ILE MG . . 4.350 3.872 3.723 3.992 . 0 0 "[ . 1 . 2]" 1
634 1 47 VAL HA 1 57 PHE H . . 4.680 4.393 4.230 4.594 . 0 0 "[ . 1 . 2]" 1
635 1 47 VAL HA 1 58 GLN H . . 5.310 4.885 4.696 5.098 . 0 0 "[ . 1 . 2]" 1
636 1 47 VAL HA 1 58 GLN HA . . 3.350 2.410 2.231 2.540 . 0 0 "[ . 1 . 2]" 1
637 1 47 VAL HA 1 58 GLN HB2 . . 5.350 5.285 5.090 5.365 0.015 18 0 "[ . 1 . 2]" 1
638 1 47 VAL HA 1 58 GLN HB3 . . 4.910 4.433 4.115 4.747 . 0 0 "[ . 1 . 2]" 1
639 1 47 VAL HA 1 58 GLN HG2 . . 4.640 3.487 2.766 3.847 . 0 0 "[ . 1 . 2]" 1
640 1 47 VAL HB 1 48 ILE H . . 4.340 4.289 4.240 4.350 0.010 4 0 "[ . 1 . 2]" 1
641 1 47 VAL HB 1 58 GLN HA . . 5.390 4.974 4.643 5.369 . 0 0 "[ . 1 . 2]" 1
642 1 47 VAL MG1 1 48 ILE H . . 3.180 2.738 2.540 2.928 . 0 0 "[ . 1 . 2]" 1
643 1 47 VAL MG1 1 48 ILE HA . . 4.420 3.780 3.629 3.983 . 0 0 "[ . 1 . 2]" 1
644 1 47 VAL MG1 1 49 SER H . . 4.990 4.860 4.704 5.011 0.021 20 0 "[ . 1 . 2]" 1
645 1 47 VAL MG1 1 49 SER HA . . 5.360 4.853 4.710 5.031 . 0 0 "[ . 1 . 2]" 1
646 1 47 VAL MG1 1 49 SER HB3 . . 4.110 3.696 3.555 3.867 . 0 0 "[ . 1 . 2]" 1
647 1 47 VAL MG1 1 56 GLU HA . . 4.520 4.243 4.027 4.554 0.034 20 0 "[ . 1 . 2]" 1
648 1 47 VAL MG1 1 56 GLU HB2 . . 4.830 4.398 4.234 4.707 . 0 0 "[ . 1 . 2]" 1
649 1 47 VAL MG1 1 56 GLU HB3 . . 5.270 4.697 4.404 5.128 . 0 0 "[ . 1 . 2]" 1
650 1 47 VAL MG1 1 56 GLU HG2 . . 4.210 2.710 2.430 3.222 . 0 0 "[ . 1 . 2]" 1
651 1 47 VAL MG1 1 56 GLU HG3 . . 4.240 2.567 2.340 2.818 . 0 0 "[ . 1 . 2]" 1
652 1 47 VAL MG1 1 57 PHE H . . 3.940 3.224 2.863 3.647 . 0 0 "[ . 1 . 2]" 1
653 1 47 VAL MG1 1 58 GLN H . . 5.460 4.717 4.221 5.059 . 0 0 "[ . 1 . 2]" 1
654 1 47 VAL MG1 1 58 GLN HG2 . . 3.940 2.432 1.984 2.706 . 0 0 "[ . 1 . 2]" 1
655 1 47 VAL MG2 1 58 GLN H . . 5.500 4.970 4.570 5.561 0.061 20 0 "[ . 1 . 2]" 1
656 1 47 VAL MG2 1 58 GLN HA . . 3.740 2.729 2.330 3.416 . 0 0 "[ . 1 . 2]" 1
657 1 47 VAL MG2 1 58 GLN HB2 . . 4.500 4.238 3.972 4.602 0.102 20 0 "[ . 1 . 2]" 1
658 1 47 VAL MG2 1 58 GLN HB3 . . 4.000 3.097 2.657 4.014 0.014 20 0 "[ . 1 . 2]" 1
659 1 47 VAL MG2 1 58 GLN HE21 . . 4.460 2.918 1.977 4.462 0.002 20 0 "[ . 1 . 2]" 1
660 1 47 VAL MG2 1 58 GLN HE22 . . 4.740 3.717 2.397 4.422 . 0 0 "[ . 1 . 2]" 1
661 1 47 VAL MG2 1 58 GLN HG2 . . 3.330 2.170 1.881 2.621 . 0 0 "[ . 1 . 2]" 1
662 1 47 VAL MG2 1 59 THR H . . 3.980 3.485 3.094 4.021 0.041 20 0 "[ . 1 . 2]" 1
663 1 48 ILE H 1 48 ILE HB . . 4.130 2.850 2.784 2.940 . 0 0 "[ . 1 . 2]" 1
664 1 48 ILE H 1 48 ILE MD . . 4.600 4.543 4.496 4.570 . 0 0 "[ . 1 . 2]" 1
665 1 48 ILE H 1 48 ILE HG12 . . 4.980 4.534 4.477 4.598 . 0 0 "[ . 1 . 2]" 1
666 1 48 ILE H 1 48 ILE HG13 . . 5.110 4.539 4.481 4.591 . 0 0 "[ . 1 . 2]" 1
667 1 48 ILE H 1 48 ILE MG . . 3.130 2.125 1.915 2.289 . 0 0 "[ . 1 . 2]" 1
668 1 48 ILE H 1 49 SER H . . 4.760 4.539 4.527 4.559 . 0 0 "[ . 1 . 2]" 1
669 1 48 ILE H 1 56 GLU HA . . 5.020 4.814 4.660 4.998 . 0 0 "[ . 1 . 2]" 1
670 1 48 ILE H 1 56 GLU HG2 . . 5.160 4.353 4.027 4.688 . 0 0 "[ . 1 . 2]" 1
671 1 48 ILE H 1 57 PHE H . . 3.570 3.049 2.900 3.301 . 0 0 "[ . 1 . 2]" 1
672 1 48 ILE H 1 57 PHE HB3 . . 4.560 3.618 3.334 4.127 . 0 0 "[ . 1 . 2]" 1
673 1 48 ILE H 1 58 GLN H . . 5.200 4.994 4.860 5.129 . 0 0 "[ . 1 . 2]" 1
674 1 48 ILE H 1 58 GLN HA . . 4.080 3.602 3.355 3.749 . 0 0 "[ . 1 . 2]" 1
675 1 48 ILE H 1 58 GLN HG2 . . 5.500 4.778 4.418 5.206 . 0 0 "[ . 1 . 2]" 1
676 1 48 ILE HA 1 48 ILE MD . . 4.250 3.633 3.455 3.715 . 0 0 "[ . 1 . 2]" 1
677 1 48 ILE HA 1 48 ILE HG12 . . 4.210 3.198 3.095 3.344 . 0 0 "[ . 1 . 2]" 1
678 1 48 ILE HA 1 48 ILE HG13 . . 3.830 2.306 2.231 2.370 . 0 0 "[ . 1 . 2]" 1
679 1 48 ILE HA 1 49 SER H . . 3.080 2.382 2.318 2.438 . 0 0 "[ . 1 . 2]" 1
680 1 48 ILE HA 1 49 SER HB2 . . 5.500 5.555 5.549 5.577 0.077 18 0 "[ . 1 . 2]" 1
681 1 48 ILE HA 1 49 SER HB3 . . 5.080 4.134 4.108 4.197 . 0 0 "[ . 1 . 2]" 1
682 1 48 ILE HA 1 70 VAL MG1 . . 4.500 4.129 3.893 4.474 . 0 0 "[ . 1 . 2]" 1
683 1 48 ILE HB 1 48 ILE MD . . 3.440 2.274 2.115 2.397 . 0 0 "[ . 1 . 2]" 1
684 1 48 ILE HB 1 49 SER H . . 4.330 3.841 3.758 3.936 . 0 0 "[ . 1 . 2]" 1
685 1 48 ILE HB 1 70 VAL HB . . 5.490 4.220 3.996 4.462 . 0 0 "[ . 1 . 2]" 1
686 1 48 ILE HB 1 70 VAL MG1 . . 3.710 2.323 2.098 2.645 . 0 0 "[ . 1 . 2]" 1
687 1 48 ILE HB 1 74 TRP HE3 . . 5.500 5.001 4.554 5.372 . 0 0 "[ . 1 . 2]" 1
688 1 48 ILE MD 1 48 ILE MG . . 3.160 2.216 1.942 2.544 . 0 0 "[ . 1 . 2]" 1
689 1 48 ILE MD 1 49 SER H . . 4.660 3.537 3.425 3.695 . 0 0 "[ . 1 . 2]" 1
690 1 48 ILE MD 1 70 VAL MG1 . . 3.790 2.938 2.425 3.481 . 0 0 "[ . 1 . 2]" 1
691 1 48 ILE MD 1 71 TYR H . . 4.380 4.073 3.782 4.358 . 0 0 "[ . 1 . 2]" 1
692 1 48 ILE MD 1 71 TYR HA . . 3.490 2.740 2.489 2.995 . 0 0 "[ . 1 . 2]" 1
693 1 48 ILE MD 1 71 TYR HB2 . . 3.860 3.204 2.848 3.475 . 0 0 "[ . 1 . 2]" 1
694 1 48 ILE MD 1 71 TYR HB3 . . 4.980 4.530 4.194 4.771 . 0 0 "[ . 1 . 2]" 1
695 1 48 ILE MD 1 71 TYR QD . . 3.370 3.040 2.799 3.303 . 0 0 "[ . 1 . 2]" 1
696 1 48 ILE MD 1 71 TYR HE1 . . 5.500 4.584 4.252 4.992 . 0 0 "[ . 1 . 2]" 1
697 1 48 ILE MD 1 74 TRP HB3 . . 4.950 3.834 3.556 4.025 . 0 0 "[ . 1 . 2]" 1
698 1 48 ILE MD 1 74 TRP HE3 . . 3.190 2.375 1.986 2.560 . 0 0 "[ . 1 . 2]" 1
699 1 48 ILE MD 1 74 TRP HH2 . . 5.260 4.715 4.398 5.161 . 0 0 "[ . 1 . 2]" 1
700 1 48 ILE MD 1 74 TRP HZ3 . . 4.110 2.987 2.527 3.302 . 0 0 "[ . 1 . 2]" 1
701 1 48 ILE HG12 1 48 ILE MG . . 3.610 2.232 2.054 2.355 . 0 0 "[ . 1 . 2]" 1
702 1 48 ILE HG12 1 49 SER H . . 3.970 2.130 1.909 2.496 . 0 0 "[ . 1 . 2]" 1
703 1 48 ILE HG12 1 74 TRP HE3 . . 4.780 3.927 3.509 4.292 . 0 0 "[ . 1 . 2]" 1
704 1 48 ILE HG12 1 74 TRP HZ3 . . 4.600 3.608 3.127 4.097 . 0 0 "[ . 1 . 2]" 1
705 1 48 ILE HG13 1 49 SER H . . 3.770 2.069 1.900 2.334 . 0 0 "[ . 1 . 2]" 1
706 1 48 ILE HG13 1 74 TRP HE3 . . 5.500 5.100 4.714 5.276 . 0 0 "[ . 1 . 2]" 1
707 1 48 ILE HG13 1 74 TRP HZ3 . . 5.500 5.025 4.592 5.384 . 0 0 "[ . 1 . 2]" 1
708 1 48 ILE MG 1 49 SER H . . 4.810 3.362 3.185 3.487 . 0 0 "[ . 1 . 2]" 1
709 1 48 ILE MG 1 49 SER HA . . 5.280 3.492 3.353 3.658 . 0 0 "[ . 1 . 2]" 1
710 1 48 ILE MG 1 56 GLU HA . . 4.740 3.475 3.322 3.648 . 0 0 "[ . 1 . 2]" 1
711 1 48 ILE MG 1 56 GLU HB2 . . 5.500 5.453 5.318 5.513 0.013 14 0 "[ . 1 . 2]" 1
712 1 48 ILE MG 1 57 PHE H . . 3.630 2.467 2.060 2.881 . 0 0 "[ . 1 . 2]" 1
713 1 48 ILE MG 1 57 PHE HA . . 4.780 4.046 3.881 4.257 . 0 0 "[ . 1 . 2]" 1
714 1 48 ILE MG 1 57 PHE HB2 . . 3.790 3.251 3.065 3.571 . 0 0 "[ . 1 . 2]" 1
715 1 48 ILE MG 1 57 PHE HB3 . . 3.320 1.943 1.822 2.227 . 0 0 "[ . 1 . 2]" 1
716 1 48 ILE MG 1 57 PHE QD . . 4.070 2.391 2.040 2.808 . 0 0 "[ . 1 . 2]" 1
717 1 48 ILE MG 1 57 PHE QE . . 4.690 4.317 4.003 4.641 . 0 0 "[ . 1 . 2]" 1
718 1 48 ILE MG 1 58 GLN H . . 5.260 4.631 4.402 4.860 . 0 0 "[ . 1 . 2]" 1
719 1 48 ILE MG 1 58 GLN HA . . 5.340 4.438 4.182 4.713 . 0 0 "[ . 1 . 2]" 1
