NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
416616 |
2dk7   |
11357 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2dk7
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 1426
_Distance_constraint_stats_list.Viol_count 557
_Distance_constraint_stats_list.Viol_total 119.452
_Distance_constraint_stats_list.Viol_max 0.141
_Distance_constraint_stats_list.Viol_rms 0.0031
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0107
_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 8 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 LYS 0.225 0.103 20 0 "[ . 1 . 2]"
1 11 PRO 0.275 0.103 20 0 "[ . 1 . 2]"
1 12 VAL 0.019 0.004 16 0 "[ . 1 . 2]"
1 13 ALA 0.015 0.003 5 0 "[ . 1 . 2]"
1 14 THR 0.090 0.040 18 0 "[ . 1 . 2]"
1 15 ALA 0.173 0.024 18 0 "[ . 1 . 2]"
1 16 PRO 1.309 0.081 14 0 "[ . 1 . 2]"
1 17 ILE 1.258 0.081 14 0 "[ . 1 . 2]"
1 18 PRO 0.010 0.006 11 0 "[ . 1 . 2]"
1 19 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 THR 0.601 0.060 17 0 "[ . 1 . 2]"
1 21 PRO 0.168 0.021 16 0 "[ . 1 . 2]"
1 22 TRP 0.658 0.060 17 0 "[ . 1 . 2]"
1 23 CYS 0.343 0.065 18 0 "[ . 1 . 2]"
1 24 VAL 0.230 0.063 18 0 "[ . 1 . 2]"
1 25 VAL 0.209 0.065 18 0 "[ . 1 . 2]"
1 26 TRP 0.087 0.007 7 0 "[ . 1 . 2]"
1 27 THR 0.131 0.018 17 0 "[ . 1 . 2]"
1 28 GLY 0.076 0.018 17 0 "[ . 1 . 2]"
1 29 ASP 0.009 0.005 17 0 "[ . 1 . 2]"
1 30 GLU 0.168 0.141 17 0 "[ . 1 . 2]"
1 31 ARG 0.027 0.010 17 0 "[ . 1 . 2]"
1 32 VAL 0.045 0.010 19 0 "[ . 1 . 2]"
1 33 PHE 0.030 0.006 16 0 "[ . 1 . 2]"
1 34 PHE 0.067 0.007 16 0 "[ . 1 . 2]"
1 35 TYR 0.142 0.021 16 0 "[ . 1 . 2]"
1 36 ASN 0.033 0.005 7 0 "[ . 1 . 2]"
1 37 PRO 0.088 0.034 16 0 "[ . 1 . 2]"
1 38 THR 0.013 0.005 16 0 "[ . 1 . 2]"
1 39 THR 0.026 0.008 7 0 "[ . 1 . 2]"
1 40 ARG 0.038 0.014 16 0 "[ . 1 . 2]"
1 41 LEU 0.022 0.008 7 0 "[ . 1 . 2]"
1 42 SER 0.046 0.012 7 0 "[ . 1 . 2]"
1 43 MET 0.066 0.011 7 0 "[ . 1 . 2]"
1 44 TRP 0.018 0.003 5 0 "[ . 1 . 2]"
1 45 ASP 0.031 0.009 4 0 "[ . 1 . 2]"
1 46 ARG 0.150 0.033 16 0 "[ . 1 . 2]"
1 47 PRO 0.244 0.029 5 0 "[ . 1 . 2]"
1 48 ASP 0.261 0.046 5 0 "[ . 1 . 2]"
1 49 ASP 0.029 0.012 16 0 "[ . 1 . 2]"
1 50 LEU 0.284 0.033 16 0 "[ . 1 . 2]"
1 51 ILE 0.163 0.046 5 0 "[ . 1 . 2]"
1 52 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ARG 0.476 0.097 16 0 "[ . 1 . 2]"
1 54 ALA 0.023 0.009 12 0 "[ . 1 . 2]"
1 55 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 VAL 0.178 0.019 12 0 "[ . 1 . 2]"
1 57 ASP 0.014 0.009 12 0 "[ . 1 . 2]"
1 58 LYS 0.377 0.123 19 0 "[ . 1 . 2]"
1 59 ILE 0.028 0.006 14 0 "[ . 1 . 2]"
1 60 ILE 0.052 0.010 19 0 "[ . 1 . 2]"
1 61 GLN 0.018 0.007 19 0 "[ . 1 . 2]"
1 62 GLU 0.316 0.092 9 0 "[ . 1 . 2]"
1 63 PRO 0.687 0.097 20 0 "[ . 1 . 2]"
1 64 PRO 0.235 0.097 20 0 "[ . 1 . 2]"
1 65 HIS 0.038 0.009 2 0 "[ . 1 . 2]"
1 66 LYS 0.426 0.081 13 0 "[ . 1 . 2]"
1 67 LYS 0.011 0.005 20 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 8 LYS HA 1 8 LYS HD2 . . 5.500 4.203 2.261 5.450 . 0 0 "[ . 1 . 2]" 1
2 1 8 LYS HA 1 8 LYS QD . . 4.810 3.690 2.226 4.314 . 0 0 "[ . 1 . 2]" 1
3 1 8 LYS HA 1 8 LYS HD3 . . 5.500 4.312 3.177 5.115 . 0 0 "[ . 1 . 2]" 1
4 1 8 LYS HA 1 8 LYS QG . . 3.690 2.744 2.182 3.453 . 0 0 "[ . 1 . 2]" 1
5 1 9 ALA HA 1 10 LYS H . . 3.270 2.282 2.141 2.797 . 0 0 "[ . 1 . 2]" 1
6 1 9 ALA MB 1 10 LYS H . . 3.880 3.170 2.431 3.693 . 0 0 "[ . 1 . 2]" 1
7 1 10 LYS H 1 10 LYS HB2 . . 4.070 2.749 2.180 3.991 . 0 0 "[ . 1 . 2]" 1
8 1 10 LYS H 1 10 LYS QB . . 3.390 2.441 2.131 3.164 . 0 0 "[ . 1 . 2]" 1
9 1 10 LYS H 1 10 LYS HB3 . . 4.070 3.293 2.191 3.836 . 0 0 "[ . 1 . 2]" 1
10 1 10 LYS HA 1 10 LYS HD2 . . 5.040 3.622 2.434 4.755 . 0 0 "[ . 1 . 2]" 1
11 1 10 LYS HA 1 10 LYS QD . . 4.370 2.926 2.012 4.122 . 0 0 "[ . 1 . 2]" 1
12 1 10 LYS HA 1 10 LYS HD3 . . 5.040 3.259 2.026 4.519 . 0 0 "[ . 1 . 2]" 1
13 1 10 LYS HA 1 10 LYS QG . . 3.630 2.690 2.149 3.443 . 0 0 "[ . 1 . 2]" 1
14 1 10 LYS HA 1 11 PRO HD2 . . 3.020 2.247 2.191 2.387 . 0 0 "[ . 1 . 2]" 1
15 1 10 LYS HA 1 11 PRO HD3 . . 2.910 2.261 2.254 2.296 . 0 0 "[ . 1 . 2]" 1
16 1 10 LYS HA 1 11 PRO HG2 . . 4.400 4.389 4.345 4.503 0.103 20 0 "[ . 1 . 2]" 1
17 1 10 LYS QB 1 11 PRO HD2 . . 3.200 2.547 1.980 3.267 0.067 7 0 "[ . 1 . 2]" 1
18 1 10 LYS QD 1 11 PRO HD2 . . 4.550 2.900 1.923 4.006 . 0 0 "[ . 1 . 2]" 1
19 1 10 LYS HD2 1 11 PRO HD2 . . 5.280 3.325 2.015 4.242 . 0 0 "[ . 1 . 2]" 1
20 1 10 LYS HD2 1 11 PRO HD3 . . 5.500 4.613 3.204 5.430 . 0 0 "[ . 1 . 2]" 1
21 1 10 LYS HD3 1 11 PRO HD2 . . 5.280 3.384 2.055 4.929 . 0 0 "[ . 1 . 2]" 1
22 1 10 LYS HD3 1 11 PRO HD3 . . 5.500 4.480 3.131 5.554 0.054 20 0 "[ . 1 . 2]" 1
23 1 10 LYS QG 1 11 PRO HD2 . . 4.220 3.229 1.986 4.217 . 0 0 "[ . 1 . 2]" 1
24 1 11 PRO HA 1 12 VAL H . . 2.940 2.300 2.201 2.381 . 0 0 "[ . 1 . 2]" 1
25 1 11 PRO HA 1 12 VAL MG1 . . 4.210 3.588 3.376 3.751 . 0 0 "[ . 1 . 2]" 1
26 1 11 PRO HA 1 12 VAL MG2 . . 4.020 3.806 3.700 4.017 . 0 0 "[ . 1 . 2]" 1
27 1 11 PRO HA 1 13 ALA H . . 4.240 4.048 3.782 4.241 0.001 7 0 "[ . 1 . 2]" 1
28 1 11 PRO HA 1 25 VAL MG1 . . 3.720 3.354 3.166 3.505 . 0 0 "[ . 1 . 2]" 1
29 1 11 PRO HA 1 27 THR HA . . 3.450 2.249 2.023 2.529 . 0 0 "[ . 1 . 2]" 1
30 1 11 PRO HA 1 27 THR MG . . 3.840 2.308 2.071 2.564 . 0 0 "[ . 1 . 2]" 1
31 1 11 PRO QB 1 13 ALA H . . 4.420 3.053 2.770 3.438 . 0 0 "[ . 1 . 2]" 1
32 1 11 PRO QB 1 14 THR MG . . 4.820 4.606 4.422 4.709 . 0 0 "[ . 1 . 2]" 1
33 1 11 PRO QB 1 25 VAL MG1 . . 2.900 1.773 1.716 1.836 . 0 0 "[ . 1 . 2]" 1
34 1 11 PRO QB 1 25 VAL MG2 . . 4.460 3.784 3.678 3.896 . 0 0 "[ . 1 . 2]" 1
35 1 11 PRO QB 1 27 THR HA . . 4.190 3.871 3.701 4.144 . 0 0 "[ . 1 . 2]" 1
36 1 11 PRO QB 1 27 THR MG . . 4.070 3.158 2.952 3.396 . 0 0 "[ . 1 . 2]" 1
37 1 11 PRO HB2 1 12 VAL H . . 4.240 2.899 2.665 3.233 . 0 0 "[ . 1 . 2]" 1
38 1 11 PRO HB2 1 14 THR MG . . 5.500 4.997 4.768 5.118 . 0 0 "[ . 1 . 2]" 1
39 1 11 PRO HB2 1 25 VAL MG1 . . 3.420 2.247 2.089 2.366 . 0 0 "[ . 1 . 2]" 1
40 1 11 PRO HB2 1 27 THR HA . . 4.820 4.521 4.307 4.820 . 0 0 "[ . 1 . 2]" 1