720 1 48 ILE MG 1 70 VAL MG1 . . 3.210 2.860 2.581 3.113 . 0 0 "[ . 1 . 2]" 1
721 1 48 ILE MG 1 71 TYR HA . . 4.330 4.055 3.687 4.335 0.005 14 0 "[ . 1 . 2]" 1
722 1 48 ILE MG 1 74 TRP H . . 4.740 4.680 4.249 4.754 0.014 16 0 "[ . 1 . 2]" 1
723 1 48 ILE MG 1 74 TRP HA . . 5.330 4.477 4.304 4.705 . 0 0 "[ . 1 . 2]" 1
724 1 48 ILE MG 1 74 TRP HB2 . . 3.960 2.784 2.506 2.961 . 0 0 "[ . 1 . 2]" 1
725 1 48 ILE MG 1 74 TRP HB3 . . 4.380 3.752 3.466 4.005 . 0 0 "[ . 1 . 2]" 1
726 1 48 ILE MG 1 74 TRP HE1 . . 4.690 4.312 3.923 4.680 . 0 0 "[ . 1 . 2]" 1
727 1 48 ILE MG 1 74 TRP HE3 . . 3.660 3.056 2.569 3.596 . 0 0 "[ . 1 . 2]" 1
728 1 48 ILE MG 1 74 TRP HZ3 . . 4.760 3.871 3.439 4.265 . 0 0 "[ . 1 . 2]" 1
729 1 49 SER H 1 49 SER HB2 . . 4.140 4.008 3.976 4.032 . 0 0 "[ . 1 . 2]" 1
730 1 49 SER H 1 49 SER HB3 . . 4.190 3.235 3.171 3.337 . 0 0 "[ . 1 . 2]" 1
731 1 49 SER H 1 50 CYS H . . 5.500 4.376 4.347 4.396 . 0 0 "[ . 1 . 2]" 1
732 1 49 SER HA 1 50 CYS H . . 3.000 2.413 2.348 2.454 . 0 0 "[ . 1 . 2]" 1
733 1 49 SER HA 1 50 CYS HB2 . . 4.900 4.289 4.231 4.373 . 0 0 "[ . 1 . 2]" 1
734 1 49 SER HA 1 50 CYS HB3 . . 5.060 4.789 4.650 4.888 . 0 0 "[ . 1 . 2]" 1
735 1 49 SER HA 1 56 GLU HB2 . . 3.940 3.569 3.419 3.812 . 0 0 "[ . 1 . 2]" 1
736 1 49 SER HA 1 56 GLU HG3 . . 4.820 4.047 3.481 4.605 . 0 0 "[ . 1 . 2]" 1
737 1 49 SER HA 1 57 PHE H . . 4.550 3.633 3.530 3.762 . 0 0 "[ . 1 . 2]" 1
738 1 49 SER HA 1 74 TRP HH2 . . 5.200 4.616 4.266 5.154 . 0 0 "[ . 1 . 2]" 1
739 1 49 SER HB2 1 50 CYS H . . 3.910 2.533 2.413 2.670 . 0 0 "[ . 1 . 2]" 1
740 1 49 SER HB2 1 56 GLU HA . . 4.550 3.377 3.240 3.512 . 0 0 "[ . 1 . 2]" 1
741 1 49 SER HB2 1 56 GLU HB2 . . 3.700 3.103 2.915 3.356 . 0 0 "[ . 1 . 2]" 1
742 1 49 SER HB2 1 56 GLU HG2 . . 5.490 5.102 4.714 5.367 . 0 0 "[ . 1 . 2]" 1
743 1 49 SER HB2 1 56 GLU HG3 . . 4.470 3.898 3.619 4.301 . 0 0 "[ . 1 . 2]" 1
744 1 49 SER HB2 1 57 PHE H . . 5.260 5.142 5.010 5.255 . 0 0 "[ . 1 . 2]" 1
745 1 49 SER HB3 1 50 CYS H . . 4.040 3.916 3.833 4.002 . 0 0 "[ . 1 . 2]" 1
746 1 49 SER HB3 1 56 GLU HA . . 4.290 3.359 3.079 3.534 . 0 0 "[ . 1 . 2]" 1
747 1 49 SER HB3 1 56 GLU HB2 . . 3.620 3.428 3.072 3.623 0.003 5 0 "[ . 1 . 2]" 1
748 1 49 SER HB3 1 56 GLU HG2 . . 4.760 4.375 3.923 4.694 . 0 0 "[ . 1 . 2]" 1
749 1 49 SER HB3 1 56 GLU HG3 . . 4.360 3.056 2.775 3.514 . 0 0 "[ . 1 . 2]" 1
750 1 49 SER HB3 1 57 PHE H . . 5.040 4.387 4.242 4.570 . 0 0 "[ . 1 . 2]" 1
751 1 50 CYS H 1 50 CYS HB2 . . 3.580 2.848 2.702 2.970 . 0 0 "[ . 1 . 2]" 1
752 1 50 CYS H 1 50 CYS HB3 . . 3.380 2.645 2.569 2.708 . 0 0 "[ . 1 . 2]" 1
753 1 50 CYS H 1 54 LEU H . . 4.740 4.583 4.389 4.741 0.001 14 0 "[ . 1 . 2]" 1
754 1 50 CYS H 1 54 LEU HA . . 4.660 4.067 3.922 4.338 . 0 0 "[ . 1 . 2]" 1
755 1 50 CYS H 1 55 GLU H . . 4.410 2.606 2.470 2.729 . 0 0 "[ . 1 . 2]" 1
756 1 50 CYS H 1 55 GLU HB2 . . 5.150 3.694 3.120 5.062 . 0 0 "[ . 1 . 2]" 1
757 1 50 CYS H 1 56 GLU HA . . 4.210 3.878 3.698 4.053 . 0 0 "[ . 1 . 2]" 1
758 1 50 CYS H 1 56 GLU HB2 . . 4.770 4.488 4.335 4.766 . 0 0 "[ . 1 . 2]" 1
759 1 50 CYS H 1 74 TRP HH2 . . 5.500 4.498 4.041 5.168 . 0 0 "[ . 1 . 2]" 1
760 1 50 CYS HA 1 51 THR H . . 3.040 2.419 2.376 2.456 . 0 0 "[ . 1 . 2]" 1
761 1 50 CYS HA 1 51 THR HA . . 4.660 4.434 4.416 4.450 . 0 0 "[ . 1 . 2]" 1
762 1 50 CYS HA 1 51 THR HB . . 5.500 5.598 5.562 5.668 0.168 17 0 "[ . 1 . 2]" 1
763 1 50 CYS HA 1 51 THR MG . . 4.320 3.166 2.957 3.512 . 0 0 "[ . 1 . 2]" 1
764 1 50 CYS HA 1 52 VAL H . . 4.770 4.206 3.984 4.461 . 0 0 "[ . 1 . 2]" 1
765 1 50 CYS HA 1 52 VAL MG2 . . 5.450 5.200 5.086 5.355 . 0 0 "[ . 1 . 2]" 1
766 1 50 CYS HA 1 74 TRP HH2 . . 5.500 4.471 4.099 4.914 . 0 0 "[ . 1 . 2]" 1
767 1 50 CYS HA 1 74 TRP HZ3 . . 5.500 4.845 4.570 5.305 . 0 0 "[ . 1 . 2]" 1
768 1 50 CYS HB2 1 51 THR H . . 4.460 3.842 3.800 3.939 . 0 0 "[ . 1 . 2]" 1
769 1 50 CYS HB2 1 52 VAL H . . 5.500 4.360 4.240 4.592 . 0 0 "[ . 1 . 2]" 1
770 1 50 CYS HB2 1 53 CYS H . . 4.810 4.274 4.179 4.363 . 0 0 "[ . 1 . 2]" 1
771 1 50 CYS HB2 1 54 LEU H . . 4.650 4.403 4.166 4.627 . 0 0 "[ . 1 . 2]" 1
772 1 50 CYS HB2 1 54 LEU HA . . 5.500 5.246 5.006 5.503 0.003 14 0 "[ . 1 . 2]" 1
773 1 50 CYS HB2 1 55 GLU H . . 4.250 3.167 2.932 3.392 . 0 0 "[ . 1 . 2]" 1
774 1 50 CYS HB2 1 55 GLU HB2 . . 4.990 2.859 2.371 4.834 . 0 0 "[ . 1 . 2]" 1
775 1 50 CYS HB2 1 55 GLU HB3 . . 5.500 4.029 3.574 4.430 . 0 0 "[ . 1 . 2]" 1
776 1 50 CYS HB2 1 55 GLU QG . . 5.500 4.019 1.941 4.548 . 0 0 "[ . 1 . 2]" 1
777 1 50 CYS HB2 1 74 TRP HH2 . . 3.890 2.624 2.214 3.107 . 0 0 "[ . 1 . 2]" 1
778 1 50 CYS HB2 1 74 TRP HZ3 . . 5.080 4.148 3.777 4.583 . 0 0 "[ . 1 . 2]" 1
779 1 50 CYS HB3 1 51 THR H . . 4.920 3.458 3.311 3.602 . 0 0 "[ . 1 . 2]" 1
780 1 50 CYS HB3 1 52 VAL H . . 4.850 3.146 2.989 3.370 . 0 0 "[ . 1 . 2]" 1
781 1 50 CYS HB3 1 53 CYS H . . 3.980 3.081 2.962 3.246 . 0 0 "[ . 1 . 2]" 1
782 1 50 CYS HB3 1 54 LEU H . . 3.640 2.690 2.446 2.969 . 0 0 "[ . 1 . 2]" 1
783 1 50 CYS HB3 1 54 LEU HA . . 4.780 3.593 3.405 3.812 . 0 0 "[ . 1 . 2]" 1
784 1 50 CYS HB3 1 55 GLU H . . 3.590 1.940 1.866 2.277 . 0 0 "[ . 1 . 2]" 1
785 1 50 CYS HB3 1 55 GLU HB2 . . 5.060 2.950 2.533 4.935 . 0 0 "[ . 1 . 2]" 1
786 1 50 CYS HB3 1 55 GLU HB3 . . 5.370 4.309 4.049 4.521 . 0 0 "[ . 1 . 2]" 1
787 1 51 THR H 1 51 THR HB . . 4.100 3.843 3.814 3.870 . 0 0 "[ . 1 . 2]" 1
788 1 51 THR H 1 51 THR MG . . 3.290 2.570 2.266 2.953 . 0 0 "[ . 1 . 2]" 1
789 1 51 THR H 1 52 VAL H . . 3.600 2.439 2.111 2.816 . 0 0 "[ . 1 . 2]" 1
790 1 51 THR H 1 52 VAL HA . . 5.310 4.758 4.622 4.944 . 0 0 "[ . 1 . 2]" 1
791 1 51 THR H 1 52 VAL MG2 . . 4.800 3.234 3.106 3.480 . 0 0 "[ . 1 . 2]" 1
792 1 51 THR H 1 54 LEU H . . 5.290 4.420 4.181 4.637 . 0 0 "[ . 1 . 2]" 1
793 1 51 THR HA 1 51 THR HB . . 2.990 2.342 2.306 2.439 . 0 0 "[ . 1 . 2]" 1
794 1 51 THR HA 1 51 THR MG . . 3.050 2.517 2.302 2.643 . 0 0 "[ . 1 . 2]" 1
795 1 51 THR HA 1 52 VAL MG2 . . 5.390 4.291 4.068 4.545 . 0 0 "[ . 1 . 2]" 1
796 1 51 THR HA 1 53 CYS H . . 5.500 4.820 4.523 5.018 . 0 0 "[ . 1 . 2]" 1
797 1 51 THR HA 1 54 LEU H . . 4.890 4.139 3.995 4.286 . 0 0 "[ . 1 . 2]" 1
798 1 51 THR HA 1 54 LEU MD2 . . 3.860 3.640 3.395 3.866 0.006 7 0 "[ . 1 . 2]" 1
799 1 51 THR HB 1 52 VAL H . . 5.250 4.532 4.438 4.572 . 0 0 "[ . 1 . 2]" 1
800 1 51 THR HB 1 52 VAL HA . . 5.180 5.060 4.856 5.141 . 0 0 "[ . 1 . 2]" 1
801 1 51 THR HB 1 52 VAL MG2 . . 4.950 4.211 3.984 4.462 . 0 0 "[ . 1 . 2]" 1
802 1 51 THR HB 1 54 LEU MD2 . . 5.500 5.228 4.959 5.471 . 0 0 "[ . 1 . 2]" 1
803 1 51 THR MG 1 52 VAL H . . 4.660 4.180 3.990 4.309 . 0 0 "[ . 1 . 2]" 1
804 1 51 THR MG 1 52 VAL MG2 . . 4.730 4.176 4.024 4.487 . 0 0 "[ . 1 . 2]" 1
805 1 52 VAL H 1 52 VAL HB . . 3.520 2.794 2.615 2.990 . 0 0 "[ . 1 . 2]" 1
806 1 52 VAL H 1 52 VAL MG1 . . 4.350 3.889 3.816 3.952 . 0 0 "[ . 1 . 2]" 1
807 1 52 VAL H 1 52 VAL MG2 . . 3.570 3.021 2.857 3.147 . 0 0 "[ . 1 . 2]" 1
808 1 52 VAL H 1 53 CYS H . . 3.340 2.008 1.812 2.179 . 0 0 "[ . 1 . 2]" 1
809 1 52 VAL H 1 54 LEU H . . 4.140 2.523 2.330 2.746 . 0 0 "[ . 1 . 2]" 1
810 1 52 VAL H 1 54 LEU HA . . 5.500 4.198 4.024 4.404 . 0 0 "[ . 1 . 2]" 1
811 1 52 VAL HA 1 52 VAL MG1 . . 3.210 2.438 2.371 2.483 . 0 0 "[ . 1 . 2]" 1
812 1 52 VAL HA 1 52 VAL MG2 . . 3.180 2.327 2.206 2.433 . 0 0 "[ . 1 . 2]" 1
813 1 52 VAL HA 1 54 LEU MD2 . . 4.940 4.401 4.181 4.699 . 0 0 "[ . 1 . 2]" 1
814 1 52 VAL HB 1 53 CYS H . . 3.340 2.495 2.347 2.726 . 0 0 "[ . 1 . 2]" 1
815 1 52 VAL HB 1 53 CYS HB3 . . 5.260 3.946 3.855 4.044 . 0 0 "[ . 1 . 2]" 1
816 1 52 VAL HB 1 54 LEU H . . 4.590 4.465 4.358 4.590 . 14 0 "[ . 1 . 2]" 1
817 1 52 VAL MG1 1 53 CYS H . . 3.990 3.316 3.071 3.490 . 0 0 "[ . 1 . 2]" 1
818 1 52 VAL MG1 1 53 CYS HA . . 4.380 3.497 3.304 3.654 . 0 0 "[ . 1 . 2]" 1
819 1 52 VAL MG1 1 53 CYS HB2 . . 5.060 4.853 4.638 4.984 . 0 0 "[ . 1 . 2]" 1
820 1 52 VAL MG1 1 53 CYS HB3 . . 4.420 3.577 3.344 3.738 . 0 0 "[ . 1 . 2]" 1
821 1 52 VAL MG2 1 53 CYS H . . 4.310 3.810 3.732 3.888 . 0 0 "[ . 1 . 2]" 1
822 1 53 CYS H 1 53 CYS HB3 . . 3.870 2.862 2.782 2.949 . 0 0 "[ . 1 . 2]" 1
823 1 53 CYS H 1 54 LEU H . . 3.180 2.139 1.971 2.226 . 0 0 "[ . 1 . 2]" 1
824 1 53 CYS H 1 54 LEU HA . . 4.480 4.396 4.226 4.493 0.013 5 0 "[ . 1 . 2]" 1
825 1 53 CYS H 1 54 LEU MD2 . . 4.820 4.610 4.442 4.802 . 0 0 "[ . 1 . 2]" 1
826 1 53 CYS H 1 55 GLU H . . 4.830 4.108 3.950 4.268 . 0 0 "[ . 1 . 2]" 1
827 1 53 CYS HA 1 54 LEU MD1 . . 5.220 4.152 3.909 4.345 . 0 0 "[ . 1 . 2]" 1
828 1 53 CYS HA 1 54 LEU HG . . 4.620 3.397 3.274 3.521 . 0 0 "[ . 1 . 2]" 1
829 1 53 CYS HB2 1 54 LEU H . . 5.220 4.151 4.023 4.249 . 0 0 "[ . 1 . 2]" 1
830 1 53 CYS HB2 1 55 GLU H . . 5.460 5.000 4.829 5.158 . 0 0 "[ . 1 . 2]" 1
831 1 53 CYS HB2 1 55 GLU QG . . 5.360 3.395 2.940 4.451 . 0 0 "[ . 1 . 2]" 1
832 1 53 CYS HB3 1 54 LEU H . . 4.810 4.222 4.175 4.275 . 0 0 "[ . 1 . 2]" 1
833 1 53 CYS HB3 1 55 GLU H . . 5.500 5.511 5.484 5.538 0.038 14 0 "[ . 1 . 2]" 1
834 1 54 LEU H 1 54 LEU HA . . 2.860 2.279 2.275 2.288 . 0 0 "[ . 1 . 2]" 1
835 1 54 LEU H 1 54 LEU HB2 . . 4.070 3.729 3.690 3.772 . 0 0 "[ . 1 . 2]" 1
836 1 54 LEU H 1 54 LEU HB3 . . 4.080 4.033 4.009 4.044 . 0 0 "[ . 1 . 2]" 1
837 1 54 LEU H 1 54 LEU MD1 . . 4.480 4.370 4.303 4.431 . 0 0 "[ . 1 . 2]" 1
838 1 54 LEU H 1 54 LEU MD2 . . 3.390 3.160 2.998 3.340 . 0 0 "[ . 1 . 2]" 1
839 1 54 LEU H 1 54 LEU HG . . 3.890 2.893 2.820 2.968 . 0 0 "[ . 1 . 2]" 1
840 1 54 LEU H 1 55 GLU H . . 3.630 2.755 2.653 2.821 . 0 0 "[ . 1 . 2]" 1
841 1 54 LEU H 1 55 GLU HA . . 5.500 5.175 5.064 5.234 . 0 0 "[ . 1 . 2]" 1
842 1 54 LEU H 1 55 GLU QG . . 5.380 4.420 3.781 4.731 . 0 0 "[ . 1 . 2]" 1
843 1 54 LEU HA 1 54 LEU MD1 . . 4.080 3.978 3.945 4.008 . 0 0 "[ . 1 . 2]" 1
844 1 54 LEU HA 1 54 LEU MD2 . . 3.000 2.466 2.318 2.650 . 0 0 "[ . 1 . 2]" 1
845 1 54 LEU HA 1 54 LEU HG . . 4.180 3.165 3.081 3.219 . 0 0 "[ . 1 . 2]" 1
846 1 54 LEU HB2 1 54 LEU MD1 . . 3.060 2.195 2.015 2.320 . 0 0 "[ . 1 . 2]" 1
847 1 54 LEU HB2 1 54 LEU MD2 . . 3.530 3.164 3.132 3.183 . 0 0 "[ . 1 . 2]" 1
848 1 54 LEU HB3 1 54 LEU MD1 . . 3.120 2.493 2.386 2.620 . 0 0 "[ . 1 . 2]" 1
849 1 54 LEU HB3 1 54 LEU MD2 . . 3.640 2.163 2.048 2.269 . 0 0 "[ . 1 . 2]" 1
850 1 54 LEU HB3 1 55 GLU H . . 4.840 4.393 4.372 4.424 . 0 0 "[ . 1 . 2]" 1
851 1 54 LEU MD2 1 55 GLU H . . 5.330 4.595 4.467 4.772 . 0 0 "[ . 1 . 2]" 1
852 1 55 GLU H 1 55 GLU HB2 . . 3.380 2.511 2.263 3.749 0.369 5 0 "[ . 1 . 2]" 1
853 1 55 GLU H 1 55 GLU QG . . 3.650 3.163 1.914 3.430 . 0 0 "[ . 1 . 2]" 1
854 1 55 GLU HA 1 56 GLU H . . 2.820 2.487 2.367 2.637 . 0 0 "[ . 1 . 2]" 1
855 1 55 GLU HA 1 56 GLU HA . . 5.050 4.570 4.503 4.651 . 0 0 "[ . 1 . 2]" 1
856 1 55 GLU HA 1 56 GLU HB2 . . 5.270 4.382 4.325 4.433 . 0 0 "[ . 1 . 2]" 1
857 1 55 GLU HA 1 56 GLU HB3 . . 5.500 4.328 4.242 4.392 . 0 0 "[ . 1 . 2]" 1
858 1 55 GLU HA 1 74 TRP HZ2 . . 5.500 5.025 4.579 5.499 . 0 0 "[ . 1 . 2]" 1
859 1 55 GLU HB2 1 56 GLU H . . 4.180 3.575 1.990 3.934 . 0 0 "[ . 1 . 2]" 1
860 1 55 GLU HB2 1 74 TRP HH2 . . 4.900 3.265 2.596 4.593 . 0 0 "[ . 1 . 2]" 1
861 1 55 GLU HB2 1 74 TRP HZ2 . . 4.100 3.267 2.641 3.704 . 0 0 "[ . 1 . 2]" 1
862 1 55 GLU HB3 1 56 GLU H . . 3.860 2.447 2.012 3.686 . 0 0 "[ . 1 . 2]" 1
863 1 55 GLU HB3 1 74 TRP HE1 . . 5.290 4.688 3.906 6.182 0.892 5 2 "[ + 1 - 2]" 1
864 1 55 GLU HB3 1 74 TRP HH2 . . 4.720 3.595 2.973 4.915 0.195 15 0 "[ . 1 . 2]" 1
865 1 55 GLU HB3 1 74 TRP HZ2 . . 3.920 2.530 2.001 4.029 0.109 15 0 "[ . 1 . 2]" 1
866 1 55 GLU QG 1 56 GLU H . . 4.620 3.883 3.102 4.122 . 0 0 "[ . 1 . 2]" 1
867 1 55 GLU QG 1 74 TRP HZ2 . . 4.410 3.270 2.276 3.904 . 0 0 "[ . 1 . 2]" 1
868 1 56 GLU H 1 56 GLU HB2 . . 3.910 3.489 3.411 3.590 . 0 0 "[ . 1 . 2]" 1
869 1 56 GLU H 1 56 GLU HB3 . . 4.060 2.980 2.868 3.077 . 0 0 "[ . 1 . 2]" 1
870 1 56 GLU H 1 56 GLU HG2 . . 4.520 4.454 4.387 4.495 . 0 0 "[ . 1 . 2]" 1
871 1 56 GLU H 1 56 GLU HG3 . . 5.150 5.016 4.818 5.159 0.009 11 0 "[ . 1 . 2]" 1
872 1 56 GLU H 1 57 PHE H . . 4.620 4.259 4.144 4.369 . 0 0 "[ . 1 . 2]" 1
873 1 56 GLU H 1 74 TRP HZ2 . . 4.490 3.968 3.453 4.425 . 0 0 "[ . 1 . 2]" 1
874 1 56 GLU HA 1 56 GLU HG3 . . 4.160 2.928 2.586 3.365 . 0 0 "[ . 1 . 2]" 1
875 1 56 GLU HA 1 57 PHE H . . 2.980 2.240 2.185 2.351 . 0 0 "[ . 1 . 2]" 1
876 1 56 GLU HB2 1 56 GLU HG3 . . 3.000 2.291 2.209 2.451 . 0 0 "[ . 1 . 2]" 1
877 1 56 GLU HB2 1 57 PHE H . . 4.280 3.975 3.833 4.083 . 0 0 "[ . 1 . 2]" 1
878 1 56 GLU HB3 1 57 PHE H . . 4.580 3.985 3.722 4.117 . 0 0 "[ . 1 . 2]" 1
879 1 56 GLU HB3 1 57 PHE HA . . 5.500 4.711 4.576 4.789 . 0 0 "[ . 1 . 2]" 1
880 1 56 GLU HG2 1 57 PHE H . . 4.590 2.217 2.055 2.366 . 0 0 "[ . 1 . 2]" 1
881 1 56 GLU HG2 1 57 PHE HA . . 5.120 3.477 3.283 3.762 . 0 0 "[ . 1 . 2]" 1
882 1 56 GLU HG3 1 57 PHE H . . 4.530 3.132 2.329 3.707 . 0 0 "[ . 1 . 2]" 1
883 1 57 PHE H 1 57 PHE HB2 . . 3.750 3.395 3.308 3.529 . 0 0 "[ . 1 . 2]" 1
884 1 57 PHE H 1 57 PHE HB3 . . 3.690 2.785 2.703 2.928 . 0 0 "[ . 1 . 2]" 1
885 1 57 PHE H 1 58 GLN H . . 4.640 4.367 4.205 4.430 . 0 0 "[ . 1 . 2]" 1
886 1 57 PHE HA 1 57 PHE QD . . 4.410 2.476 2.230 2.757 . 0 0 "[ . 1 . 2]" 1
887 1 57 PHE HA 1 58 GLN H . . 2.790 2.292 2.161 2.409 . 0 0 "[ . 1 . 2]" 1
888 1 57 PHE HA 1 58 GLN HA . . 5.480 4.411 4.378 4.458 . 0 0 "[ . 1 . 2]" 1
889 1 57 PHE HA 1 58 GLN HB2 . . 5.030 4.574 4.204 4.703 . 0 0 "[ . 1 . 2]" 1
890 1 57 PHE HA 1 58 GLN HG3 . . 5.500 3.768 3.343 4.512 . 0 0 "[ . 1 . 2]" 1
891 1 57 PHE HA 1 74 TRP HE1 . . 5.150 4.611 4.175 4.972 . 0 0 "[ . 1 . 2]" 1
892 1 57 PHE HB2 1 58 GLN H . . 4.280 3.867 3.732 4.171 . 0 0 "[ . 1 . 2]" 1
893 1 57 PHE HB2 1 74 TRP HD1 . . 4.710 3.033 2.581 3.333 . 0 0 "[ . 1 . 2]" 1
894 1 57 PHE HB2 1 74 TRP HE1 . . 3.570 2.442 1.895 2.790 . 0 0 "[ . 1 . 2]" 1
895 1 57 PHE HB3 1 58 GLN H . . 4.470 3.912 3.647 4.299 . 0 0 "[ . 1 . 2]" 1