41 1 11 PRO HB2 1 27 THR MG . . 4.790 4.298 4.025 4.544 . 0 0 "[ . 1 . 2]" 1
42 1 11 PRO HB3 1 12 VAL H . . 4.240 3.610 3.481 3.805 . 0 0 "[ . 1 . 2]" 1
43 1 11 PRO HB3 1 14 THR MG . . 5.500 5.397 5.236 5.527 0.027 18 0 "[ . 1 . 2]" 1
44 1 11 PRO HB3 1 25 VAL MG1 . . 3.420 1.857 1.814 1.913 . 0 0 "[ . 1 . 2]" 1
45 1 11 PRO HB3 1 27 THR HA . . 4.820 4.210 4.025 4.565 . 0 0 "[ . 1 . 2]" 1
46 1 11 PRO HB3 1 27 THR MG . . 4.790 3.250 3.036 3.507 . 0 0 "[ . 1 . 2]" 1
47 1 11 PRO HG2 1 25 VAL MG1 . . 4.060 3.587 3.331 3.743 . 0 0 "[ . 1 . 2]" 1
48 1 11 PRO HG2 1 33 PHE QE . . 5.500 5.419 5.004 5.504 0.004 18 0 "[ . 1 . 2]" 1
49 1 11 PRO HG3 1 14 THR MG . . 5.500 5.161 4.843 5.436 . 0 0 "[ . 1 . 2]" 1
50 1 11 PRO HG3 1 25 VAL MG1 . . 3.820 2.776 2.423 3.005 . 0 0 "[ . 1 . 2]" 1
51 1 11 PRO HG3 1 27 THR MG . . 5.200 4.984 4.759 5.210 0.010 18 0 "[ . 1 . 2]" 1
52 1 11 PRO HG3 1 33 PHE QE . . 4.430 4.294 3.889 4.424 . 0 0 "[ . 1 . 2]" 1
53 1 12 VAL H 1 12 VAL HB . . 4.000 3.703 3.645 3.769 . 0 0 "[ . 1 . 2]" 1
54 1 12 VAL H 1 12 VAL MG1 . . 3.680 2.672 2.289 2.967 . 0 0 "[ . 1 . 2]" 1
55 1 12 VAL H 1 12 VAL MG2 . . 3.260 1.919 1.874 2.103 . 0 0 "[ . 1 . 2]" 1
56 1 12 VAL H 1 13 ALA H . . 3.470 2.097 1.830 2.320 . 0 0 "[ . 1 . 2]" 1
57 1 12 VAL H 1 13 ALA MB . . 4.730 4.252 3.979 4.402 . 0 0 "[ . 1 . 2]" 1
58 1 12 VAL H 1 25 VAL MG1 . . 4.420 3.671 3.425 4.111 . 0 0 "[ . 1 . 2]" 1
59 1 12 VAL H 1 27 THR HA . . 4.410 2.503 2.210 2.941 . 0 0 "[ . 1 . 2]" 1
60 1 12 VAL HA 1 12 VAL MG1 . . 3.010 2.321 2.215 2.468 . 0 0 "[ . 1 . 2]" 1
61 1 12 VAL HA 1 12 VAL MG2 . . 3.500 3.190 3.184 3.202 . 0 0 "[ . 1 . 2]" 1
62 1 12 VAL HB 1 13 ALA H . . 4.220 3.846 3.635 4.071 . 0 0 "[ . 1 . 2]" 1
63 1 12 VAL HB 1 13 ALA MB . . 4.330 3.840 3.776 3.998 . 0 0 "[ . 1 . 2]" 1
64 1 12 VAL HB 1 28 GLY HA2 . . 5.110 4.808 4.555 5.114 0.004 19 0 "[ . 1 . 2]" 1
65 1 12 VAL MG1 1 13 ALA H . . 4.140 3.981 3.860 4.122 . 0 0 "[ . 1 . 2]" 1
66 1 12 VAL MG1 1 27 THR HA . . 4.210 2.672 2.030 3.166 . 0 0 "[ . 1 . 2]" 1
67 1 12 VAL MG1 1 28 GLY HA2 . . 3.370 2.291 2.012 2.710 . 0 0 "[ . 1 . 2]" 1
68 1 12 VAL MG1 1 65 HIS HD2 . . 5.500 5.366 4.908 5.504 0.004 16 0 "[ . 1 . 2]" 1
69 1 12 VAL MG2 1 13 ALA H . . 3.690 2.037 1.873 2.332 . 0 0 "[ . 1 . 2]" 1
70 1 12 VAL MG2 1 13 ALA MB . . 3.610 2.555 2.340 2.763 . 0 0 "[ . 1 . 2]" 1
71 1 12 VAL MG2 1 26 TRP H . . 4.450 3.528 3.286 3.820 . 0 0 "[ . 1 . 2]" 1
72 1 12 VAL MG2 1 26 TRP HA . . 5.010 3.836 3.550 4.264 . 0 0 "[ . 1 . 2]" 1
73 1 12 VAL MG2 1 26 TRP HB2 . . 3.880 2.176 1.970 2.501 . 0 0 "[ . 1 . 2]" 1
74 1 12 VAL MG2 1 26 TRP HB3 . . 3.850 2.367 2.024 2.777 . 0 0 "[ . 1 . 2]" 1
75 1 12 VAL MG2 1 27 THR HA . . 4.000 2.921 2.458 3.129 . 0 0 "[ . 1 . 2]" 1
76 1 12 VAL MG2 1 27 THR MG . . 4.520 4.173 3.851 4.401 . 0 0 "[ . 1 . 2]" 1
77 1 12 VAL MG2 1 28 GLY HA2 . . 3.720 3.531 3.171 3.723 0.003 17 0 "[ . 1 . 2]" 1
78 1 12 VAL MG2 1 65 HIS HD2 . . 4.450 3.875 2.873 4.300 . 0 0 "[ . 1 . 2]" 1
79 1 13 ALA H 1 13 ALA MB . . 3.410 2.672 2.604 2.768 . 0 0 "[ . 1 . 2]" 1
80 1 13 ALA H 1 25 VAL MG1 . . 4.350 3.465 3.137 3.797 . 0 0 "[ . 1 . 2]" 1
81 1 13 ALA H 1 26 TRP H . . 4.170 2.899 2.777 3.084 . 0 0 "[ . 1 . 2]" 1
82 1 13 ALA H 1 26 TRP HA . . 5.250 4.770 4.573 4.996 . 0 0 "[ . 1 . 2]" 1
83 1 13 ALA H 1 26 TRP HB2 . . 4.350 2.753 2.445 3.147 . 0 0 "[ . 1 . 2]" 1
84 1 13 ALA H 1 26 TRP HB3 . . 4.730 4.051 3.755 4.404 . 0 0 "[ . 1 . 2]" 1
85 1 13 ALA H 1 27 THR HA . . 4.980 4.389 4.190 4.614 . 0 0 "[ . 1 . 2]" 1
86 1 13 ALA HA 1 14 THR H . . 3.060 2.298 2.167 2.491 . 0 0 "[ . 1 . 2]" 1
87 1 13 ALA MB 1 14 THR H . . 3.230 2.641 2.279 3.022 . 0 0 "[ . 1 . 2]" 1
88 1 13 ALA MB 1 14 THR HA . . 4.420 3.911 3.753 4.037 . 0 0 "[ . 1 . 2]" 1
89 1 13 ALA MB 1 26 TRP H . . 4.290 3.396 2.968 3.665 . 0 0 "[ . 1 . 2]" 1
90 1 13 ALA MB 1 26 TRP HA . . 5.390 5.012 4.745 5.203 . 0 0 "[ . 1 . 2]" 1
91 1 13 ALA MB 1 26 TRP HB2 . . 3.270 2.401 2.112 2.631 . 0 0 "[ . 1 . 2]" 1
92 1 13 ALA MB 1 26 TRP HB3 . . 3.960 3.801 3.538 3.963 0.003 13 0 "[ . 1 . 2]" 1
93 1 13 ALA MB 1 26 TRP HE3 . . 3.380 2.392 1.963 2.614 . 0 0 "[ . 1 . 2]" 1
94 1 13 ALA MB 1 26 TRP HZ3 . . 4.020 3.430 3.236 3.590 . 0 0 "[ . 1 . 2]" 1
95 1 13 ALA MB 1 64 PRO HB2 . . 4.620 4.297 4.056 4.530 . 0 0 "[ . 1 . 2]" 1
96 1 13 ALA MB 1 64 PRO HG2 . . 3.420 2.766 2.573 2.905 . 0 0 "[ . 1 . 2]" 1
97 1 13 ALA MB 1 64 PRO HG3 . . 3.870 3.797 3.330 3.872 0.002 7 0 "[ . 1 . 2]" 1
98 1 13 ALA MB 1 65 HIS HA . . 4.390 3.796 3.439 4.390 . 0 0 "[ . 1 . 2]" 1
99 1 13 ALA MB 1 65 HIS HB2 . . 4.060 3.084 2.696 4.060 . 0 0 "[ . 1 . 2]" 1
100 1 13 ALA MB 1 65 HIS QB . . 3.570 2.054 1.883 2.635 . 0 0 "[ . 1 . 2]" 1
101 1 13 ALA MB 1 65 HIS HB3 . . 4.060 2.087 1.908 2.669 . 0 0 "[ . 1 . 2]" 1
102 1 13 ALA MB 1 65 HIS HD2 . . 4.970 4.497 1.954 4.973 0.003 5 0 "[ . 1 . 2]" 1
103 1 14 THR H 1 14 THR HB . . 3.710 2.911 2.733 3.048 . 0 0 "[ . 1 . 2]" 1
104 1 14 THR H 1 14 THR MG . . 4.190 3.964 3.897 4.010 . 0 0 "[ . 1 . 2]" 1
105 1 14 THR H 1 15 ALA H . . 5.010 4.250 4.049 4.343 . 0 0 "[ . 1 . 2]" 1
106 1 14 THR H 1 15 ALA MB . . 4.930 4.405 4.215 4.571 . 0 0 "[ . 1 . 2]" 1
107 1 14 THR HA 1 14 THR MG . . 3.360 2.258 2.182 2.438 . 0 0 "[ . 1 . 2]" 1
108 1 14 THR HA 1 15 ALA H . . 3.090 2.168 2.142 2.196 . 0 0 "[ . 1 . 2]" 1
109 1 14 THR HA 1 15 ALA MB . . 4.230 3.944 3.892 4.014 . 0 0 "[ . 1 . 2]" 1
110 1 14 THR HA 1 25 VAL HA . . 3.290 2.241 2.153 2.342 . 0 0 "[ . 1 . 2]" 1
111 1 14 THR HA 1 25 VAL MG1 . . 4.270 3.333 3.044 3.547 . 0 0 "[ . 1 . 2]" 1
112 1 14 THR HA 1 25 VAL MG2 . . 4.080 2.834 2.292 3.269 . 0 0 "[ . 1 . 2]" 1
113 1 14 THR HA 1 26 TRP H . . 4.220 3.487 3.196 3.656 . 0 0 "[ . 1 . 2]" 1
114 1 14 THR HA 1 26 TRP HE3 . . 3.860 3.224 2.847 3.517 . 0 0 "[ . 1 . 2]" 1
115 1 14 THR HA 1 26 TRP HZ3 . . 4.160 3.417 3.128 3.806 . 0 0 "[ . 1 . 2]" 1
116 1 14 THR HB 1 15 ALA H . . 4.210 4.051 3.911 4.213 0.003 16 0 "[ . 1 . 2]" 1
117 1 14 THR HB 1 25 VAL HA . . 5.080 4.895 4.547 5.098 0.018 18 0 "[ . 1 . 2]" 1
118 1 14 THR HB 1 25 VAL MG1 . . 4.650 4.386 4.068 4.570 . 0 0 "[ . 1 . 2]" 1
119 1 14 THR HB 1 25 VAL MG2 . . 4.240 3.928 3.718 4.156 . 0 0 "[ . 1 . 2]" 1
120 1 14 THR MG 1 15 ALA H . . 3.780 2.346 2.101 2.607 . 0 0 "[ . 1 . 2]" 1
121 1 14 THR MG 1 15 ALA HA . . 4.430 3.694 3.294 3.872 . 0 0 "[ . 1 . 2]" 1
122 1 14 THR MG 1 16 PRO HA . . 5.040 4.462 4.349 4.532 . 0 0 "[ . 1 . 2]" 1
123 1 14 THR MG 1 16 PRO HD3 . . 4.260 3.888 3.354 4.108 . 0 0 "[ . 1 . 2]" 1
124 1 14 THR MG 1 23 CYS HB2 . . 3.850 3.112 2.326 3.643 . 0 0 "[ . 1 . 2]" 1
125 1 14 THR MG 1 23 CYS QB . . 3.350 2.501 2.277 3.343 . 0 0 "[ . 1 . 2]" 1
126 1 14 THR MG 1 23 CYS HB3 . . 3.850 2.697 2.359 3.890 0.040 18 0 "[ . 1 . 2]" 1
127 1 14 THR MG 1 24 VAL H . . 4.760 4.405 4.225 4.611 . 0 0 "[ . 1 . 2]" 1
128 1 14 THR MG 1 25 VAL HA . . 3.800 3.238 2.655 3.660 . 0 0 "[ . 1 . 2]" 1
129 1 14 THR MG 1 25 VAL MG1 . . 3.470 3.093 2.752 3.327 . 0 0 "[ . 1 . 2]" 1
130 1 14 THR MG 1 25 VAL MG2 . . 3.180 1.781 1.673 1.923 . 0 0 "[ . 1 . 2]" 1
131 1 15 ALA H 1 15 ALA MB . . 3.320 2.572 2.415 2.656 . 0 0 "[ . 1 . 2]" 1
132 1 15 ALA H 1 16 PRO HD2 . . 5.220 4.737 4.624 4.794 . 0 0 "[ . 1 . 2]" 1
133 1 15 ALA H 1 16 PRO HD3 . . 5.490 4.484 4.227 4.644 . 0 0 "[ . 1 . 2]" 1
134 1 15 ALA H 1 23 CYS QB . . 4.150 3.574 3.408 4.174 0.024 18 0 "[ . 1 . 2]" 1
135 1 15 ALA H 1 24 VAL H . . 3.840 3.628 3.224 3.803 . 0 0 "[ . 1 . 2]" 1
136 1 15 ALA H 1 24 VAL HB . . 4.280 3.481 3.241 3.782 . 0 0 "[ . 1 . 2]" 1
137 1 15 ALA H 1 24 VAL MG1 . . 4.570 4.260 4.005 4.580 0.010 18 0 "[ . 1 . 2]" 1
138 1 15 ALA H 1 24 VAL MG2 . . 4.820 4.644 4.474 4.777 . 0 0 "[ . 1 . 2]" 1
139 1 15 ALA H 1 25 VAL HA . . 4.520 3.524 3.312 3.641 . 0 0 "[ . 1 . 2]" 1
140 1 15 ALA H 1 25 VAL MG1 . . 5.080 4.910 4.703 5.065 . 0 0 "[ . 1 . 2]" 1
141 1 15 ALA H 1 25 VAL MG2 . . 4.230 3.492 3.243 3.795 . 0 0 "[ . 1 . 2]" 1
142 1 15 ALA H 1 26 TRP H . . 5.500 5.068 4.879 5.255 . 0 0 "[ . 1 . 2]" 1
143 1 15 ALA H 1 26 TRP HH2 . . 4.970 4.735 4.254 4.972 0.002 18 0 "[ . 1 . 2]" 1
144 1 15 ALA H 1 26 TRP HZ3 . . 4.210 2.985 2.563 3.271 . 0 0 "[ . 1 . 2]" 1
145 1 15 ALA H 1 59 ILE MG . . 4.900 4.757 4.485 4.899 . 0 0 "[ . 1 . 2]" 1
146 1 15 ALA HA 1 16 PRO HD2 . . 2.790 2.045 1.984 2.143 . 0 0 "[ . 1 . 2]" 1
147 1 15 ALA HA 1 16 PRO HD3 . . 3.140 2.283 2.255 2.321 . 0 0 "[ . 1 . 2]" 1
148 1 15 ALA HA 1 16 PRO HG2 . . 4.530 4.230 4.181 4.307 . 0 0 "[ . 1 . 2]" 1
149 1 15 ALA HA 1 16 PRO HG3 . . 4.900 4.323 4.317 4.346 . 0 0 "[ . 1 . 2]" 1
150 1 15 ALA HA 1 59 ILE MG . . 5.500 5.310 5.036 5.448 . 0 0 "[ . 1 . 2]" 1
151 1 15 ALA HA 1 64 PRO HG3 . . 5.100 5.058 4.846 5.102 0.002 8 0 "[ . 1 . 2]" 1
152 1 15 ALA MB 1 16 PRO HA . . 5.190 4.533 4.501 4.552 . 0 0 "[ . 1 . 2]" 1
153 1 15 ALA MB 1 16 PRO HD2 . . 3.080 2.806 2.581 3.014 . 0 0 "[ . 1 . 2]" 1
154 1 15 ALA MB 1 16 PRO HG2 . . 4.500 4.307 4.092 4.499 . 0 0 "[ . 1 . 2]" 1
155 1 15 ALA MB 1 24 VAL H . . 4.020 3.840 3.608 3.975 . 0 0 "[ . 1 . 2]" 1
156 1 15 ALA MB 1 24 VAL MG1 . . 3.860 3.817 3.562 3.877 0.017 18 0 "[ . 1 . 2]" 1
157 1 15 ALA MB 1 24 VAL MG2 . . 3.960 3.800 3.551 3.963 0.003 10 0 "[ . 1 . 2]" 1
158 1 15 ALA MB 1 26 TRP HE3 . . 4.350 4.327 4.113 4.357 0.007 7 0 "[ . 1 . 2]" 1
159 1 15 ALA MB 1 26 TRP HH2 . . 3.200 2.752 2.482 2.853 . 0 0 "[ . 1 . 2]" 1
160 1 15 ALA MB 1 26 TRP HZ2 . . 4.930 4.880 4.645 4.934 0.004 16 0 "[ . 1 . 2]" 1
161 1 15 ALA MB 1 26 TRP HZ3 . . 3.130 2.258 1.989 2.351 . 0 0 "[ . 1 . 2]" 1
162 1 15 ALA MB 1 59 ILE MG . . 2.900 2.783 2.528 2.901 0.001 2 0 "[ . 1 . 2]" 1
163 1 15 ALA MB 1 64 PRO HB3 . . 4.740 4.238 3.728 4.446 . 0 0 "[ . 1 . 2]" 1
164 1 15 ALA MB 1 64 PRO HD2 . . 4.260 4.152 3.985 4.263 0.003 13 0 "[ . 1 . 2]" 1
165 1 15 ALA MB 1 64 PRO HD3 . . 4.290 3.662 3.419 3.777 . 0 0 "[ . 1 . 2]" 1
166 1 15 ALA MB 1 64 PRO HG2 . . 4.350 3.922 3.795 4.061 . 0 0 "[ . 1 . 2]" 1
167 1 15 ALA MB 1 64 PRO HG3 . . 3.550 2.691 2.587 2.769 . 0 0 "[ . 1 . 2]" 1
168 1 16 PRO HA 1 17 ILE H . . 3.000 2.154 2.151 2.165 . 0 0 "[ . 1 . 2]" 1
169 1 16 PRO HA 1 17 ILE HG12 . . 5.500 4.797 4.677 4.878 . 0 0 "[ . 1 . 2]" 1
170 1 16 PRO HA 1 17 ILE HG13 . . 5.450 4.061 4.000 4.134 . 0 0 "[ . 1 . 2]" 1
171 1 16 PRO HA 1 23 CYS HA . . 3.250 2.254 2.166 2.294 . 0 0 "[ . 1 . 2]" 1
172 1 16 PRO HA 1 23 CYS HB2 . . 4.300 3.812 2.137 4.071 . 0 0 "[ . 1 . 2]" 1
173 1 16 PRO HA 1 23 CYS QB . . 3.720 2.573 2.126 2.764 . 0 0 "[ . 1 . 2]" 1
174 1 16 PRO HA 1 23 CYS HB3 . . 4.300 2.696 2.204 3.800 . 0 0 "[ . 1 . 2]" 1
175 1 16 PRO HA 1 24 VAL H . . 4.140 3.754 3.591 3.841 . 0 0 "[ . 1 . 2]" 1
176 1 16 PRO QB 1 17 ILE H . . 3.500 3.327 3.225 3.396 . 0 0 "[ . 1 . 2]" 1
177 1 16 PRO QB 1 23 CYS HA . . 4.120 4.113 4.032 4.137 0.017 18 0 "[ . 1 . 2]" 1
178 1 16 PRO HB2 1 17 ILE H . . 4.160 3.552 3.427 3.636 . 0 0 "[ . 1 . 2]" 1
179 1 16 PRO HB2 1 23 CYS HA . . 4.870 4.819 4.750 4.852 . 0 0 "[ . 1 . 2]" 1
180 1 16 PRO HB3 1 17 ILE H . . 4.160 4.014 3.930 4.072 . 0 0 "[ . 1 . 2]" 1
181 1 16 PRO HB3 1 23 CYS HA . . 4.870 4.462 4.351 4.490 . 0 0 "[ . 1 . 2]" 1
182 1 16 PRO HD3 1 17 ILE H . . 5.500 5.561 5.544 5.581 0.081 14 0 "[ . 1 . 2]" 1
183 1 17 ILE H 1 17 ILE HB . . 3.350 2.472 2.418 2.514 . 0 0 "[ . 1 . 2]" 1
184 1 17 ILE H 1 17 ILE MD . . 4.090 3.933 3.886 4.007 . 0 0 "[ . 1 . 2]" 1
185 1 17 ILE H 1 17 ILE HG12 . . 3.870 3.226 3.115 3.397 . 0 0 "[ . 1 . 2]" 1
186 1 17 ILE H 1 17 ILE HG13 . . 3.750 2.442 2.373 2.587 . 0 0 "[ . 1 . 2]" 1
187 1 17 ILE H 1 17 ILE MG . . 4.010 3.760 3.746 3.769 . 0 0 "[ . 1 . 2]" 1
188 1 17 ILE H 1 18 PRO HD3 . . 4.930 4.889 4.851 4.915 . 0 0 "[ . 1 . 2]" 1
189 1 17 ILE H 1 23 CYS HA . . 3.400 2.185 2.111 2.269 . 0 0 "[ . 1 . 2]" 1
190 1 17 ILE H 1 23 CYS HB2 . . 4.950 4.820 3.588 4.957 0.007 19 0 "[ . 1 . 2]" 1
191 1 17 ILE H 1 23 CYS HB3 . . 4.950 4.123 3.576 4.748 . 0 0 "[ . 1 . 2]" 1
192 1 17 ILE H 1 24 VAL H . . 4.460 3.518 3.406 3.816 . 0 0 "[ . 1 . 2]" 1