896 1 57 PHE HB3 1 74 TRP HA . . 5.500 4.566 4.071 4.885 . 0 0 "[ . 1 . 2]" 1
897 1 57 PHE HB3 1 74 TRP HD1 . . 5.110 3.550 3.144 3.884 . 0 0 "[ . 1 . 2]" 1
898 1 57 PHE HB3 1 74 TRP HE1 . . 4.140 3.680 3.010 4.062 . 0 0 "[ . 1 . 2]" 1
899 1 57 PHE QD 1 58 GLN H . . 3.970 2.593 2.338 3.129 . 0 0 "[ . 1 . 2]" 1
900 1 57 PHE QD 1 59 THR HB . . 5.380 3.802 3.490 4.180 . 0 0 "[ . 1 . 2]" 1
901 1 57 PHE QD 1 59 THR MG . . 5.250 3.422 3.094 3.926 . 0 0 "[ . 1 . 2]" 1
902 1 57 PHE QD 1 74 TRP H . . 4.870 4.128 3.441 4.558 . 0 0 "[ . 1 . 2]" 1
903 1 57 PHE QD 1 74 TRP HE1 . . 5.000 3.936 3.439 4.225 . 0 0 "[ . 1 . 2]" 1
904 1 57 PHE QE 1 59 THR HA . . 5.470 4.317 4.058 4.861 . 0 0 "[ . 1 . 2]" 1
905 1 57 PHE QE 1 59 THR HB . . 3.650 2.285 1.990 2.961 . 0 0 "[ . 1 . 2]" 1
906 1 57 PHE QE 1 59 THR MG . . 3.800 2.964 2.462 3.565 . 0 0 "[ . 1 . 2]" 1
907 1 57 PHE QE 1 73 ASP HB2 . . 4.120 3.471 2.723 3.875 . 0 0 "[ . 1 . 2]" 1
908 1 57 PHE QE 1 73 ASP HB3 . . 3.880 3.127 2.458 3.537 . 0 0 "[ . 1 . 2]" 1
909 1 57 PHE QE 1 74 TRP H . . 4.310 3.633 3.059 4.116 . 0 0 "[ . 1 . 2]" 1
910 1 57 PHE QE 1 74 TRP HA . . 4.400 2.975 2.317 3.520 . 0 0 "[ . 1 . 2]" 1
911 1 57 PHE QE 1 77 ALA MB . . 4.820 2.818 2.231 3.384 . 0 0 "[ . 1 . 2]" 1
912 1 57 PHE HZ 1 59 THR HB . . 4.550 3.100 2.484 3.726 . 0 0 "[ . 1 . 2]" 1
913 1 57 PHE HZ 1 59 THR MG . . 5.120 4.495 3.846 4.958 . 0 0 "[ . 1 . 2]" 1
914 1 57 PHE HZ 1 73 ASP HB2 . . 5.500 5.216 4.061 5.478 . 0 0 "[ . 1 . 2]" 1
915 1 57 PHE HZ 1 73 ASP HB3 . . 4.420 4.054 3.281 4.345 . 0 0 "[ . 1 . 2]" 1
916 1 57 PHE HZ 1 74 TRP HA . . 4.660 4.008 3.525 4.556 . 0 0 "[ . 1 . 2]" 1
917 1 57 PHE HZ 1 77 ALA MB . . 3.330 2.677 1.897 3.316 . 0 0 "[ . 1 . 2]" 1
918 1 58 GLN H 1 58 GLN HB2 . . 3.580 2.643 2.382 2.768 . 0 0 "[ . 1 . 2]" 1
919 1 58 GLN H 1 58 GLN HB3 . . 4.010 3.762 3.551 3.844 . 0 0 "[ . 1 . 2]" 1
920 1 58 GLN H 1 58 GLN HG2 . . 4.410 3.719 3.214 4.287 . 0 0 "[ . 1 . 2]" 1
921 1 58 GLN H 1 58 GLN HG3 . . 4.550 3.000 2.483 3.600 . 0 0 "[ . 1 . 2]" 1
922 1 58 GLN H 1 59 THR H . . 4.550 4.474 4.415 4.543 . 0 0 "[ . 1 . 2]" 1
923 1 58 GLN H 1 59 THR HA . . 5.500 5.143 5.059 5.283 . 0 0 "[ . 1 . 2]" 1
924 1 58 GLN HA 1 58 GLN HE22 . . 5.500 5.554 4.964 5.806 0.306 14 0 "[ . 1 . 2]" 1
925 1 58 GLN HA 1 58 GLN HG2 . . 4.120 2.509 2.177 2.750 . 0 0 "[ . 1 . 2]" 1
926 1 58 GLN HA 1 59 THR H . . 2.820 2.269 2.235 2.351 . 0 0 "[ . 1 . 2]" 1
927 1 58 GLN HA 1 59 THR HB . . 5.080 4.493 4.337 4.753 . 0 0 "[ . 1 . 2]" 1
928 1 58 GLN HA 1 59 THR MG . . 4.280 3.523 3.171 3.780 . 0 0 "[ . 1 . 2]" 1
929 1 58 GLN HB2 1 59 THR H . . 3.920 3.852 3.766 3.977 0.057 20 0 "[ . 1 . 2]" 1
930 1 58 GLN HB3 1 59 THR H . . 3.830 2.787 2.641 2.893 . 0 0 "[ . 1 . 2]" 1
931 1 58 GLN HG2 1 59 THR H . . 4.560 4.256 3.447 4.429 . 0 0 "[ . 1 . 2]" 1
932 1 58 GLN HG3 1 59 THR H . . 5.500 5.073 4.694 5.248 . 0 0 "[ . 1 . 2]" 1
933 1 59 THR H 1 59 THR HB . . 3.740 3.499 3.383 3.687 . 0 0 "[ . 1 . 2]" 1
934 1 59 THR H 1 59 THR MG . . 3.170 2.500 2.336 2.631 . 0 0 "[ . 1 . 2]" 1
935 1 59 THR H 1 60 PRO HD2 . . 4.870 4.763 4.750 4.774 . 0 0 "[ . 1 . 2]" 1
936 1 59 THR H 1 60 PRO HD3 . . 5.330 4.589 4.545 4.632 . 0 0 "[ . 1 . 2]" 1
937 1 59 THR H 1 61 ILE MG . . 4.850 4.533 4.355 4.629 . 0 0 "[ . 1 . 2]" 1
938 1 59 THR H 1 70 VAL MG1 . . 4.600 4.449 4.126 4.616 0.016 20 0 "[ . 1 . 2]" 1
939 1 59 THR HA 1 60 PRO HD2 . . 3.050 2.221 2.189 2.260 . 0 0 "[ . 1 . 2]" 1
940 1 59 THR HA 1 60 PRO HD3 . . 3.210 2.257 2.254 2.261 . 0 0 "[ . 1 . 2]" 1
941 1 59 THR HA 1 60 PRO HG2 . . 4.870 4.369 4.344 4.400 . 0 0 "[ . 1 . 2]" 1
942 1 59 THR HA 1 60 PRO HG3 . . 4.750 4.379 4.365 4.396 . 0 0 "[ . 1 . 2]" 1
943 1 59 THR HB 1 70 VAL MG1 . . 4.800 3.847 3.620 4.154 . 0 0 "[ . 1 . 2]" 1
944 1 59 THR HB 1 73 ASP HB2 . . 4.810 4.324 3.695 4.815 0.005 13 0 "[ . 1 . 2]" 1
945 1 59 THR HB 1 73 ASP HB3 . . 4.750 3.964 3.407 4.445 . 0 0 "[ . 1 . 2]" 1
946 1 59 THR MG 1 60 PRO HD2 . . 5.280 3.844 3.705 4.094 . 0 0 "[ . 1 . 2]" 1
947 1 59 THR MG 1 60 PRO HD3 . . 5.040 4.635 4.547 4.789 . 0 0 "[ . 1 . 2]" 1
948 1 59 THR MG 1 61 ILE MG . . 3.460 2.406 2.127 2.768 . 0 0 "[ . 1 . 2]" 1
949 1 59 THR MG 1 70 VAL H . . 5.010 4.671 4.410 4.967 . 0 0 "[ . 1 . 2]" 1
950 1 59 THR MG 1 70 VAL HA . . 3.180 2.673 2.391 3.058 . 0 0 "[ . 1 . 2]" 1
951 1 59 THR MG 1 70 VAL HB . . 5.160 4.094 3.829 4.316 . 0 0 "[ . 1 . 2]" 1
952 1 59 THR MG 1 70 VAL MG1 . . 3.060 1.894 1.765 2.142 . 0 0 "[ . 1 . 2]" 1
953 1 59 THR MG 1 70 VAL MG2 . . 3.210 2.448 2.034 2.810 . 0 0 "[ . 1 . 2]" 1
954 1 59 THR MG 1 73 ASP H . . 5.490 5.209 4.864 5.430 . 0 0 "[ . 1 . 2]" 1
955 1 59 THR MG 1 73 ASP HB2 . . 3.730 3.422 2.931 3.620 . 0 0 "[ . 1 . 2]" 1
956 1 59 THR MG 1 73 ASP HB3 . . 4.050 3.960 3.572 4.064 0.014 15 0 "[ . 1 . 2]" 1
957 1 59 THR MG 1 74 TRP H . . 4.900 4.601 4.314 4.903 0.003 19 0 "[ . 1 . 2]" 1
958 1 59 THR MG 1 74 TRP HA . . 5.500 5.213 4.905 5.435 . 0 0 "[ . 1 . 2]" 1
959 1 60 PRO HA 1 61 ILE H . . 2.880 2.155 2.150 2.164 . 0 0 "[ . 1 . 2]" 1
960 1 60 PRO HA 1 61 ILE HG12 . . 5.170 4.899 4.755 5.129 . 0 0 "[ . 1 . 2]" 1
961 1 60 PRO HA 1 61 ILE HG13 . . 5.240 3.940 3.819 4.097 . 0 0 "[ . 1 . 2]" 1
962 1 60 PRO HA 1 61 ILE MG . . 4.770 3.795 3.709 3.954 . 0 0 "[ . 1 . 2]" 1
963 1 60 PRO HB2 1 61 ILE H . . 4.090 3.562 3.436 3.719 . 0 0 "[ . 1 . 2]" 1
964 1 60 PRO HB2 1 61 ILE HA . . 5.140 4.287 4.215 4.402 . 0 0 "[ . 1 . 2]" 1
965 1 60 PRO HB3 1 61 ILE H . . 4.160 4.021 3.936 4.130 . 0 0 "[ . 1 . 2]" 1
966 1 60 PRO HG2 1 61 ILE H . . 5.040 4.968 4.920 5.017 . 0 0 "[ . 1 . 2]" 1
967 1 61 ILE H 1 61 ILE MD . . 3.870 3.654 3.553 3.737 . 0 0 "[ . 1 . 2]" 1
968 1 61 ILE H 1 61 ILE HG12 . . 3.910 3.422 3.207 3.528 . 0 0 "[ . 1 . 2]" 1
969 1 61 ILE H 1 61 ILE HG13 . . 3.560 2.083 1.918 2.176 . 0 0 "[ . 1 . 2]" 1
970 1 61 ILE H 1 61 ILE MG . . 3.910 3.003 2.819 3.138 . 0 0 "[ . 1 . 2]" 1
971 1 61 ILE H 1 62 THR H . . 5.180 4.410 4.366 4.458 . 0 0 "[ . 1 . 2]" 1
972 1 61 ILE H 1 62 THR MG . . 5.290 4.239 4.039 4.579 . 0 0 "[ . 1 . 2]" 1
973 1 61 ILE HA 1 61 ILE MG . . 3.220 2.354 2.243 2.436 . 0 0 "[ . 1 . 2]" 1
974 1 61 ILE HA 1 62 THR H . . 3.240 2.547 2.381 2.663 . 0 0 "[ . 1 . 2]" 1
975 1 61 ILE HA 1 65 SER HB2 . . 5.000 3.799 3.517 4.058 . 0 0 "[ . 1 . 2]" 1
976 1 61 ILE HB 1 61 ILE MD . . 3.460 2.158 2.034 2.237 . 0 0 "[ . 1 . 2]" 1
977 1 61 ILE HB 1 62 THR H . . 3.250 2.099 1.891 2.428 . 0 0 "[ . 1 . 2]" 1
978 1 61 ILE HB 1 65 SER H . . 4.700 4.461 4.263 4.700 . 0 0 "[ . 1 . 2]" 1
979 1 61 ILE HB 1 65 SER HB2 . . 3.670 2.209 2.076 2.498 . 0 0 "[ . 1 . 2]" 1
980 1 61 ILE HB 1 65 SER HB3 . . 3.920 2.628 2.357 3.061 . 0 0 "[ . 1 . 2]" 1
981 1 61 ILE MD 1 61 ILE MG . . 3.240 2.996 2.929 3.044 . 0 0 "[ . 1 . 2]" 1
982 1 61 ILE MD 1 62 THR H . . 4.430 2.775 2.343 3.225 . 0 0 "[ . 1 . 2]" 1
983 1 61 ILE MD 1 62 THR HA . . 3.790 3.026 2.833 3.283 . 0 0 "[ . 1 . 2]" 1