193 1 17 ILE HA 1 17 ILE MD . . 3.810 3.618 3.588 3.662 . 0 0 "[ . 1 . 2]" 1
194 1 17 ILE HA 1 17 ILE HG12 . . 3.890 2.336 2.296 2.368 . 0 0 "[ . 1 . 2]" 1
195 1 17 ILE HA 1 17 ILE HG13 . . 3.950 3.270 3.216 3.323 . 0 0 "[ . 1 . 2]" 1
196 1 17 ILE HA 1 17 ILE MG . . 3.150 2.468 2.439 2.492 . 0 0 "[ . 1 . 2]" 1
197 1 17 ILE HA 1 18 PRO HD2 . . 3.450 2.147 2.109 2.175 . 0 0 "[ . 1 . 2]" 1
198 1 17 ILE HA 1 18 PRO HD3 . . 3.250 2.254 2.252 2.259 . 0 0 "[ . 1 . 2]" 1
199 1 17 ILE HA 1 18 PRO QG . . 4.360 3.856 3.836 3.871 . 0 0 "[ . 1 . 2]" 1
200 1 17 ILE HA 1 59 ILE MD . . 3.850 2.267 2.149 2.405 . 0 0 "[ . 1 . 2]" 1
201 1 17 ILE HA 1 59 ILE HG13 . . 5.190 4.903 4.658 5.115 . 0 0 "[ . 1 . 2]" 1
202 1 17 ILE HB 1 17 ILE MD . . 3.190 2.632 2.590 2.659 . 0 0 "[ . 1 . 2]" 1
203 1 17 ILE HB 1 20 THR H . . 4.400 3.926 3.779 4.065 . 0 0 "[ . 1 . 2]" 1
204 1 17 ILE HB 1 20 THR HB . . 4.990 4.751 4.638 4.870 . 0 0 "[ . 1 . 2]" 1
205 1 17 ILE HB 1 20 THR HG1 . . 3.210 2.099 1.994 2.473 . 0 0 "[ . 1 . 2]" 1
206 1 17 ILE HB 1 20 THR MG . . 4.240 3.939 3.786 4.062 . 0 0 "[ . 1 . 2]" 1
207 1 17 ILE HB 1 22 TRP H . . 4.270 3.506 3.342 3.595 . 0 0 "[ . 1 . 2]" 1
208 1 17 ILE HB 1 22 TRP HB2 . . 4.290 2.928 2.806 3.098 . 0 0 "[ . 1 . 2]" 1
209 1 17 ILE HB 1 22 TRP HB3 . . 4.540 3.975 3.820 4.150 . 0 0 "[ . 1 . 2]" 1
210 1 17 ILE HB 1 23 CYS HA . . 4.730 3.900 3.756 4.021 . 0 0 "[ . 1 . 2]" 1
211 1 17 ILE HB 1 50 LEU MD1 . . 4.790 4.313 4.065 4.546 . 0 0 "[ . 1 . 2]" 1
212 1 17 ILE HB 1 50 LEU MD2 . . 4.310 3.429 3.143 3.670 . 0 0 "[ . 1 . 2]" 1
213 1 17 ILE MD 1 18 PRO HD2 . . 3.860 3.822 3.777 3.859 . 0 0 "[ . 1 . 2]" 1
214 1 17 ILE MD 1 20 THR HG1 . . 3.750 3.313 2.777 3.520 . 0 0 "[ . 1 . 2]" 1
215 1 17 ILE MD 1 22 TRP H . . 4.710 4.414 4.242 4.573 . 0 0 "[ . 1 . 2]" 1
216 1 17 ILE MD 1 22 TRP HB2 . . 3.320 2.525 2.305 2.736 . 0 0 "[ . 1 . 2]" 1
217 1 17 ILE MD 1 22 TRP HB3 . . 3.860 2.816 2.612 3.018 . 0 0 "[ . 1 . 2]" 1
218 1 17 ILE MD 1 22 TRP HE3 . . 5.340 4.871 4.681 5.111 . 0 0 "[ . 1 . 2]" 1
219 1 17 ILE MD 1 23 CYS H . . 4.800 4.375 4.189 4.566 . 0 0 "[ . 1 . 2]" 1
220 1 17 ILE MD 1 23 CYS HA . . 4.440 4.043 3.979 4.160 . 0 0 "[ . 1 . 2]" 1
221 1 17 ILE MD 1 24 VAL H . . 4.130 3.511 3.393 4.052 . 0 0 "[ . 1 . 2]" 1
222 1 17 ILE MD 1 24 VAL HB . . 4.780 4.357 4.204 4.580 . 0 0 "[ . 1 . 2]" 1
223 1 17 ILE MD 1 24 VAL MG2 . . 2.870 1.909 1.843 2.087 . 0 0 "[ . 1 . 2]" 1
224 1 17 ILE MD 1 34 PHE QD . . 3.650 2.680 2.228 2.854 . 0 0 "[ . 1 . 2]" 1
225 1 17 ILE MD 1 50 LEU MD1 . . 3.290 1.999 1.889 2.231 . 0 0 "[ . 1 . 2]" 1
226 1 17 ILE HG12 1 18 PRO HD2 . . 4.230 3.538 3.432 3.639 . 0 0 "[ . 1 . 2]" 1
227 1 17 ILE HG12 1 18 PRO HD3 . . 4.530 4.286 4.226 4.355 . 0 0 "[ . 1 . 2]" 1
228 1 17 ILE HG12 1 22 TRP HB2 . . 5.210 4.857 4.678 5.040 . 0 0 "[ . 1 . 2]" 1
229 1 17 ILE HG12 1 22 TRP HB3 . . 5.500 5.030 4.838 5.233 . 0 0 "[ . 1 . 2]" 1
230 1 17 ILE HG12 1 23 CYS HA . . 4.180 3.741 3.550 3.911 . 0 0 "[ . 1 . 2]" 1
231 1 17 ILE HG12 1 24 VAL H . . 4.540 3.036 2.859 3.575 . 0 0 "[ . 1 . 2]" 1
232 1 17 ILE HG12 1 24 VAL MG2 . . 3.800 1.994 1.891 2.198 . 0 0 "[ . 1 . 2]" 1
233 1 17 ILE HG12 1 50 LEU MD1 . . 5.020 4.619 4.439 4.916 . 0 0 "[ . 1 . 2]" 1
234 1 17 ILE HG12 1 59 ILE HG13 . . 5.070 4.813 4.610 5.072 0.002 6 0 "[ . 1 . 2]" 1
235 1 17 ILE HG13 1 17 ILE MG . . 3.430 3.167 3.159 3.179 . 0 0 "[ . 1 . 2]" 1
236 1 17 ILE HG13 1 23 CYS HA . . 3.970 2.492 2.421 2.639 . 0 0 "[ . 1 . 2]" 1
237 1 17 ILE HG13 1 24 VAL H . . 4.530 2.555 2.363 3.176 . 0 0 "[ . 1 . 2]" 1
238 1 17 ILE HG13 1 24 VAL MG2 . . 3.340 2.535 2.138 2.820 . 0 0 "[ . 1 . 2]" 1
239 1 17 ILE HG13 1 50 LEU MD1 . . 4.480 4.029 3.749 4.281 . 0 0 "[ . 1 . 2]" 1
240 1 17 ILE MG 1 18 PRO HA . . 4.480 3.945 3.919 3.986 . 0 0 "[ . 1 . 2]" 1
241 1 17 ILE MG 1 18 PRO HD2 . . 3.440 1.873 1.817 1.932 . 0 0 "[ . 1 . 2]" 1
242 1 17 ILE MG 1 18 PRO HD3 . . 3.730 3.231 3.155 3.331 . 0 0 "[ . 1 . 2]" 1
243 1 17 ILE MG 1 18 PRO QG . . 4.470 2.946 2.859 3.059 . 0 0 "[ . 1 . 2]" 1
244 1 17 ILE MG 1 20 THR H . . 4.310 2.775 2.530 2.907 . 0 0 "[ . 1 . 2]" 1
245 1 17 ILE MG 1 20 THR HA . . 4.900 4.813 4.560 4.910 0.010 18 0 "[ . 1 . 2]" 1
246 1 17 ILE MG 1 20 THR HG1 . . 3.490 2.214 1.932 2.436 . 0 0 "[ . 1 . 2]" 1
247 1 17 ILE MG 1 22 TRP H . . 4.840 4.358 4.089 4.482 . 0 0 "[ . 1 . 2]" 1
248 1 17 ILE MG 1 22 TRP HB2 . . 4.190 3.483 3.227 3.652 . 0 0 "[ . 1 . 2]" 1
249 1 17 ILE MG 1 50 LEU MD1 . . 3.840 3.535 3.354 3.843 0.003 16 0 "[ . 1 . 2]" 1
250 1 17 ILE MG 1 56 VAL H . . 4.810 3.332 3.114 3.537 . 0 0 "[ . 1 . 2]" 1
251 1 17 ILE MG 1 56 VAL HB . . 4.530 2.769 2.518 3.002 . 0 0 "[ . 1 . 2]" 1
252 1 17 ILE MG 1 59 ILE HG13 . . 4.780 4.375 4.144 4.608 . 0 0 "[ . 1 . 2]" 1
253 1 18 PRO HA 1 19 GLY QA . . 4.580 3.931 3.914 3.960 . 0 0 "[ . 1 . 2]" 1
254 1 18 PRO HA 1 20 THR H . . 4.240 4.160 4.031 4.246 0.006 11 0 "[ . 1 . 2]" 1
255 1 18 PRO HD2 1 59 ILE MD . . 3.270 2.038 1.862 2.305 . 0 0 "[ . 1 . 2]" 1
256 1 18 PRO HD3 1 59 ILE MD . . 3.680 2.279 1.985 2.496 . 0 0 "[ . 1 . 2]" 1
257 1 18 PRO QG 1 59 ILE MD . . 4.510 3.099 2.842 3.359 . 0 0 "[ . 1 . 2]" 1
258 1 19 GLY QA 1 20 THR MG . . 3.870 3.164 3.141 3.229 . 0 0 "[ . 1 . 2]" 1
259 1 19 GLY HA2 1 20 THR MG . . 4.580 4.397 4.370 4.450 . 0 0 "[ . 1 . 2]" 1
260 1 19 GLY HA3 1 20 THR MG . . 4.580 3.244 3.218 3.315 . 0 0 "[ . 1 . 2]" 1
261 1 20 THR H 1 20 THR HG1 . . 3.180 2.626 2.527 3.191 0.011 6 0 "[ . 1 . 2]" 1
262 1 20 THR H 1 20 THR MG . . 3.280 1.880 1.872 1.900 . 0 0 "[ . 1 . 2]" 1
263 1 20 THR H 1 50 LEU MD2 . . 5.340 4.188 4.085 4.341 . 0 0 "[ . 1 . 2]" 1
264 1 20 THR HA 1 20 THR MG . . 3.210 2.665 2.646 2.674 . 0 0 "[ . 1 . 2]" 1
265 1 20 THR HA 1 21 PRO HA . . 4.730 4.398 4.396 4.401 . 0 0 "[ . 1 . 2]" 1
266 1 20 THR HA 1 21 PRO HD2 . . 3.130 2.301 2.269 2.344 . 0 0 "[ . 1 . 2]" 1
267 1 20 THR HA 1 21 PRO HD3 . . 2.970 2.270 2.263 2.281 . 0 0 "[ . 1 . 2]" 1
268 1 20 THR HA 1 21 PRO HG2 . . 4.570 4.433 4.406 4.468 . 0 0 "[ . 1 . 2]" 1
269 1 20 THR HA 1 21 PRO HG3 . . 4.520 4.417 4.401 4.441 . 0 0 "[ . 1 . 2]" 1
270 1 20 THR HA 1 22 TRP HD1 . . 4.310 4.265 4.223 4.312 0.002 15 0 "[ . 1 . 2]" 1
271 1 20 THR HA 1 50 LEU MD2 . . 5.180 4.317 4.267 4.417 . 0 0 "[ . 1 . 2]" 1
272 1 20 THR HB 1 21 PRO HD2 . . 3.190 2.174 2.086 2.225 . 0 0 "[ . 1 . 2]" 1
273 1 20 THR HB 1 21 PRO HD3 . . 3.750 3.552 3.466 3.610 . 0 0 "[ . 1 . 2]" 1
274 1 20 THR HB 1 21 PRO HG2 . . 4.210 4.123 4.058 4.164 . 0 0 "[ . 1 . 2]" 1
275 1 20 THR HB 1 21 PRO HG3 . . 5.030 4.876 4.789 4.924 . 0 0 "[ . 1 . 2]" 1
276 1 20 THR HB 1 22 TRP H . . 3.700 3.010 2.943 3.035 . 0 0 "[ . 1 . 2]" 1
277 1 20 THR HB 1 22 TRP HB2 . . 4.820 3.684 3.570 3.757 . 0 0 "[ . 1 . 2]" 1
278 1 20 THR HB 1 22 TRP HD1 . . 3.480 2.233 2.187 2.280 . 0 0 "[ . 1 . 2]" 1
279 1 20 THR HB 1 22 TRP HE1 . . 4.400 4.333 4.237 4.404 0.004 18 0 "[ . 1 . 2]" 1
280 1 20 THR HB 1 50 LEU MD2 . . 3.980 2.434 2.365 2.580 . 0 0 "[ . 1 . 2]" 1
281 1 20 THR HB 1 53 ARG QD . . 5.260 4.083 3.861 4.620 . 0 0 "[ . 1 . 2]" 1
282 1 20 THR HG1 1 20 THR MG . . 3.480 2.452 2.047 2.637 . 0 0 "[ . 1 . 2]" 1
283 1 20 THR HG1 1 22 TRP H . . 3.380 2.733 2.465 3.226 . 0 0 "[ . 1 . 2]" 1
284 1 20 THR HG1 1 22 TRP HB2 . . 4.810 2.736 2.513 2.830 . 0 0 "[ . 1 . 2]" 1
285 1 20 THR HG1 1 22 TRP HD1 . . 4.940 3.655 3.297 3.799 . 0 0 "[ . 1 . 2]" 1
286 1 20 THR HG1 1 50 LEU MD2 . . 4.380 2.646 1.909 2.904 . 0 0 "[ . 1 . 2]" 1
287 1 20 THR MG 1 21 PRO HD2 . . 3.780 3.715 3.675 3.746 . 0 0 "[ . 1 . 2]" 1
288 1 20 THR MG 1 21 PRO HD3 . . 4.650 4.419 4.393 4.442 . 0 0 "[ . 1 . 2]" 1
289 1 20 THR MG 1 22 TRP H . . 4.140 4.092 4.073 4.117 . 0 0 "[ . 1 . 2]" 1
290 1 20 THR MG 1 22 TRP HB2 . . 3.920 3.948 3.931 3.980 0.060 17 0 "[ . 1 . 2]" 1
291 1 20 THR MG 1 22 TRP HB3 . . 5.500 5.356 5.339 5.387 . 0 0 "[ . 1 . 2]" 1
292 1 20 THR MG 1 22 TRP HD1 . . 3.850 3.504 3.418 3.575 . 0 0 "[ . 1 . 2]" 1
293 1 20 THR MG 1 49 ASP HB3 . . 4.870 4.576 4.323 4.809 . 0 0 "[ . 1 . 2]" 1
294 1 20 THR MG 1 50 LEU MD1 . . 4.170 4.037 3.969 4.156 . 0 0 "[ . 1 . 2]" 1
295 1 21 PRO HB2 1 36 ASN HA . . 4.640 4.113 3.707 4.274 . 0 0 "[ . 1 . 2]" 1
296 1 21 PRO HB2 1 36 ASN HD21 . . 4.720 3.920 3.856 3.984 . 0 0 "[ . 1 . 2]" 1
297 1 21 PRO HB2 1 36 ASN HD22 . . 4.420 2.813 2.659 3.017 . 0 0 "[ . 1 . 2]" 1
298 1 21 PRO HB2 1 38 THR HB . . 4.600 2.929 2.669 3.236 . 0 0 "[ . 1 . 2]" 1
299 1 21 PRO HB2 1 38 THR MG . . 4.440 3.915 3.772 4.201 . 0 0 "[ . 1 . 2]" 1
300 1 21 PRO HB3 1 36 ASN HD21 . . 5.400 5.389 5.285 5.402 0.002 9 0 "[ . 1 . 2]" 1
301 1 21 PRO HB3 1 36 ASN HD22 . . 4.690 4.076 3.880 4.132 . 0 0 "[ . 1 . 2]" 1
302 1 21 PRO HB3 1 38 THR MG . . 4.340 3.736 3.578 4.075 . 0 0 "[ . 1 . 2]" 1
303 1 21 PRO HD2 1 22 TRP H . . 3.940 2.935 2.891 2.980 . 0 0 "[ . 1 . 2]" 1
304 1 21 PRO HD2 1 22 TRP HD1 . . 3.580 2.912 2.794 2.941 . 0 0 "[ . 1 . 2]" 1
305 1 21 PRO HD2 1 22 TRP HE1 . . 4.410 4.332 4.244 4.380 . 0 0 "[ . 1 . 2]" 1
306 1 21 PRO HD2 1 50 LEU MD2 . . 4.710 4.157 4.132 4.178 . 0 0 "[ . 1 . 2]" 1
307 1 21 PRO HD3 1 22 TRP H . . 4.160 3.994 3.972 4.018 . 0 0 "[ . 1 . 2]" 1
308 1 21 PRO HD3 1 22 TRP HD1 . . 4.690 4.662 4.542 4.691 0.001 4 0 "[ . 1 . 2]" 1
309 1 21 PRO HD3 1 50 LEU MD2 . . 5.500 5.504 5.491 5.521 0.021 16 0 "[ . 1 . 2]" 1
310 1 21 PRO HG2 1 22 TRP H . . 4.420 3.208 3.135 3.278 . 0 0 "[ . 1 . 2]" 1
311 1 21 PRO HG2 1 22 TRP HD1 . . 4.190 3.580 3.427 3.655 . 0 0 "[ . 1 . 2]" 1
312 1 21 PRO HG2 1 22 TRP HE1 . . 4.400 4.191 4.109 4.218 . 0 0 "[ . 1 . 2]" 1
313 1 21 PRO HG2 1 36 ASN HD21 . . 4.520 2.970 2.807 3.124 . 0 0 "[ . 1 . 2]" 1
314 1 21 PRO HG2 1 36 ASN HD22 . . 4.320 2.166 1.920 2.439 . 0 0 "[ . 1 . 2]" 1
315 1 21 PRO HG3 1 22 TRP H . . 4.810 4.511 4.455 4.564 . 0 0 "[ . 1 . 2]" 1
316 1 21 PRO HG3 1 22 TRP HD1 . . 5.040 4.982 4.834 5.043 0.003 4 0 "[ . 1 . 2]" 1
317 1 21 PRO HG3 1 22 TRP HE1 . . 5.500 5.485 5.391 5.514 0.014 17 0 "[ . 1 . 2]" 1
318 1 21 PRO HG3 1 36 ASN HD21 . . 4.620 4.373 4.132 4.498 . 0 0 "[ . 1 . 2]" 1
319 1 21 PRO HG3 1 36 ASN HD22 . . 4.290 3.017 2.767 3.189 . 0 0 "[ . 1 . 2]" 1
320 1 22 TRP H 1 22 TRP HB2 . . 3.230 2.347 2.331 2.379 . 0 0 "[ . 1 . 2]" 1
321 1 22 TRP H 1 22 TRP HB3 . . 3.660 3.574 3.570 3.580 . 0 0 "[ . 1 . 2]" 1
322 1 22 TRP H 1 22 TRP HD1 . . 3.760 2.663 2.547 2.714 . 0 0 "[ . 1 . 2]" 1
323 1 22 TRP H 1 22 TRP HE1 . . 4.910 4.875 4.794 4.913 0.003 11 0 "[ . 1 . 2]" 1
324 1 22 TRP H 1 23 CYS H . . 4.890 4.625 4.612 4.630 . 0 0 "[ . 1 . 2]" 1
325 1 22 TRP H 1 50 LEU MD1 . . 4.830 4.617 4.320 4.765 . 0 0 "[ . 1 . 2]" 1
326 1 22 TRP H 1 50 LEU MD2 . . 5.000 3.591 3.433 3.738 . 0 0 "[ . 1 . 2]" 1
327 1 22 TRP HA 1 22 TRP HE3 . . 3.940 3.096 3.018 3.224 . 0 0 "[ . 1 . 2]" 1
328 1 22 TRP HA 1 23 CYS H . . 3.110 2.306 2.223 2.358 . 0 0 "[ . 1 . 2]" 1
329 1 22 TRP HB2 1 22 TRP HD1 . . 3.740 2.641 2.628 2.669 . 0 0 "[ . 1 . 2]" 1
330 1 22 TRP HB2 1 22 TRP HE1 . . 4.910 4.781 4.777 4.792 . 0 0 "[ . 1 . 2]" 1
331 1 22 TRP HB2 1 23 CYS H . . 4.230 3.921 3.821 4.073 . 0 0 "[ . 1 . 2]" 1
332 1 22 TRP HB2 1 50 LEU MD1 . . 3.630 2.661 2.195 2.869 . 0 0 "[ . 1 . 2]" 1
333 1 22 TRP HB2 1 50 LEU MD2 . . 3.530 2.363 2.231 2.530 . 0 0 "[ . 1 . 2]" 1
334 1 22 TRP HB3 1 22 TRP HE3 . . 3.720 2.612 2.568 2.635 . 0 0 "[ . 1 . 2]" 1
335 1 22 TRP HB3 1 23 CYS H . . 3.790 2.692 2.545 2.949 . 0 0 "[ . 1 . 2]" 1
336 1 22 TRP HB3 1 34 PHE QD . . 5.000 3.331 3.168 3.517 . 0 0 "[ . 1 . 2]" 1
337 1 22 TRP HB3 1 50 LEU MD1 . . 3.880 2.486 2.053 2.752 . 0 0 "[ . 1 . 2]" 1
338 1 22 TRP HB3 1 50 LEU MD2 . . 4.150 3.412 3.278 3.566 . 0 0 "[ . 1 . 2]" 1
339 1 22 TRP HD1 1 47 PRO HG2 . . 5.210 4.824 4.573 5.013 . 0 0 "[ . 1 . 2]" 1
340 1 22 TRP HD1 1 49 ASP HB2 . . 4.640 4.030 3.760 4.287 . 0 0 "[ . 1 . 2]" 1
341 1 22 TRP HD1 1 49 ASP HB3 . . 4.970 3.439 3.174 3.780 . 0 0 "[ . 1 . 2]" 1
342 1 22 TRP HD1 1 50 LEU MD1 . . 4.080 3.627 3.337 3.775 . 0 0 "[ . 1 . 2]" 1
343 1 22 TRP HD1 1 50 LEU MD2 . . 3.570 2.250 1.976 2.366 . 0 0 "[ . 1 . 2]" 1