984 1 61 ILE MD 1 62 THR MG . . 4.560 4.203 4.053 4.339 . 0 0 "[ . 1 . 2]" 1
985 1 61 ILE MD 1 63 TYR H . . 4.960 4.245 3.890 4.752 . 0 0 "[ . 1 . 2]" 1
986 1 61 ILE MD 1 65 SER H . . 5.090 4.494 4.103 4.885 . 0 0 "[ . 1 . 2]" 1
987 1 61 ILE MD 1 65 SER HB2 . . 4.500 2.883 2.518 3.409 . 0 0 "[ . 1 . 2]" 1
988 1 61 ILE MD 1 65 SER HB3 . . 4.860 3.849 3.486 4.343 . 0 0 "[ . 1 . 2]" 1
989 1 61 ILE HG12 1 61 ILE MG . . 2.930 1.991 1.926 2.138 . 0 0 "[ . 1 . 2]" 1
990 1 61 ILE HG13 1 61 ILE MG . . 3.650 2.849 2.784 2.907 . 0 0 "[ . 1 . 2]" 1
991 1 61 ILE HG13 1 62 THR H . . 4.680 3.965 3.773 4.263 . 0 0 "[ . 1 . 2]" 1
992 1 61 ILE HG13 1 65 SER HB2 . . 5.500 4.846 4.578 5.182 . 0 0 "[ . 1 . 2]" 1
993 1 61 ILE MG 1 62 THR H . . 3.930 3.568 3.433 3.695 . 0 0 "[ . 1 . 2]" 1
994 1 61 ILE MG 1 65 SER H . . 5.500 5.453 5.329 5.538 0.038 20 0 "[ . 1 . 2]" 1
995 1 61 ILE MG 1 65 SER HA . . 5.240 4.983 4.777 5.248 0.008 13 0 "[ . 1 . 2]" 1
996 1 61 ILE MG 1 65 SER HB2 . . 3.900 3.513 3.346 3.600 . 0 0 "[ . 1 . 2]" 1
997 1 61 ILE MG 1 65 SER HB3 . . 3.860 2.864 2.655 3.112 . 0 0 "[ . 1 . 2]" 1
998 1 61 ILE MG 1 70 VAL H . . 5.370 4.194 4.000 4.389 . 0 0 "[ . 1 . 2]" 1
999 1 62 THR H 1 62 THR MG . . 3.740 3.198 2.962 3.593 . 0 0 "[ . 1 . 2]" 1
1000 1 62 THR H 1 64 LEU H . . 5.260 4.494 4.290 4.785 . 0 0 "[ . 1 . 2]" 1
1001 1 62 THR H 1 65 SER H . . 3.700 2.969 2.771 3.283 . 0 0 "[ . 1 . 2]" 1
1002 1 62 THR H 1 65 SER HA . . 4.950 4.200 3.938 4.554 . 0 0 "[ . 1 . 2]" 1
1003 1 62 THR H 1 65 SER HB2 . . 4.030 1.962 1.885 2.264 . 0 0 "[ . 1 . 2]" 1
1004 1 62 THR H 1 65 SER HB3 . . 4.320 3.118 2.967 3.550 . 0 0 "[ . 1 . 2]" 1
1005 1 62 THR HA 1 62 THR HB . . 2.970 2.510 2.423 2.636 . 0 0 "[ . 1 . 2]" 1
1006 1 62 THR HA 1 62 THR MG . . 2.920 2.265 2.037 2.390 . 0 0 "[ . 1 . 2]" 1
1007 1 62 THR HA 1 63 TYR H . . 3.510 2.426 2.291 2.670 . 0 0 "[ . 1 . 2]" 1
1008 1 62 THR HB 1 63 TYR H . . 4.330 2.364 1.901 2.671 . 0 0 "[ . 1 . 2]" 1
1009 1 62 THR HB 1 63 TYR QD . . 4.430 3.605 3.133 4.495 0.065 17 0 "[ . 1 . 2]" 1
1010 1 62 THR HB 1 64 LEU H . . 4.080 2.822 2.449 3.047 . 0 0 "[ . 1 . 2]" 1
1011 1 62 THR MG 1 64 LEU H . . 4.530 4.302 4.108 4.454 . 0 0 "[ . 1 . 2]" 1
1012 1 62 THR MG 1 65 SER H . . 4.590 4.374 4.210 4.584 . 0 0 "[ . 1 . 2]" 1
1013 1 62 THR MG 1 65 SER HG . . 5.280 3.889 3.320 5.288 0.008 17 0 "[ . 1 . 2]" 1
1014 1 63 TYR H 1 63 TYR QD . . 5.160 2.419 1.945 3.999 . 0 0 "[ . 1 . 2]" 1
1015 1 63 TYR H 1 64 LEU H . . 5.170 2.849 2.553 3.034 . 0 0 "[ . 1 . 2]" 1
1016 1 63 TYR HA 1 63 TYR QD . . 4.180 3.589 3.136 3.704 . 0 0 "[ . 1 . 2]" 1
1017 1 63 TYR HB2 1 64 LEU H . . 4.590 3.613 3.310 4.252 . 0 0 "[ . 1 . 2]" 1
1018 1 63 TYR HB2 1 65 SER H . . 5.500 5.601 5.277 6.319 0.819 17 3 "[ * . - . + 2]" 1
1019 1 63 TYR HB3 1 64 LEU H . . 4.750 3.980 3.037 4.240 . 0 0 "[ . 1 . 2]" 1
1020 1 63 TYR QD 1 64 LEU H . . 4.220 2.816 1.881 3.078 . 0 0 "[ . 1 . 2]" 1
1021 1 63 TYR QD 1 64 LEU HA . . 4.950 3.480 2.599 3.864 . 0 0 "[ . 1 . 2]" 1
1022 1 63 TYR QD 1 64 LEU MD1 . . 5.050 3.260 1.761 3.703 . 0 0 "[ . 1 . 2]" 1
1023 1 63 TYR QD 1 64 LEU MD2 . . 3.880 3.321 2.595 4.380 0.500 13 0 "[ . 1 . 2]" 1
1024 1 63 TYR QD 1 64 LEU HG . . 4.780 2.277 1.990 3.678 . 0 0 "[ . 1 . 2]" 1
1025 1 63 TYR QE 1 64 LEU H . . 5.220 4.106 3.812 4.802 . 0 0 "[ . 1 . 2]" 1
1026 1 63 TYR QE 1 64 LEU MD1 . . 4.580 2.624 2.033 3.779 . 0 0 "[ . 1 . 2]" 1
1027 1 63 TYR QE 1 64 LEU MD2 . . 3.760 3.538 2.217 4.389 0.629 19 3 "[ . 1 - . * +2]" 1
1028 1 63 TYR QE 1 64 LEU HG . . 4.960 2.771 2.355 4.984 0.024 19 0 "[ . 1 . 2]" 1
1029 1 64 LEU H 1 64 LEU HB2 . . 3.730 2.294 2.174 2.513 . 0 0 "[ . 1 . 2]" 1
1030 1 64 LEU H 1 64 LEU HB3 . . 3.270 3.546 3.488 3.599 0.329 15 0 "[ . 1 . 2]" 1
1031 1 64 LEU H 1 64 LEU MD1 . . 4.230 3.296 1.883 3.801 . 0 0 "[ . 1 . 2]" 1
1032 1 64 LEU H 1 64 LEU MD2 . . 4.000 3.928 3.518 4.198 0.198 19 0 "[ . 1 . 2]" 1
1033 1 64 LEU H 1 64 LEU HG . . 3.560 2.874 2.203 3.721 0.161 19 0 "[ . 1 . 2]" 1
1034 1 64 LEU H 1 65 SER H . . 3.220 2.508 2.342 2.720 . 0 0 "[ . 1 . 2]" 1
1035 1 64 LEU H 1 65 SER HB2 . . 5.390 4.605 4.376 4.798 . 0 0 "[ . 1 . 2]" 1
1036 1 64 LEU HA 1 64 LEU MD1 . . 4.330 3.738 3.009 3.934 . 0 0 "[ . 1 . 2]" 1
1037 1 64 LEU HA 1 64 LEU MD2 . . 2.880 2.440 1.974 3.650 0.770 17 3 "[ . 1 * . + -2]" 1
1038 1 64 LEU HA 1 64 LEU HG . . 3.860 2.722 2.263 2.991 . 0 0 "[ . 1 . 2]" 1
1039 1 64 LEU HB2 1 64 LEU MD2 . . 3.190 3.073 2.521 3.186 . 0 0 "[ . 1 . 2]" 1
1040 1 64 LEU HB2 1 65 SER H . . 4.290 2.746 2.508 3.161 . 0 0 "[ . 1 . 2]" 1
1041 1 64 LEU HB2 1 65 SER HA . . 5.500 4.414 4.115 4.626 . 0 0 "[ . 1 . 2]" 1
1042 1 64 LEU HB3 1 64 LEU MD1 . . 3.470 2.604 2.296 3.163 . 0 0 "[ . 1 . 2]" 1
1043 1 64 LEU HB3 1 64 LEU MD2 . . 3.440 2.211 2.007 2.361 . 0 0 "[ . 1 . 2]" 1
1044 1 64 LEU HB3 1 65 SER H . . 3.970 3.515 3.149 3.775 . 0 0 "[ . 1 . 2]" 1
1045 1 64 LEU HB3 1 65 SER HA . . 5.500 4.258 3.990 4.482 . 0 0 "[ . 1 . 2]" 1
1046 1 64 LEU MD2 1 65 SER H . . 4.950 4.740 4.566 4.935 . 0 0 "[ . 1 . 2]" 1
1047 1 64 LEU HG 1 65 SER H . . 4.840 4.669 4.259 4.940 0.100 19 0 "[ . 1 . 2]" 1
1048 1 65 SER H 1 65 SER HB2 . . 3.280 2.513 2.309 2.632 . 0 0 "[ . 1 . 2]" 1
1049 1 65 SER H 1 65 SER HB3 . . 3.660 3.601 3.558 3.621 . 0 0 "[ . 1 . 2]" 1
1050 1 65 SER H 1 66 GLU H . . 4.830 4.639 4.601 4.650 . 0 0 "[ . 1 . 2]" 1
1051 1 65 SER HA 1 66 GLU H . . 3.060 2.386 2.276 2.544 . 0 0 "[ . 1 . 2]" 1
1052 1 65 SER HA 1 66 GLU HA . . 5.000 4.437 4.392 4.523 . 0 0 "[ . 1 . 2]" 1
1053 1 65 SER HA 1 66 GLU QB . . 5.280 4.123 4.010 4.341 . 0 0 "[ . 1 . 2]" 1
1054 1 65 SER HA 1 66 GLU HG2 . . 5.500 5.268 4.175 5.513 0.013 16 0 "[ . 1 . 2]" 1
1055 1 65 SER HA 1 66 GLU HG3 . . 5.200 4.297 3.642 5.703 0.503 8 1 "[ . + 1 . 2]" 1
1056 1 65 SER HA 1 69 ASP HB2 . . 4.950 4.429 4.219 4.600 . 0 0 "[ . 1 . 2]" 1
1057 1 65 SER HA 1 69 ASP HB3 . . 5.070 4.840 4.628 5.078 0.008 18 0 "[ . 1 . 2]" 1
1058 1 65 SER HB2 1 66 GLU H . . 4.570 3.739 3.396 3.939 . 0 0 "[ . 1 . 2]" 1
1059 1 65 SER HB3 1 66 GLU H . . 3.980 2.491 2.141 2.766 . 0 0 "[ . 1 . 2]" 1
1060 1 65 SER HB3 1 69 ASP HB2 . . 4.620 4.387 4.084 4.675 0.055 14 0 "[ . 1 . 2]" 1
1061 1 65 SER HB3 1 69 ASP HB3 . . 4.820 4.067 3.608 4.427 . 0 0 "[ . 1 . 2]" 1
1062 1 65 SER HB3 1 70 VAL MG2 . . 4.660 3.810 3.517 4.061 . 0 0 "[ . 1 . 2]" 1
1063 1 66 GLU H 1 66 GLU QB . . 3.820 2.484 2.357 2.636 . 0 0 "[ . 1 . 2]" 1
1064 1 66 GLU H 1 66 GLU HG2 . . 4.370 4.216 3.340 4.396 0.026 15 0 "[ . 1 . 2]" 1
1065 1 66 GLU H 1 66 GLU HG3 . . 4.280 3.643 3.028 4.483 0.203 8 0 "[ . 1 . 2]" 1
1066 1 66 GLU H 1 68 VAL MG1 . . 4.690 4.217 4.087 4.349 . 0 0 "[ . 1 . 2]" 1
1067 1 66 GLU H 1 69 ASP H . . 4.510 3.676 3.593 3.774 . 0 0 "[ . 1 . 2]" 1
1068 1 66 GLU H 1 69 ASP HA . . 5.500 5.462 5.374 5.536 0.036 15 0 "[ . 1 . 2]" 1
1069 1 66 GLU H 1 69 ASP HB2 . . 3.950 2.790 2.576 2.953 . 0 0 "[ . 1 . 2]" 1