344 1 22 TRP HD1 1 50 LEU HG . . 4.350 2.974 2.872 3.146 . 0 0 "[ . 1 . 2]" 1
345 1 22 TRP HE1 1 47 PRO HB2 . . 4.590 4.184 3.927 4.309 . 0 0 "[ . 1 . 2]" 1
346 1 22 TRP HE1 1 47 PRO HB3 . . 5.430 5.359 5.085 5.431 0.001 14 0 "[ . 1 . 2]" 1
347 1 22 TRP HE1 1 47 PRO HG2 . . 5.070 3.766 3.603 3.988 . 0 0 "[ . 1 . 2]" 1
348 1 22 TRP HE1 1 47 PRO HG3 . . 4.680 4.225 4.084 4.424 . 0 0 "[ . 1 . 2]" 1
349 1 22 TRP HE1 1 49 ASP HB2 . . 4.260 2.053 1.901 2.235 . 0 0 "[ . 1 . 2]" 1
350 1 22 TRP HE1 1 49 ASP HB3 . . 4.760 2.195 1.979 2.427 . 0 0 "[ . 1 . 2]" 1
351 1 22 TRP HE1 1 50 LEU MD1 . . 5.080 4.374 3.885 4.599 . 0 0 "[ . 1 . 2]" 1
352 1 22 TRP HE1 1 50 LEU MD2 . . 4.810 3.935 3.773 4.115 . 0 0 "[ . 1 . 2]" 1
353 1 22 TRP HE1 1 50 LEU HG . . 4.740 3.425 3.121 3.608 . 0 0 "[ . 1 . 2]" 1
354 1 22 TRP HE3 1 23 CYS H . . 3.930 3.073 2.977 3.278 . 0 0 "[ . 1 . 2]" 1
355 1 22 TRP HE3 1 34 PHE HA . . 4.650 3.500 3.369 3.611 . 0 0 "[ . 1 . 2]" 1
356 1 22 TRP HE3 1 34 PHE HB2 . . 4.200 2.980 2.735 3.183 . 0 0 "[ . 1 . 2]" 1
357 1 22 TRP HE3 1 34 PHE HB3 . . 3.760 2.112 1.999 2.278 . 0 0 "[ . 1 . 2]" 1
358 1 22 TRP HE3 1 34 PHE QD . . 4.880 4.024 3.890 4.129 . 0 0 "[ . 1 . 2]" 1
359 1 22 TRP HE3 1 35 TYR H . . 3.930 2.913 2.722 3.235 . 0 0 "[ . 1 . 2]" 1
360 1 22 TRP HE3 1 35 TYR HA . . 4.810 3.578 3.375 3.693 . 0 0 "[ . 1 . 2]" 1
361 1 22 TRP HE3 1 36 ASN H . . 4.850 4.375 4.050 4.573 . 0 0 "[ . 1 . 2]" 1
362 1 22 TRP HE3 1 36 ASN HA . . 4.940 4.300 4.026 4.543 . 0 0 "[ . 1 . 2]" 1
363 1 22 TRP HE3 1 36 ASN HB3 . . 5.150 5.126 5.039 5.153 0.003 17 0 "[ . 1 . 2]" 1
364 1 22 TRP HE3 1 47 PRO HG2 . . 5.400 4.978 4.555 5.172 . 0 0 "[ . 1 . 2]" 1
365 1 22 TRP HE3 1 47 PRO HG3 . . 4.670 4.156 3.554 4.337 . 0 0 "[ . 1 . 2]" 1
366 1 22 TRP HE3 1 50 LEU MD1 . . 4.450 3.626 3.337 3.771 . 0 0 "[ . 1 . 2]" 1
367 1 22 TRP HH2 1 41 LEU HB3 . . 4.690 3.340 2.945 3.530 . 0 0 "[ . 1 . 2]" 1
368 1 22 TRP HH2 1 41 LEU MD1 . . 3.480 2.133 1.963 2.338 . 0 0 "[ . 1 . 2]" 1
369 1 22 TRP HH2 1 41 LEU HG . . 4.850 3.691 3.287 3.863 . 0 0 "[ . 1 . 2]" 1
370 1 22 TRP HH2 1 43 MET ME . . 3.760 3.626 3.374 3.762 0.002 5 0 "[ . 1 . 2]" 1
371 1 22 TRP HH2 1 43 MET HG2 . . 4.250 3.551 3.343 3.703 . 0 0 "[ . 1 . 2]" 1
372 1 22 TRP HH2 1 43 MET HG3 . . 4.100 2.129 2.001 2.295 . 0 0 "[ . 1 . 2]" 1
373 1 22 TRP HH2 1 47 PRO HB2 . . 4.880 4.353 4.029 4.592 . 0 0 "[ . 1 . 2]" 1
374 1 22 TRP HH2 1 47 PRO HB3 . . 4.440 3.573 3.227 3.835 . 0 0 "[ . 1 . 2]" 1
375 1 22 TRP HH2 1 47 PRO HG2 . . 5.500 4.436 4.305 4.655 . 0 0 "[ . 1 . 2]" 1
376 1 22 TRP HH2 1 47 PRO HG3 . . 4.310 2.826 2.687 3.046 . 0 0 "[ . 1 . 2]" 1
377 1 22 TRP HZ2 1 36 ASN HD21 . . 4.580 3.918 3.676 4.058 . 0 0 "[ . 1 . 2]" 1
378 1 22 TRP HZ2 1 36 ASN HD22 . . 5.500 5.329 5.081 5.502 0.002 16 0 "[ . 1 . 2]" 1
379 1 22 TRP HZ2 1 41 LEU MD1 . . 4.260 3.921 3.650 4.201 . 0 0 "[ . 1 . 2]" 1
380 1 22 TRP HZ2 1 43 MET ME . . 4.940 4.470 4.269 4.673 . 0 0 "[ . 1 . 2]" 1
381 1 22 TRP HZ2 1 47 PRO HB2 . . 3.950 3.140 2.904 3.348 . 0 0 "[ . 1 . 2]" 1
382 1 22 TRP HZ2 1 47 PRO HB3 . . 3.980 3.475 3.148 3.647 . 0 0 "[ . 1 . 2]" 1
383 1 22 TRP HZ2 1 47 PRO HG2 . . 4.930 3.576 3.371 3.841 . 0 0 "[ . 1 . 2]" 1
384 1 22 TRP HZ2 1 47 PRO HG3 . . 4.300 2.869 2.698 3.086 . 0 0 "[ . 1 . 2]" 1
385 1 22 TRP HZ3 1 34 PHE HB2 . . 4.450 2.790 2.596 3.072 . 0 0 "[ . 1 . 2]" 1
386 1 22 TRP HZ3 1 34 PHE HB3 . . 4.240 3.409 3.052 3.711 . 0 0 "[ . 1 . 2]" 1
387 1 22 TRP HZ3 1 35 TYR HA . . 4.140 3.179 2.799 3.389 . 0 0 "[ . 1 . 2]" 1
388 1 22 TRP HZ3 1 36 ASN H . . 4.810 4.133 3.587 4.389 . 0 0 "[ . 1 . 2]" 1
389 1 22 TRP HZ3 1 36 ASN HB2 . . 4.840 3.730 3.585 3.888 . 0 0 "[ . 1 . 2]" 1
390 1 22 TRP HZ3 1 36 ASN HB3 . . 4.970 4.745 4.624 4.880 . 0 0 "[ . 1 . 2]" 1
391 1 22 TRP HZ3 1 41 LEU HB3 . . 5.170 4.057 3.858 4.326 . 0 0 "[ . 1 . 2]" 1
392 1 22 TRP HZ3 1 41 LEU MD1 . . 4.370 3.128 2.950 3.276 . 0 0 "[ . 1 . 2]" 1
393 1 22 TRP HZ3 1 41 LEU HG . . 5.500 5.453 5.296 5.502 0.002 19 0 "[ . 1 . 2]" 1
394 1 22 TRP HZ3 1 42 SER HA . . 4.100 3.160 2.839 3.511 . 0 0 "[ . 1 . 2]" 1
395 1 22 TRP HZ3 1 43 MET H . . 4.340 2.763 2.481 3.117 . 0 0 "[ . 1 . 2]" 1
396 1 22 TRP HZ3 1 43 MET HB2 . . 4.780 3.956 3.682 4.264 . 0 0 "[ . 1 . 2]" 1
397 1 22 TRP HZ3 1 43 MET ME . . 4.980 4.544 4.241 4.962 . 0 0 "[ . 1 . 2]" 1
398 1 22 TRP HZ3 1 43 MET HG2 . . 4.430 4.346 4.103 4.434 0.004 15 0 "[ . 1 . 2]" 1
399 1 22 TRP HZ3 1 43 MET HG3 . . 4.370 2.955 2.733 3.239 . 0 0 "[ . 1 . 2]" 1
400 1 22 TRP HZ3 1 47 PRO HG3 . . 4.280 3.523 3.199 3.790 . 0 0 "[ . 1 . 2]" 1
401 1 23 CYS H 1 23 CYS HB2 . . 3.990 2.894 2.738 3.675 . 0 0 "[ . 1 . 2]" 1
402 1 23 CYS H 1 23 CYS QB . . 3.450 2.757 2.438 3.129 . 0 0 "[ . 1 . 2]" 1
403 1 23 CYS H 1 23 CYS HB3 . . 3.990 3.774 2.491 3.902 . 0 0 "[ . 1 . 2]" 1
404 1 23 CYS H 1 25 VAL MG2 . . 4.940 4.417 4.277 4.546 . 0 0 "[ . 1 . 2]" 1
405 1 23 CYS H 1 34 PHE HA . . 4.550 3.991 3.668 4.144 . 0 0 "[ . 1 . 2]" 1
406 1 23 CYS H 1 34 PHE HB3 . . 4.780 4.033 3.625 4.222 . 0 0 "[ . 1 . 2]" 1
407 1 23 CYS H 1 34 PHE QD . . 5.410 4.880 4.312 5.139 . 0 0 "[ . 1 . 2]" 1
408 1 23 CYS H 1 35 TYR H . . 3.840 2.552 2.467 2.687 . 0 0 "[ . 1 . 2]" 1
409 1 23 CYS H 1 35 TYR QD . . 4.720 4.542 4.391 4.741 0.021 16 0 "[ . 1 . 2]" 1
410 1 23 CYS H 1 36 ASN HA . . 4.600 3.759 3.641 3.901 . 0 0 "[ . 1 . 2]" 1
411 1 23 CYS H 1 37 PRO HD2 . . 4.680 4.283 4.000 4.487 . 0 0 "[ . 1 . 2]" 1
412 1 23 CYS H 1 37 PRO HD3 . . 4.590 4.062 3.688 4.302 . 0 0 "[ . 1 . 2]" 1
413 1 23 CYS H 1 50 LEU MD1 . . 5.390 4.717 4.509 4.913 . 0 0 "[ . 1 . 2]" 1
414 1 23 CYS HA 1 24 VAL H . . 3.050 2.144 2.138 2.212 . 0 0 "[ . 1 . 2]" 1
415 1 23 CYS HA 1 24 VAL HA . . 4.760 4.390 4.354 4.401 . 0 0 "[ . 1 . 2]" 1
416 1 23 CYS HA 1 24 VAL HB . . 4.850 4.667 4.577 4.766 . 0 0 "[ . 1 . 2]" 1
417 1 23 CYS HA 1 24 VAL MG2 . . 4.110 3.686 3.474 3.856 . 0 0 "[ . 1 . 2]" 1
418 1 23 CYS QB 1 24 VAL H . . 3.470 3.371 3.284 3.509 0.039 18 0 "[ . 1 . 2]" 1
419 1 23 CYS QB 1 35 TYR H . . 4.320 3.581 3.224 4.332 0.012 16 0 "[ . 1 . 2]" 1
420 1 23 CYS QB 1 35 TYR HB3 . . 4.060 2.886 2.429 3.968 . 0 0 "[ . 1 . 2]" 1
421 1 23 CYS QB 1 35 TYR QD . . 4.030 2.726 2.362 3.910 . 0 0 "[ . 1 . 2]" 1
422 1 23 CYS QB 1 37 PRO HD2 . . 4.740 4.206 4.023 4.428 . 0 0 "[ . 1 . 2]" 1
423 1 23 CYS HB2 1 25 VAL MG2 . . 4.090 3.208 2.713 4.155 0.065 18 0 "[ . 1 . 2]" 1
424 1 23 CYS HB2 1 35 TYR QD . . 4.630 2.843 2.390 4.252 . 0 0 "[ . 1 . 2]" 1
425 1 23 CYS HB2 1 37 PRO HD3 . . 4.710 3.370 2.993 4.744 0.034 16 0 "[ . 1 . 2]" 1
426 1 23 CYS HB3 1 25 VAL MG2 . . 4.090 3.583 3.354 4.102 0.012 16 0 "[ . 1 . 2]" 1
427 1 23 CYS HB3 1 35 TYR QD . . 4.630 4.021 2.941 4.635 0.005 16 0 "[ . 1 . 2]" 1
428 1 23 CYS HB3 1 37 PRO HD3 . . 4.710 4.463 3.373 4.678 . 0 0 "[ . 1 . 2]" 1
429 1 24 VAL H 1 24 VAL HB . . 3.410 2.573 2.497 2.669 . 0 0 "[ . 1 . 2]" 1
430 1 24 VAL H 1 24 VAL MG1 . . 4.200 3.766 3.760 3.794 . 0 0 "[ . 1 . 2]" 1
431 1 24 VAL H 1 24 VAL MG2 . . 3.280 2.157 1.928 2.469 . 0 0 "[ . 1 . 2]" 1
432 1 24 VAL H 1 25 VAL MG2 . . 4.730 4.364 4.206 4.489 . 0 0 "[ . 1 . 2]" 1
433 1 24 VAL H 1 59 ILE MG . . 4.650 3.893 3.730 4.074 . 0 0 "[ . 1 . 2]" 1
434 1 24 VAL HA 1 24 VAL MG1 . . 3.310 2.278 2.196 2.361 . 0 0 "[ . 1 . 2]" 1
435 1 24 VAL HA 1 24 VAL MG2 . . 3.190 2.356 2.254 2.501 . 0 0 "[ . 1 . 2]" 1
436 1 24 VAL HA 1 25 VAL H . . 2.890 2.153 2.140 2.244 . 0 0 "[ . 1 . 2]" 1
437 1 24 VAL HA 1 25 VAL HB . . 4.770 4.700 4.637 4.798 0.028 18 0 "[ . 1 . 2]" 1
438 1 24 VAL HA 1 25 VAL MG2 . . 4.060 3.718 3.447 3.962 . 0 0 "[ . 1 . 2]" 1
439 1 24 VAL HA 1 32 VAL MG2 . . 4.670 3.373 3.166 3.453 . 0 0 "[ . 1 . 2]" 1
440 1 24 VAL HA 1 34 PHE HA . . 3.520 3.019 2.838 3.298 . 0 0 "[ . 1 . 2]" 1
441 1 24 VAL HA 1 34 PHE QD . . 4.330 3.997 3.048 4.262 . 0 0 "[ . 1 . 2]" 1
442 1 24 VAL HA 1 35 TYR H . . 4.320 3.961 3.827 4.319 . 0 0 "[ . 1 . 2]" 1
443 1 24 VAL HB 1 25 VAL H . . 4.390 4.283 4.130 4.453 0.063 18 0 "[ . 1 . 2]" 1
444 1 24 VAL HB 1 26 TRP HH2 . . 4.090 2.991 2.691 3.361 . 0 0 "[ . 1 . 2]" 1
445 1 24 VAL HB 1 26 TRP HZ3 . . 4.250 3.335 3.061 3.483 . 0 0 "[ . 1 . 2]" 1
446 1 24 VAL HB 1 32 VAL MG2 . . 4.580 4.108 4.015 4.194 . 0 0 "[ . 1 . 2]" 1
447 1 24 VAL HB 1 59 ILE MG . . 3.730 2.314 2.087 2.475 . 0 0 "[ . 1 . 2]" 1
448 1 24 VAL MG1 1 25 VAL H . . 3.410 2.755 2.311 3.404 . 0 0 "[ . 1 . 2]" 1
449 1 24 VAL MG1 1 25 VAL HA . . 4.900 3.856 3.656 4.180 . 0 0 "[ . 1 . 2]" 1
450 1 24 VAL MG1 1 26 TRP HE1 . . 4.880 3.803 3.625 4.104 . 0 0 "[ . 1 . 2]" 1
451 1 24 VAL MG1 1 26 TRP HE3 . . 4.530 3.678 3.399 3.904 . 0 0 "[ . 1 . 2]" 1
452 1 24 VAL MG1 1 26 TRP HH2 . . 3.640 2.743 2.649 2.972 . 0 0 "[ . 1 . 2]" 1
453 1 24 VAL MG1 1 26 TRP HZ2 . . 4.040 2.754 2.536 3.091 . 0 0 "[ . 1 . 2]" 1
454 1 24 VAL MG1 1 26 TRP HZ3 . . 4.350 3.221 2.932 3.415 . 0 0 "[ . 1 . 2]" 1
455 1 24 VAL MG1 1 32 VAL HA . . 4.950 4.514 4.354 4.685 . 0 0 "[ . 1 . 2]" 1
456 1 24 VAL MG1 1 32 VAL HB . . 3.860 3.819 3.738 3.865 0.005 19 0 "[ . 1 . 2]" 1
457 1 24 VAL MG1 1 32 VAL MG1 . . 3.420 3.339 3.206 3.421 0.001 7 0 "[ . 1 . 2]" 1
458 1 24 VAL MG1 1 32 VAL MG2 . . 3.270 1.792 1.748 1.837 . 0 0 "[ . 1 . 2]" 1
459 1 24 VAL MG1 1 33 PHE H . . 4.590 4.165 3.876 4.516 . 0 0 "[ . 1 . 2]" 1
460 1 24 VAL MG1 1 34 PHE HA . . 4.980 4.478 4.268 4.778 . 0 0 "[ . 1 . 2]" 1
461 1 24 VAL MG1 1 34 PHE QD . . 5.100 4.624 3.998 4.836 . 0 0 "[ . 1 . 2]" 1
462 1 24 VAL MG1 1 34 PHE QE . . 4.860 4.486 3.592 4.752 . 0 0 "[ . 1 . 2]" 1
463 1 24 VAL MG1 1 59 ILE MD . . 4.890 4.195 4.026 4.436 . 0 0 "[ . 1 . 2]" 1
464 1 24 VAL MG1 1 59 ILE MG . . 3.470 2.408 2.148 2.725 . 0 0 "[ . 1 . 2]" 1
465 1 24 VAL MG1 1 60 ILE HA . . 4.010 2.865 2.535 3.137 . 0 0 "[ . 1 . 2]" 1
466 1 24 VAL MG1 1 60 ILE HB . . 5.030 4.470 4.255 4.701 . 0 0 "[ . 1 . 2]" 1
467 1 24 VAL MG1 1 60 ILE MD . . 3.700 3.376 3.150 3.599 . 0 0 "[ . 1 . 2]" 1
468 1 24 VAL MG1 1 60 ILE HG12 . . 4.010 2.450 2.318 2.678 . 0 0 "[ . 1 . 2]" 1
469 1 24 VAL MG1 1 60 ILE QG . . 3.130 2.161 1.949 2.378 . 0 0 "[ . 1 . 2]" 1
470 1 24 VAL MG1 1 60 ILE HG13 . . 4.010 2.417 2.096 2.660 . 0 0 "[ . 1 . 2]" 1
471 1 24 VAL MG1 1 60 ILE MG . . 4.160 3.689 3.448 3.876 . 0 0 "[ . 1 . 2]" 1
472 1 24 VAL MG2 1 25 VAL H . . 4.340 4.131 3.987 4.291 . 0 0 "[ . 1 . 2]" 1
473 1 24 VAL MG2 1 26 TRP HH2 . . 4.570 3.897 3.677 4.206 . 0 0 "[ . 1 . 2]" 1
474 1 24 VAL MG2 1 26 TRP HZ2 . . 4.930 4.385 4.092 4.796 . 0 0 "[ . 1 . 2]" 1
475 1 24 VAL MG2 1 32 VAL MG1 . . 4.970 4.838 4.671 4.971 0.001 15 0 "[ . 1 . 2]" 1
476 1 24 VAL MG2 1 32 VAL MG2 . . 4.100 3.649 3.514 3.811 . 0 0 "[ . 1 . 2]" 1
477 1 24 VAL MG2 1 34 PHE QD . . 3.580 3.286 2.951 3.578 . 0 0 "[ . 1 . 2]" 1
478 1 24 VAL MG2 1 34 PHE QE . . 3.920 3.495 2.685 3.792 . 0 0 "[ . 1 . 2]" 1
479 1 24 VAL MG2 1 50 LEU MD1 . . 4.610 3.890 3.723 4.156 . 0 0 "[ . 1 . 2]" 1
480 1 24 VAL MG2 1 56 VAL MG2 . . 3.600 3.110 2.973 3.369 . 0 0 "[ . 1 . 2]" 1
481 1 24 VAL MG2 1 59 ILE H . . 5.380 4.687 4.566 4.885 . 0 0 "[ . 1 . 2]" 1
482 1 24 VAL MG2 1 59 ILE HB . . 4.060 2.473 2.339 2.694 . 0 0 "[ . 1 . 2]" 1
483 1 24 VAL MG2 1 59 ILE MG . . 2.930 1.969 1.857 2.158 . 0 0 "[ . 1 . 2]" 1
484 1 24 VAL MG2 1 60 ILE HG12 . . 4.410 3.409 3.054 3.745 . 0 0 "[ . 1 . 2]" 1
485 1 24 VAL MG2 1 60 ILE QG . . 3.670 2.441 2.112 2.713 . 0 0 "[ . 1 . 2]" 1
486 1 24 VAL MG2 1 60 ILE HG13 . . 4.410 2.503 2.153 2.808 . 0 0 "[ . 1 . 2]" 1
487 1 25 VAL H 1 25 VAL HB . . 3.570 2.662 2.546 2.759 . 0 0 "[ . 1 . 2]" 1
488 1 25 VAL H 1 25 VAL MG1 . . 3.990 3.862 3.809 3.906 . 0 0 "[ . 1 . 2]" 1
489 1 25 VAL H 1 25 VAL MG2 . . 3.420 2.676 2.419 2.840 . 0 0 "[ . 1 . 2]" 1
490 1 25 VAL H 1 32 VAL MG2 . . 4.530 2.782 2.445 3.137 . 0 0 "[ . 1 . 2]" 1
491 1 25 VAL H 1 33 PHE H . . 3.800 3.295 3.080 3.666 . 0 0 "[ . 1 . 2]" 1
492 1 25 VAL H 1 34 PHE HA . . 4.120 3.328 3.192 3.461 . 0 0 "[ . 1 . 2]" 1
493 1 25 VAL HA 1 25 VAL MG1 . . 3.190 2.335 2.251 2.421 . 0 0 "[ . 1 . 2]" 1