1070 1 66 GLU H 1 69 ASP HB3 . . 4.290 3.497 3.129 3.797 . 0 0 "[ . 1 . 2]" 1
1071 1 66 GLU H 1 70 VAL MG2 . . 5.230 4.318 4.013 4.619 . 0 0 "[ . 1 . 2]" 1
1072 1 66 GLU HA 1 66 GLU HG2 . . 3.610 2.374 2.112 3.438 . 0 0 "[ . 1 . 2]" 1
1073 1 66 GLU HA 1 66 GLU HG3 . . 3.810 3.006 2.681 3.431 . 0 0 "[ . 1 . 2]" 1
1074 1 66 GLU HA 1 67 PRO HD2 . . 3.530 2.498 2.418 2.536 . 0 0 "[ . 1 . 2]" 1
1075 1 66 GLU HA 1 67 PRO HD3 . . 3.130 2.341 2.304 2.360 . 0 0 "[ . 1 . 2]" 1
1076 1 66 GLU HA 1 67 PRO HG2 . . 4.980 4.592 4.526 4.624 . 0 0 "[ . 1 . 2]" 1
1077 1 66 GLU HA 1 67 PRO HG3 . . 5.060 4.533 4.481 4.558 . 0 0 "[ . 1 . 2]" 1
1078 1 66 GLU HA 1 68 VAL MG1 . . 5.240 4.297 4.211 4.382 . 0 0 "[ . 1 . 2]" 1
1079 1 66 GLU QB 1 67 PRO HD2 . . 3.900 1.975 1.913 2.005 . 0 0 "[ . 1 . 2]" 1
1080 1 66 GLU QB 1 67 PRO HD3 . . 4.530 3.350 3.304 3.372 . 0 0 "[ . 1 . 2]" 1
1081 1 66 GLU QB 1 68 VAL H . . 3.360 2.221 2.172 2.372 . 0 0 "[ . 1 . 2]" 1
1082 1 66 GLU QB 1 68 VAL HB . . 4.280 3.850 3.721 4.035 . 0 0 "[ . 1 . 2]" 1
1083 1 66 GLU QB 1 68 VAL MG1 . . 3.160 1.949 1.891 2.102 . 0 0 "[ . 1 . 2]" 1
1084 1 66 GLU QB 1 69 ASP H . . 4.510 2.888 2.700 2.982 . 0 0 "[ . 1 . 2]" 1
1085 1 66 GLU QB 1 69 ASP HA . . 5.500 4.890 4.668 5.038 . 0 0 "[ . 1 . 2]" 1
1086 1 66 GLU QB 1 70 VAL H . . 5.500 4.808 4.689 4.927 . 0 0 "[ . 1 . 2]" 1
1087 1 66 GLU HG2 1 67 PRO HD2 . . 4.460 2.803 2.543 4.400 . 0 0 "[ . 1 . 2]" 1
1088 1 66 GLU HG2 1 67 PRO HD3 . . 4.530 3.568 3.257 5.360 0.830 8 1 "[ . + 1 . 2]" 1
1089 1 66 GLU HG2 1 68 VAL H . . 5.080 4.694 4.585 5.077 . 0 0 "[ . 1 . 2]" 1
1090 1 66 GLU HG2 1 68 VAL MG1 . . 4.470 4.101 3.833 4.340 . 0 0 "[ . 1 . 2]" 1
1091 1 66 GLU HG3 1 67 PRO HD2 . . 4.370 3.977 3.388 4.181 . 0 0 "[ . 1 . 2]" 1
1092 1 66 GLU HG3 1 67 PRO HD3 . . 5.260 4.814 4.659 5.164 . 0 0 "[ . 1 . 2]" 1
1093 1 66 GLU HG3 1 68 VAL H . . 5.220 5.105 4.598 5.175 . 0 0 "[ . 1 . 2]" 1
1094 1 66 GLU HG3 1 68 VAL MG1 . . 4.680 4.092 3.354 4.303 . 0 0 "[ . 1 . 2]" 1
1095 1 66 GLU HG3 1 69 ASP H . . 5.500 5.480 5.325 5.524 0.024 20 0 "[ . 1 . 2]" 1
1096 1 67 PRO HA 1 68 VAL MG1 . . 5.150 4.888 4.792 4.979 . 0 0 "[ . 1 . 2]" 1
1097 1 67 PRO HA 1 69 ASP H . . 4.830 4.332 4.190 4.466 . 0 0 "[ . 1 . 2]" 1
1098 1 67 PRO HA 1 70 VAL H . . 4.040 3.918 3.840 3.977 . 0 0 "[ . 1 . 2]" 1
1099 1 67 PRO HA 1 70 VAL HB . . 3.860 3.644 3.446 3.762 . 0 0 "[ . 1 . 2]" 1
1100 1 67 PRO HB2 1 68 VAL H . . 4.310 3.827 3.748 3.882 . 0 0 "[ . 1 . 2]" 1
1101 1 67 PRO HD2 1 68 VAL H . . 4.300 2.870 2.799 2.923 . 0 0 "[ . 1 . 2]" 1
1102 1 67 PRO HD3 1 68 VAL H . . 4.990 3.961 3.924 3.989 . 0 0 "[ . 1 . 2]" 1
1103 1 67 PRO HG2 1 68 VAL MG1 . . 5.500 3.909 3.603 4.080 . 0 0 "[ . 1 . 2]" 1
1104 1 67 PRO HG3 1 68 VAL H . . 5.250 4.427 4.324 4.498 . 0 0 "[ . 1 . 2]" 1
1105 1 67 PRO HG3 1 68 VAL MG1 . . 5.500 5.213 4.948 5.370 . 0 0 "[ . 1 . 2]" 1
1106 1 68 VAL H 1 68 VAL HB . . 3.500 2.840 2.744 2.959 . 0 0 "[ . 1 . 2]" 1
1107 1 68 VAL H 1 68 VAL MG1 . . 3.090 1.963 1.874 2.159 . 0 0 "[ . 1 . 2]" 1
1108 1 68 VAL H 1 68 VAL MG2 . . 3.850 3.797 3.764 3.811 . 0 0 "[ . 1 . 2]" 1
1109 1 68 VAL H 1 69 ASP H . . 3.790 2.221 2.183 2.298 . 0 0 "[ . 1 . 2]" 1
1110 1 68 VAL H 1 70 VAL H . . 4.930 4.068 3.974 4.222 . 0 0 "[ . 1 . 2]" 1
1111 1 68 VAL HA 1 68 VAL HB . . 3.010 2.433 2.384 2.470 . 0 0 "[ . 1 . 2]" 1
1112 1 68 VAL HA 1 68 VAL MG1 . . 3.660 3.199 3.180 3.204 . 0 0 "[ . 1 . 2]" 1
1113 1 68 VAL HA 1 68 VAL MG2 . . 3.200 2.404 2.349 2.482 . 0 0 "[ . 1 . 2]" 1
1114 1 68 VAL HA 1 69 ASP HA . . 5.310 4.791 4.764 4.819 . 0 0 "[ . 1 . 2]" 1
1115 1 68 VAL HA 1 70 VAL H . . 4.750 4.563 4.374 4.679 . 0 0 "[ . 1 . 2]" 1
1116 1 68 VAL HA 1 71 TYR H . . 3.970 3.679 3.535 3.805 . 0 0 "[ . 1 . 2]" 1
1117 1 68 VAL HA 1 71 TYR HB2 . . 4.000 3.874 3.546 4.009 0.009 10 0 "[ . 1 . 2]" 1
1118 1 68 VAL HA 1 71 TYR HB3 . . 4.080 3.360 3.035 3.547 . 0 0 "[ . 1 . 2]" 1
1119 1 68 VAL HA 1 71 TYR QD . . 5.060 4.380 3.989 4.660 . 0 0 "[ . 1 . 2]" 1
1120 1 68 VAL HB 1 69 ASP H . . 5.000 4.030 3.942 4.140 . 0 0 "[ . 1 . 2]" 1
1121 1 68 VAL MG1 1 69 ASP H . . 3.380 2.099 1.878 2.278 . 0 0 "[ . 1 . 2]" 1
1122 1 68 VAL MG1 1 69 ASP HA . . 4.300 3.268 3.109 3.578 . 0 0 "[ . 1 . 2]" 1
1123 1 68 VAL MG1 1 69 ASP HB2 . . 4.800 3.135 2.996 3.327 . 0 0 "[ . 1 . 2]" 1
1124 1 68 VAL MG1 1 69 ASP HB3 . . 5.100 4.399 4.206 4.594 . 0 0 "[ . 1 . 2]" 1
1125 1 68 VAL MG1 1 70 VAL H . . 4.540 4.409 4.295 4.507 . 0 0 "[ . 1 . 2]" 1
1126 1 68 VAL MG2 1 69 ASP H . . 4.250 3.661 3.483 3.759 . 0 0 "[ . 1 . 2]" 1
1127 1 68 VAL MG2 1 69 ASP HA . . 4.750 3.637 3.370 3.806 . 0 0 "[ . 1 . 2]" 1
1128 1 68 VAL MG2 1 71 TYR H . . 4.890 4.506 4.316 4.658 . 0 0 "[ . 1 . 2]" 1
1129 1 68 VAL MG2 1 71 TYR HB2 . . 5.340 4.608 4.200 4.787 . 0 0 "[ . 1 . 2]" 1
1130 1 68 VAL MG2 1 71 TYR HB3 . . 4.960 3.510 3.188 3.679 . 0 0 "[ . 1 . 2]" 1
1131 1 68 VAL MG2 1 71 TYR QD . . 4.120 3.459 3.209 3.689 . 0 0 "[ . 1 . 2]" 1
1132 1 68 VAL MG2 1 72 SER H . . 4.350 4.087 3.825 4.352 0.002 1 0 "[ . 1 . 2]" 1
1133 1 68 VAL MG2 1 72 SER QB . . 4.560 4.114 3.588 4.442 . 0 0 "[ . 1 . 2]" 1
1134 1 69 ASP H 1 69 ASP HB2 . . 3.690 2.142 2.071 2.258 . 0 0 "[ . 1 . 2]" 1
1135 1 69 ASP H 1 69 ASP HB3 . . 3.870 3.063 2.858 3.285 . 0 0 "[ . 1 . 2]" 1
1136 1 69 ASP H 1 70 VAL H . . 3.150 2.692 2.635 2.754 . 0 0 "[ . 1 . 2]" 1
1137 1 69 ASP H 1 70 VAL HB . . 4.990 4.838 4.742 4.913 . 0 0 "[ . 1 . 2]" 1
1138 1 69 ASP H 1 70 VAL MG2 . . 4.400 4.050 3.950 4.237 . 0 0 "[ . 1 . 2]" 1
1139 1 69 ASP H 1 71 TYR H . . 5.070 4.183 4.076 4.328 . 0 0 "[ . 1 . 2]" 1
1140 1 69 ASP HA 1 70 VAL MG2 . . 5.330 5.051 5.000 5.110 . 0 0 "[ . 1 . 2]" 1
1141 1 69 ASP HA 1 71 TYR HB3 . . 5.500 4.742 4.625 4.946 . 0 0 "[ . 1 . 2]" 1
1142 1 69 ASP HA 1 72 SER H . . 3.920 3.509 3.380 3.689 . 0 0 "[ . 1 . 2]" 1
1143 1 69 ASP HA 1 72 SER QB . . 3.660 2.874 2.773 3.082 . 0 0 "[ . 1 . 2]" 1
1144 1 69 ASP HA 1 73 ASP H . . 4.970 4.300 4.044 4.725 . 0 0 "[ . 1 . 2]" 1
1145 1 69 ASP HB2 1 70 VAL H . . 3.790 3.312 3.030 3.582 . 0 0 "[ . 1 . 2]" 1
1146 1 69 ASP HB2 1 70 VAL HA . . 5.440 5.282 5.042 5.457 0.017 20 0 "[ . 1 . 2]" 1
1147 1 69 ASP HB2 1 70 VAL MG2 . . 4.630 4.310 3.979 4.521 . 0 0 "[ . 1 . 2]" 1
1148 1 69 ASP HB3 1 70 VAL H . . 4.170 2.596 2.408 2.801 . 0 0 "[ . 1 . 2]" 1
1149 1 69 ASP HB3 1 70 VAL HA . . 5.500 3.810 3.756 3.901 . 0 0 "[ . 1 . 2]" 1
1150 1 69 ASP HB3 1 70 VAL MG2 . . 5.070 3.411 3.182 3.611 . 0 0 "[ . 1 . 2]" 1
1151 1 70 VAL H 1 70 VAL HB . . 3.110 2.610 2.551 2.657 . 0 0 "[ . 1 . 2]" 1
1152 1 70 VAL H 1 70 VAL MG1 . . 3.990 3.769 3.764 3.773 . 0 0 "[ . 1 . 2]" 1
1153 1 70 VAL H 1 70 VAL MG2 . . 3.030 2.038 1.920 2.205 . 0 0 "[ . 1 . 2]" 1
1154 1 70 VAL H 1 71 TYR HA . . 5.500 5.427 5.335 5.469 . 0 0 "[ . 1 . 2]" 1
1155 1 70 VAL H 1 71 TYR HB2 . . 5.500 5.411 5.267 5.497 . 0 0 "[ . 1 . 2]" 1
1156 1 70 VAL H 1 71 TYR HB3 . . 5.500 4.951 4.842 5.022 . 0 0 "[ . 1 . 2]" 1
1157 1 70 VAL H 1 72 SER H . . 5.500 4.682 4.542 4.831 . 0 0 "[ . 1 . 2]" 1
1158 1 70 VAL H 1 72 SER QB . . 5.500 5.234 5.180 5.304 . 0 0 "[ . 1 . 2]" 1
1159 1 70 VAL HA 1 70 VAL MG1 . . 3.280 2.411 2.296 2.468 . 0 0 "[ . 1 . 2]" 1
1160 1 70 VAL HA 1 70 VAL MG2 . . 3.200 2.349 2.280 2.417 . 0 0 "[ . 1 . 2]" 1
1161 1 70 VAL HA 1 73 ASP H . . 4.230 3.704 3.538 3.848 . 0 0 "[ . 1 . 2]" 1
1162 1 70 VAL HA 1 73 ASP HB2 . . 3.990 2.760 2.622 2.970 . 0 0 "[ . 1 . 2]" 1
1163 1 70 VAL HA 1 73 ASP HB3 . . 4.520 4.301 4.156 4.454 . 0 0 "[ . 1 . 2]" 1
1164 1 70 VAL HA 1 74 TRP H . . 4.860 4.218 4.037 4.416 . 0 0 "[ . 1 . 2]" 1
1165 1 70 VAL HB 1 71 TYR H . . 3.460 2.644 2.530 2.722 . 0 0 "[ . 1 . 2]" 1
1166 1 70 VAL MG1 1 71 TYR H . . 3.900 3.481 3.356 3.590 . 0 0 "[ . 1 . 2]" 1
1167 1 70 VAL MG1 1 71 TYR HA . . 4.560 3.520 3.345 3.671 . 0 0 "[ . 1 . 2]" 1
1168 1 70 VAL MG1 1 73 ASP HB2 . . 5.400 3.686 3.321 3.935 . 0 0 "[ . 1 . 2]" 1
1169 1 70 VAL MG1 1 74 TRP H . . 4.670 3.836 3.567 4.044 . 0 0 "[ . 1 . 2]" 1
1170 1 71 TYR H 1 71 TYR HB2 . . 3.480 2.667 2.592 2.716 . 0 0 "[ . 1 . 2]" 1
1171 1 71 TYR H 1 71 TYR HB3 . . 3.400 2.400 2.359 2.471 . 0 0 "[ . 1 . 2]" 1
1172 1 71 TYR H 1 71 TYR QD . . 4.420 4.186 4.180 4.195 . 0 0 "[ . 1 . 2]" 1
1173 1 71 TYR H 1 72 SER H . . 3.450 2.860 2.747 2.978 . 0 0 "[ . 1 . 2]" 1
1174 1 71 TYR H 1 73 ASP H . . 5.060 4.203 4.039 4.476 . 0 0 "[ . 1 . 2]" 1
1175 1 71 TYR H 1 73 ASP HB2 . . 5.500 5.006 4.877 5.236 . 0 0 "[ . 1 . 2]" 1
1176 1 71 TYR HA 1 71 TYR QD . . 3.440 2.234 2.091 2.307 . 0 0 "[ . 1 . 2]" 1
1177 1 71 TYR HA 1 71 TYR HE1 . . 4.680 4.647 4.550 4.694 0.014 11 0 "[ . 1 . 2]" 1
1178 1 71 TYR HA 1 74 TRP H . . 4.110 3.559 3.373 3.801 . 0 0 "[ . 1 . 2]" 1
1179 1 71 TYR HA 1 74 TRP HB2 . . 4.320 3.358 3.100 3.623 . 0 0 "[ . 1 . 2]" 1
1180 1 71 TYR HA 1 74 TRP HB3 . . 4.150 3.123 2.920 3.616 . 0 0 "[ . 1 . 2]" 1
1181 1 71 TYR HA 1 74 TRP HE3 . . 4.050 3.456 3.196 3.946 . 0 0 "[ . 1 . 2]" 1
1182 1 71 TYR HA 1 75 ILE H . . 4.790 4.589 4.339 4.770 . 0 0 "[ . 1 . 2]" 1
1183 1 71 TYR HB2 1 71 TYR HE1 . . 5.160 4.960 4.896 5.068 . 0 0 "[ . 1 . 2]" 1
1184 1 71 TYR HB2 1 72 SER H . . 3.850 3.781 3.701 3.852 0.002 3 0 "[ . 1 . 2]" 1
1185 1 71 TYR HB3 1 72 SER H . . 3.410 2.338 2.220 2.464 . 0 0 "[ . 1 . 2]" 1
1186 1 71 TYR HB3 1 72 SER HA . . 5.500 4.351 4.291 4.402 . 0 0 "[ . 1 . 2]" 1
1187 1 71 TYR QD 1 72 SER H . . 4.000 3.526 3.343 3.921 . 0 0 "[ . 1 . 2]" 1
1188 1 71 TYR QD 1 72 SER HA . . 4.910 4.127 3.961 4.310 . 0 0 "[ . 1 . 2]" 1
1189 1 71 TYR QD 1 74 TRP H . . 4.950 4.797 4.595 4.949 . 0 0 "[ . 1 . 2]" 1
1190 1 71 TYR QD 1 74 TRP HB3 . . 5.420 3.245 3.071 3.423 . 0 0 "[ . 1 . 2]" 1
1191 1 71 TYR QD 1 74 TRP HE3 . . 4.000 2.584 2.249 2.927 . 0 0 "[ . 1 . 2]" 1
1192 1 71 TYR QD 1 74 TRP HZ3 . . 4.830 4.241 3.924 4.735 . 0 0 "[ . 1 . 2]" 1
1193 1 71 TYR QD 1 75 ILE H . . 5.430 4.553 4.259 4.780 . 0 0 "[ . 1 . 2]" 1
1194 1 71 TYR QD 1 75 ILE HG12 . . 4.970 3.772 3.393 4.145 . 0 0 "[ . 1 . 2]" 1
1195 1 71 TYR HE1 1 75 ILE H . . 5.500 5.229 4.922 5.492 . 0 0 "[ . 1 . 2]" 1
1196 1 71 TYR HE1 1 75 ILE MD . . 3.620 2.074 1.893 2.223 . 0 0 "[ . 1 . 2]" 1
1197 1 71 TYR HE1 1 75 ILE HG12 . . 5.500 3.932 3.430 4.501 . 0 0 "[ . 1 . 2]" 1
1198 1 71 TYR HE1 1 75 ILE MG . . 5.090 4.966 4.590 5.105 0.015 20 0 "[ . 1 . 2]" 1
1199 1 72 SER H 1 72 SER QB . . 3.170 2.160 2.052 2.259 . 0 0 "[ . 1 . 2]" 1
1200 1 72 SER H 1 73 ASP H . . 3.440 2.867 2.780 3.019 . 0 0 "[ . 1 . 2]" 1
1201 1 72 SER H 1 75 ILE HG12 . . 4.880 4.492 4.338 4.652 . 0 0 "[ . 1 . 2]" 1
1202 1 72 SER HA 1 75 ILE H . . 4.100 3.583 3.477 3.751 . 0 0 "[ . 1 . 2]" 1
1203 1 72 SER HA 1 75 ILE HB . . 3.770 3.404 3.174 3.551 . 0 0 "[ . 1 . 2]" 1
1204 1 72 SER HA 1 75 ILE MD . . 4.480 4.038 3.689 4.352 . 0 0 "[ . 1 . 2]" 1
1205 1 72 SER HA 1 75 ILE HG12 . . 4.310 2.639 2.257 2.997 . 0 0 "[ . 1 . 2]" 1
1206 1 72 SER HA 1 75 ILE HG13 . . 4.740 2.940 2.688 3.128 . 0 0 "[ . 1 . 2]" 1
1207 1 72 SER HA 1 75 ILE MG . . 4.470 4.402 4.258 4.492 0.022 6 0 "[ . 1 . 2]" 1
1208 1 72 SER HA 1 76 ASP H . . 5.500 4.607 4.418 4.797 . 0 0 "[ . 1 . 2]" 1
1209 1 72 SER QB 1 73 ASP H . . 4.050 2.600 2.421 2.789 . 0 0 "[ . 1 . 2]" 1
1210 1 73 ASP H 1 73 ASP HB2 . . 3.660 2.363 2.276 2.616 . 0 0 "[ . 1 . 2]" 1
1211 1 73 ASP H 1 73 ASP HB3 . . 3.880 3.568 3.545 3.594 . 0 0 "[ . 1 . 2]" 1
1212 1 73 ASP HA 1 75 ILE H . . 5.330 4.187 3.913 4.386 . 0 0 "[ . 1 . 2]" 1
1213 1 73 ASP HA 1 76 ASP HB2 . . 3.520 3.400 3.160 3.512 . 0 0 "[ . 1 . 2]" 1
1214 1 73 ASP HA 1 76 ASP HB3 . . 4.290 4.272 4.192 4.302 0.012 10 0 "[ . 1 . 2]" 1
1215 1 73 ASP HA 1 77 ALA H . . 4.680 4.167 3.984 4.571 . 0 0 "[ . 1 . 2]" 1
1216 1 73 ASP HB2 1 74 TRP H . . 3.540 2.560 2.304 2.675 . 0 0 "[ . 1 . 2]" 1
1217 1 73 ASP HB3 1 74 TRP H . . 4.090 3.358 3.186 3.486 . 0 0 "[ . 1 . 2]" 1
1218 1 74 TRP H 1 74 TRP HB2 . . 3.200 2.394 2.302 2.455 . 0 0 "[ . 1 . 2]" 1
1219 1 74 TRP H 1 74 TRP HB3 . . 3.340 2.680 2.606 2.798 . 0 0 "[ . 1 . 2]" 1
1220 1 74 TRP H 1 74 TRP HD1 . . 4.840 4.683 4.581 4.737 . 0 0 "[ . 1 . 2]" 1
1221 1 74 TRP H 1 74 TRP HE3 . . 5.350 5.034 4.983 5.111 . 0 0 "[ . 1 . 2]" 1
1222 1 74 TRP H 1 75 ILE HB . . 5.210 5.161 5.064 5.215 0.005 20 0 "[ . 1 . 2]" 1
1223 1 74 TRP H 1 75 ILE HG12 . . 5.160 4.117 3.947 4.264 . 0 0 "[ . 1 . 2]" 1
1224 1 74 TRP H 1 77 ALA MB . . 4.670 4.167 3.981 4.613 . 0 0 "[ . 1 . 2]" 1
1225 1 74 TRP HA 1 74 TRP HD1 . . 3.200 2.154 2.064 2.225 . 0 0 "[ . 1 . 2]" 1
1226 1 74 TRP HA 1 74 TRP HE1 . . 4.820 4.665 4.578 4.727 . 0 0 "[ . 1 . 2]" 1
1227 1 74 TRP HA 1 77 ALA H . . 4.030 3.558 3.427 3.726 . 0 0 "[ . 1 . 2]" 1
1228 1 74 TRP HA 1 77 ALA MB . . 3.430 2.291 1.981 2.694 . 0 0 "[ . 1 . 2]" 1
1229 1 74 TRP HB2 1 75 ILE H . . 4.150 3.861 3.744 4.006 . 0 0 "[ . 1 . 2]" 1
1230 1 74 TRP HB2 1 75 ILE MD . . 5.330 4.766 4.377 5.190 . 0 0 "[ . 1 . 2]" 1
1231 1 74 TRP HB2 1 77 ALA MB . . 5.500 4.443 4.259 4.856 . 0 0 "[ . 1 . 2]" 1
1232 1 74 TRP HB3 1 74 TRP HE3 . . 4.150 2.607 2.543 2.666 . 0 0 "[ . 1 . 2]" 1
1233 1 74 TRP HB3 1 74 TRP HZ3 . . 5.500 4.983 4.932 5.030 . 0 0 "[ . 1 . 2]" 1
1234 1 74 TRP HB3 1 75 ILE H . . 3.480 2.679 2.514 2.912 . 0 0 "[ . 1 . 2]" 1
1235 1 74 TRP HB3 1 75 ILE HG12 . . 5.260 3.474 3.342 3.606 . 0 0 "[ . 1 . 2]" 1
1236 1 74 TRP HD1 1 77 ALA H . . 5.100 4.733 4.599 4.895 . 0 0 "[ . 1 . 2]" 1
1237 1 74 TRP HD1 1 77 ALA MB . . 3.670 2.720 2.579 3.026 . 0 0 "[ . 1 . 2]" 1
1238 1 74 TRP HD1 1 78 CYS H . . 5.170 4.340 3.950 4.711 . 0 0 "[ . 1 . 2]" 1
1239 1 74 TRP HE1 1 77 ALA MB . . 4.820 4.567 4.267 4.760 . 0 0 "[ . 1 . 2]" 1
1240 1 74 TRP HE3 1 75 ILE MD . . 4.700 3.713 3.523 3.959 . 0 0 "[ . 1 . 2]" 1
1241 1 75 ILE H 1 75 ILE HB . . 3.130 2.661 2.578 2.728 . 0 0 "[ . 1 . 2]" 1
1242 1 75 ILE H 1 75 ILE MD . . 3.970 2.923 2.608 3.235 . 0 0 "[ . 1 . 2]" 1
1243 1 75 ILE H 1 75 ILE HG12 . . 3.100 1.928 1.891 2.071 . 0 0 "[ . 1 . 2]" 1
1244 1 75 ILE H 1 75 ILE MG . . 3.780 3.760 3.751 3.769 . 0 0 "[ . 1 . 2]" 1
1245 1 75 ILE H 1 76 ASP HB2 . . 5.300 4.746 4.565 4.818 . 0 0 "[ . 1 . 2]" 1
1246 1 75 ILE HA 1 75 ILE MD . . 3.190 2.102 1.969 2.313 . 0 0 "[ . 1 . 2]" 1
1247 1 75 ILE HA 1 75 ILE HG12 . . 3.970 3.171 2.993 3.318 . 0 0 "[ . 1 . 2]" 1
1248 1 75 ILE HA 1 75 ILE MG . . 3.270 2.328 2.230 2.412 . 0 0 "[ . 1 . 2]" 1
1249 1 75 ILE HA 1 76 ASP HA . . 5.210 4.758 4.715 4.839 . 0 0 "[ . 1 . 2]" 1
1250 1 75 ILE HA 1 77 ALA H . . 5.260 4.102 3.835 4.262 . 0 0 "[ . 1 . 2]" 1
1251 1 75 ILE HA 1 78 CYS H . . 3.940 3.605 3.067 3.770 . 0 0 "[ . 1 . 2]" 1
1252 1 75 ILE HA 1 78 CYS HB2 . . 4.300 4.149 3.851 4.302 0.002 15 0 "[ . 1 . 2]" 1
1253 1 75 ILE HA 1 78 CYS HB3 . . 3.900 3.617 2.795 3.904 0.004 15 0 "[ . 1 . 2]" 1
1254 1 75 ILE HA 1 79 GLU H . . 5.140 4.135 3.793 4.490 . 0 0 "[ . 1 . 2]" 1
1255 1 75 ILE HB 1 75 ILE MD . . 3.730 3.221 3.207 3.230 . 0 0 "[ . 1 . 2]" 1
1256 1 75 ILE HB 1 76 ASP H . . 3.730 2.081 1.973 2.271 . 0 0 "[ . 1 . 2]" 1
1257 1 75 ILE HB 1 76 ASP HA . . 5.220 4.108 3.994 4.188 . 0 0 "[ . 1 . 2]" 1
1258 1 75 ILE HB 1 76 ASP HB2 . . 5.500 3.787 3.723 3.919 . 0 0 "[ . 1 . 2]" 1
1259 1 75 ILE MD 1 75 ILE MG . . 2.980 1.955 1.896 2.091 . 0 0 "[ . 1 . 2]" 1
1260 1 75 ILE MD 1 78 CYS HB2 . . 5.500 5.115 4.770 5.409 . 0 0 "[ . 1 . 2]" 1
1261 1 75 ILE MD 1 78 CYS HB3 . . 5.320 4.741 3.872 5.064 . 0 0 "[ . 1 . 2]" 1
1262 1 75 ILE HG12 1 76 ASP H . . 4.730 3.905 3.740 4.006 . 0 0 "[ . 1 . 2]" 1
1263 1 75 ILE HG12 1 77 ALA H . . 5.470 5.458 5.345 5.481 0.011 16 0 "[ . 1 . 2]" 1
1264 1 75 ILE HG13 1 75 ILE MG . . 3.480 2.363 2.244 2.458 . 0 0 "[ . 1 . 2]" 1
1265 1 75 ILE HG13 1 76 ASP H . . 5.340 4.482 4.418 4.593 . 0 0 "[ . 1 . 2]" 1
1266 1 75 ILE MG 1 76 ASP H . . 3.870 3.179 3.023 3.345 . 0 0 "[ . 1 . 2]" 1
1267 1 75 ILE MG 1 76 ASP HA . . 4.210 3.488 3.260 3.645 . 0 0 "[ . 1 . 2]" 1
1268 1 75 ILE MG 1 77 ALA H . . 5.030 4.679 4.465 4.790 . 0 0 "[ . 1 . 2]" 1
1269 1 75 ILE MG 1 78 CYS H . . 5.150 4.540 4.155 4.708 . 0 0 "[ . 1 . 2]" 1
1270 1 75 ILE MG 1 78 CYS HB3 . . 5.320 4.411 4.041 4.642 . 0 0 "[ . 1 . 2]" 1
1271 1 75 ILE MG 1 79 GLU H . . 4.560 3.939 3.660 4.137 . 0 0 "[ . 1 . 2]" 1
1272 1 75 ILE MG 1 79 GLU HB2 . . 5.010 4.269 3.682 4.750 . 0 0 "[ . 1 . 2]" 1
1273 1 75 ILE MG 1 79 GLU HB3 . . 5.490 4.599 3.232 5.493 0.003 15 0 "[ . 1 . 2]" 1
1274 1 75 ILE MG 1 79 GLU HG2 . . 4.170 3.194 2.588 4.021 . 0 0 "[ . 1 . 2]" 1
1275 1 75 ILE MG 1 79 GLU HG3 . . 4.830 3.198 2.424 4.619 . 0 0 "[ . 1 . 2]" 1
1276 1 76 ASP H 1 76 ASP HB2 . . 3.440 2.072 2.067 2.086 . 0 0 "[ . 1 . 2]" 1
1277 1 76 ASP H 1 76 ASP HB3 . . 3.480 3.306 3.241 3.350 . 0 0 "[ . 1 . 2]" 1
1278 1 76 ASP H 1 77 ALA H . . 3.260 2.660 2.545 2.835 . 0 0 "[ . 1 . 2]" 1
1279 1 76 ASP H 1 77 ALA MB . . 5.060 4.286 4.179 4.503 . 0 0 "[ . 1 . 2]" 1
1280 1 76 ASP HA 1 77 ALA MB . . 5.340 4.969 4.947 4.999 . 0 0 "[ . 1 . 2]" 1
1281 1 76 ASP HA 1 78 CYS H . . 5.020 4.093 3.930 4.346 . 0 0 "[ . 1 . 2]" 1
1282 1 76 ASP HA 1 79 GLU H . . 4.300 3.436 3.224 3.758 . 0 0 "[ . 1 . 2]" 1
1283 1 76 ASP HA 1 79 GLU HB2 . . 4.100 2.906 2.192 4.645 0.545 20 4 "[ * . 1 * . - +]" 1
1284 1 76 ASP HA 1 79 GLU HB3 . . 4.620 3.948 3.604 4.421 . 0 0 "[ . 1 . 2]" 1
1285 1 76 ASP HA 1 79 GLU HG2 . . 5.190 3.577 1.953 4.707 . 0 0 "[ . 1 . 2]" 1
1286 1 76 ASP HA 1 79 GLU HG3 . . 5.020 2.885 2.081 3.704 . 0 0 "[ . 1 . 2]" 1
1287 1 76 ASP HB2 1 77 ALA H . . 3.520 3.407 3.309 3.519 . 0 0 "[ . 1 . 2]" 1
1288 1 76 ASP HB2 1 77 ALA HA . . 5.450 5.143 5.051 5.308 . 0 0 "[ . 1 . 2]" 1
1289 1 76 ASP HB2 1 77 ALA MB . . 5.080 4.731 4.654 4.830 . 0 0 "[ . 1 . 2]" 1
1290 1 76 ASP HB2 1 78 CYS H . . 5.500 5.465 5.304 5.505 0.005 19 0 "[ . 1 . 2]" 1
1291 1 76 ASP HB3 1 77 ALA H . . 3.700 3.324 3.175 3.492 . 0 0 "[ . 1 . 2]" 1
1292 1 76 ASP HB3 1 77 ALA HA . . 5.400 3.999 3.936 4.074 . 0 0 "[ . 1 . 2]" 1
1293 1 76 ASP HB3 1 77 ALA MB . . 5.480 4.345 4.047 4.507 . 0 0 "[ . 1 . 2]" 1
1294 1 76 ASP HB3 1 78 CYS H . . 5.270 5.241 5.059 5.277 0.007 13 0 "[ . 1 . 2]" 1
1295 1 77 ALA H 1 77 ALA MB . . 2.820 2.152 2.031 2.275 . 0 0 "[ . 1 . 2]" 1
1296 1 77 ALA H 1 78 CYS H . . 3.120 2.547 2.255 2.668 . 0 0 "[ . 1 . 2]" 1
1297 1 77 ALA HA 1 80 SER H . . 4.390 4.168 3.606 4.350 . 0 0 "[ . 1 . 2]" 1
1298 1 77 ALA MB 1 78 CYS H . . 3.340 2.770 2.620 2.951 . 0 0 "[ . 1 . 2]" 1
1299 1 77 ALA MB 1 78 CYS HA . . 4.500 3.867 3.789 3.947 . 0 0 "[ . 1 . 2]" 1
1300 1 77 ALA MB 1 78 CYS HB2 . . 5.500 3.940 3.709 5.165 . 0 0 "[ . 1 . 2]" 1
1301 1 77 ALA MB 1 78 CYS HB3 . . 5.500 4.670 4.046 4.809 . 0 0 "[ . 1 . 2]" 1
1302 1 77 ALA MB 1 79 GLU H . . 5.290 4.699 4.573 4.947 . 0 0 "[ . 1 . 2]" 1
1303 1 78 CYS H 1 78 CYS HB2 . . 3.800 2.653 2.476 3.593 . 0 0 "[ . 1 . 2]" 1
1304 1 78 CYS H 1 78 CYS HB3 . . 3.300 2.625 2.244 2.718 . 0 0 "[ . 1 . 2]" 1
1305 1 78 CYS H 1 79 GLU H . . 3.470 2.398 2.299 2.465 . 0 0 "[ . 1 . 2]" 1
1306 1 78 CYS H 1 79 GLU HA . . 5.040 5.013 4.949 5.049 0.009 2 0 "[ . 1 . 2]" 1
1307 1 78 CYS H 1 79 GLU HB2 . . 5.280 4.699 4.120 5.939 0.659 2 5 "[*+ . 1 - . * *]" 1
1308 1 78 CYS HB2 1 79 GLU H . . 4.350 3.723 3.560 4.176 . 0 0 "[ . 1 . 2]" 1
1309 1 78 CYS HB3 1 79 GLU H . . 3.930 2.591 2.259 3.771 . 0 0 "[ . 1 . 2]" 1
1310 1 79 GLU H 1 79 GLU HB2 . . 3.230 2.681 2.202 3.592 0.362 1 0 "[ . 1 . 2]" 1
1311 1 79 GLU H 1 79 GLU HB3 . . 3.660 3.316 2.473 3.614 . 0 0 "[ . 1 . 2]" 1
1312 1 79 GLU H 1 79 GLU HG2 . . 3.870 2.771 2.110 3.357 . 0 0 "[ . 1 . 2]" 1
1313 1 79 GLU H 1 79 GLU HG3 . . 3.990 3.054 2.209 3.717 . 0 0 "[ . 1 . 2]" 1
1314 1 79 GLU HA 1 79 GLU HG2 . . 4.050 2.821 2.146 4.099 0.049 18 0 "[ . 1 . 2]" 1
1315 1 79 GLU HA 1 79 GLU HG3 . . 3.620 3.526 3.124 3.763 0.143 19 0 "[ . 1 . 2]" 1
1316 1 79 GLU HA 1 80 SER H . . 3.560 3.513 3.384 3.560 . 0 0 "[ . 1 . 2]" 1
1317 1 79 GLU HB2 1 80 SER H . . 4.180 3.014 2.493 4.172 . 0 0 "[ . 1 . 2]" 1
1318 1 79 GLU HB3 1 80 SER H . . 4.260 3.544 3.071 4.197 . 0 0 "[ . 1 . 2]" 1
1319 1 79 GLU HG2 1 80 SER H . . 5.280 4.474 3.454 4.913 . 0 0 "[ . 1 . 2]" 1
1320 1 79 GLU HG3 1 80 SER H . . 4.930 4.170 2.233 5.273 0.343 3 0 "[ . 1 . 2]" 1
1321 1 80 SER H 1 80 SER HB2 . . 3.580 2.692 2.081 3.970 0.390 10 0 "[ . 1 . 2]" 1
1322 1 80 SER H 1 80 SER HB3 . . 4.020 3.288 2.711 3.974 . 0 0 "[ . 1 . 2]" 1
1323 1 80 SER HB2 1 81 GLY H . . 4.810 4.202 3.147 4.679 . 0 0 "[ . 1 . 2]" 1
1324 1 80 SER HB3 1 81 GLY H . . 5.010 3.667 2.362 4.578 . 0 0 "[ . 1 . 2]" 1
1325 1 81 GLY H 1 82 PRO HD2 . . 5.210 4.023 2.773 4.832 . 0 0 "[ . 1 . 2]" 1
1326 1 81 GLY H 1 82 PRO HD3 . . 5.500 4.097 2.057 5.129 . 0 0 "[ . 1 . 2]" 1
1327 1 81 GLY HA3 1 82 PRO HD2 . . 3.560 2.862 1.922 3.747 0.187 11 0 "[ . 1 . 2]" 1
1328 1 81 GLY HA3 1 82 PRO HD3 . . 4.010 3.403 2.263 4.093 0.083 16 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Thursday, July 4, 2024 4:27:06 PM GMT (wattos1)