494 1 25 VAL HA 1 25 VAL MG2 . . 3.300 2.385 2.271 2.490 . 0 0 "[ . 1 . 2]" 1
495 1 25 VAL HA 1 26 TRP H . . 3.020 2.154 2.140 2.189 . 0 0 "[ . 1 . 2]" 1
496 1 25 VAL HA 1 26 TRP HB2 . . 4.610 4.452 4.375 4.486 . 0 0 "[ . 1 . 2]" 1
497 1 25 VAL HA 1 26 TRP HE3 . . 3.880 3.043 2.830 3.247 . 0 0 "[ . 1 . 2]" 1
498 1 25 VAL HA 1 26 TRP HZ3 . . 5.120 4.109 3.816 4.372 . 0 0 "[ . 1 . 2]" 1
499 1 25 VAL HB 1 33 PHE H . . 4.230 3.364 3.102 3.684 . 0 0 "[ . 1 . 2]" 1
500 1 25 VAL HB 1 33 PHE QD . . 4.500 3.401 3.103 3.569 . 0 0 "[ . 1 . 2]" 1
501 1 25 VAL HB 1 33 PHE QE . . 4.320 2.962 2.711 3.162 . 0 0 "[ . 1 . 2]" 1
502 1 25 VAL MG1 1 26 TRP H . . 3.260 2.506 2.281 2.713 . 0 0 "[ . 1 . 2]" 1
503 1 25 VAL MG1 1 26 TRP HA . . 4.680 3.922 3.676 4.052 . 0 0 "[ . 1 . 2]" 1
504 1 25 VAL MG1 1 26 TRP HB2 . . 4.560 4.323 4.199 4.479 . 0 0 "[ . 1 . 2]" 1
505 1 25 VAL MG1 1 26 TRP HE3 . . 4.700 4.198 4.009 4.374 . 0 0 "[ . 1 . 2]" 1
506 1 25 VAL MG1 1 27 THR HA . . 4.940 4.402 4.296 4.522 . 0 0 "[ . 1 . 2]" 1
507 1 25 VAL MG1 1 27 THR MG . . 3.740 3.338 3.125 3.574 . 0 0 "[ . 1 . 2]" 1
508 1 25 VAL MG1 1 33 PHE QD . . 4.190 3.652 3.494 3.919 . 0 0 "[ . 1 . 2]" 1
509 1 25 VAL MG1 1 33 PHE QE . . 3.310 2.219 1.973 2.642 . 0 0 "[ . 1 . 2]" 1
510 1 25 VAL MG2 1 26 TRP H . . 4.240 4.069 3.994 4.159 . 0 0 "[ . 1 . 2]" 1
511 1 25 VAL MG2 1 33 PHE QD . . 4.580 3.999 3.641 4.362 . 0 0 "[ . 1 . 2]" 1
512 1 25 VAL MG2 1 33 PHE QE . . 3.650 3.076 2.544 3.493 . 0 0 "[ . 1 . 2]" 1
513 1 25 VAL MG2 1 34 PHE HA . . 4.390 3.988 3.646 4.378 . 0 0 "[ . 1 . 2]" 1
514 1 25 VAL MG2 1 35 TYR H . . 3.930 3.195 2.829 3.414 . 0 0 "[ . 1 . 2]" 1
515 1 25 VAL MG2 1 35 TYR HA . . 5.260 4.437 4.125 4.808 . 0 0 "[ . 1 . 2]" 1
516 1 25 VAL MG2 1 35 TYR HB2 . . 3.370 2.746 2.373 3.196 . 0 0 "[ . 1 . 2]" 1
517 1 25 VAL MG2 1 35 TYR HB3 . . 3.370 2.241 1.966 2.562 . 0 0 "[ . 1 . 2]" 1
518 1 25 VAL MG2 1 35 TYR QD . . 3.880 3.224 2.936 3.551 . 0 0 "[ . 1 . 2]" 1
519 1 25 VAL MG2 1 35 TYR QE . . 5.210 4.854 4.591 5.144 . 0 0 "[ . 1 . 2]" 1
520 1 26 TRP H 1 26 TRP HB2 . . 3.620 2.392 2.337 2.473 . 0 0 "[ . 1 . 2]" 1
521 1 26 TRP H 1 26 TRP HB3 . . 3.870 3.626 3.587 3.679 . 0 0 "[ . 1 . 2]" 1
522 1 26 TRP H 1 26 TRP HE3 . . 3.460 2.212 1.994 2.513 . 0 0 "[ . 1 . 2]" 1
523 1 26 TRP H 1 27 THR H . . 4.820 4.552 4.520 4.577 . 0 0 "[ . 1 . 2]" 1
524 1 26 TRP HA 1 26 TRP HD1 . . 4.120 3.306 3.200 3.409 . 0 0 "[ . 1 . 2]" 1
525 1 26 TRP HA 1 26 TRP HE3 . . 4.700 4.245 4.155 4.340 . 0 0 "[ . 1 . 2]" 1
526 1 26 TRP HA 1 27 THR H . . 2.930 2.420 2.362 2.487 . 0 0 "[ . 1 . 2]" 1
527 1 26 TRP HA 1 27 THR HA . . 5.010 4.453 4.428 4.481 . 0 0 "[ . 1 . 2]" 1
528 1 26 TRP HA 1 27 THR MG . . 4.050 3.630 3.529 3.755 . 0 0 "[ . 1 . 2]" 1
529 1 26 TRP HA 1 31 ARG H . . 5.020 4.962 4.871 5.020 . 0 0 "[ . 1 . 2]" 1
530 1 26 TRP HA 1 32 VAL H . . 4.980 4.655 4.584 4.798 . 0 0 "[ . 1 . 2]" 1
531 1 26 TRP HA 1 32 VAL HA . . 3.380 2.099 1.996 2.282 . 0 0 "[ . 1 . 2]" 1
532 1 26 TRP HA 1 32 VAL MG1 . . 4.380 4.249 4.065 4.373 . 0 0 "[ . 1 . 2]" 1
533 1 26 TRP HA 1 32 VAL MG2 . . 4.000 2.747 2.517 2.935 . 0 0 "[ . 1 . 2]" 1
534 1 26 TRP HA 1 33 PHE H . . 4.390 3.523 3.336 3.706 . 0 0 "[ . 1 . 2]" 1
535 1 26 TRP HB2 1 26 TRP HE3 . . 3.980 2.627 2.575 2.684 . 0 0 "[ . 1 . 2]" 1
536 1 26 TRP HB2 1 27 THR H . . 4.410 3.696 3.570 3.836 . 0 0 "[ . 1 . 2]" 1
537 1 26 TRP HB2 1 65 HIS HE1 . . 5.440 4.511 3.137 5.347 . 0 0 "[ . 1 . 2]" 1
538 1 26 TRP HB3 1 26 TRP HD1 . . 3.520 2.633 2.606 2.663 . 0 0 "[ . 1 . 2]" 1
539 1 26 TRP HB3 1 27 THR H . . 3.990 2.395 2.242 2.534 . 0 0 "[ . 1 . 2]" 1
540 1 26 TRP HB3 1 65 HIS HE1 . . 5.110 3.866 2.929 4.666 . 0 0 "[ . 1 . 2]" 1
541 1 26 TRP HD1 1 27 THR H . . 4.910 3.800 3.662 3.924 . 0 0 "[ . 1 . 2]" 1
542 1 26 TRP HD1 1 30 GLU HA . . 5.140 4.947 4.783 5.067 . 0 0 "[ . 1 . 2]" 1
543 1 26 TRP HD1 1 32 VAL HB . . 4.600 2.500 2.222 2.832 . 0 0 "[ . 1 . 2]" 1
544 1 26 TRP HD1 1 32 VAL MG1 . . 3.960 3.656 3.305 3.943 . 0 0 "[ . 1 . 2]" 1
545 1 26 TRP HD1 1 32 VAL MG2 . . 3.950 3.621 3.382 3.876 . 0 0 "[ . 1 . 2]" 1
546 1 26 TRP HD1 1 63 PRO HG3 . . 5.010 4.333 3.963 4.718 . 0 0 "[ . 1 . 2]" 1
547 1 26 TRP HD1 1 65 HIS HE1 . . 4.860 3.022 2.580 3.984 . 0 0 "[ . 1 . 2]" 1
548 1 26 TRP HE1 1 32 VAL MG1 . . 3.950 3.539 3.218 3.780 . 0 0 "[ . 1 . 2]" 1
549 1 26 TRP HE1 1 32 VAL MG2 . . 3.860 3.455 3.183 3.747 . 0 0 "[ . 1 . 2]" 1
550 1 26 TRP HE1 1 59 ILE MG . . 5.500 5.029 4.804 5.316 . 0 0 "[ . 1 . 2]" 1
551 1 26 TRP HE1 1 60 ILE HA . . 4.140 3.279 2.816 3.807 . 0 0 "[ . 1 . 2]" 1
552 1 26 TRP HE1 1 60 ILE MG . . 4.160 3.520 2.976 4.030 . 0 0 "[ . 1 . 2]" 1
553 1 26 TRP HE1 1 63 PRO HA . . 5.040 4.185 3.790 4.568 . 0 0 "[ . 1 . 2]" 1
554 1 26 TRP HE1 1 63 PRO HB2 . . 4.980 3.780 3.370 4.124 . 0 0 "[ . 1 . 2]" 1
555 1 26 TRP HE1 1 63 PRO HB3 . . 4.370 2.263 2.036 2.460 . 0 0 "[ . 1 . 2]" 1
556 1 26 TRP HE1 1 63 PRO HD2 . . 5.380 5.215 5.098 5.344 . 0 0 "[ . 1 . 2]" 1
557 1 26 TRP HE1 1 63 PRO HD3 . . 4.800 3.789 3.552 3.986 . 0 0 "[ . 1 . 2]" 1
558 1 26 TRP HE1 1 63 PRO HG2 . . 5.120 4.654 4.296 4.952 . 0 0 "[ . 1 . 2]" 1
559 1 26 TRP HE1 1 63 PRO HG3 . . 3.890 3.204 2.871 3.503 . 0 0 "[ . 1 . 2]" 1
560 1 26 TRP HH2 1 32 VAL MG2 . . 5.170 4.743 4.522 4.907 . 0 0 "[ . 1 . 2]" 1
561 1 26 TRP HH2 1 59 ILE MD . . 5.100 4.625 4.362 4.916 . 0 0 "[ . 1 . 2]" 1
562 1 26 TRP HH2 1 59 ILE MG . . 3.150 2.032 1.883 2.183 . 0 0 "[ . 1 . 2]" 1
563 1 26 TRP HH2 1 60 ILE HA . . 4.530 4.464 4.187 4.533 0.003 16 0 "[ . 1 . 2]" 1
564 1 26 TRP HH2 1 63 PRO HA . . 3.920 3.284 3.061 3.663 . 0 0 "[ . 1 . 2]" 1
565 1 26 TRP HH2 1 64 PRO HD2 . . 4.040 2.898 2.593 3.167 . 0 0 "[ . 1 . 2]" 1
566 1 26 TRP HH2 1 64 PRO HD3 . . 4.420 2.644 2.149 3.132 . 0 0 "[ . 1 . 2]" 1
567 1 26 TRP HH2 1 64 PRO HG3 . . 4.740 3.655 3.419 4.019 . 0 0 "[ . 1 . 2]" 1
568 1 26 TRP HZ2 1 32 VAL MG1 . . 5.010 4.927 4.691 5.012 0.002 3 0 "[ . 1 . 2]" 1
569 1 26 TRP HZ2 1 32 VAL MG2 . . 4.410 3.974 3.692 4.151 . 0 0 "[ . 1 . 2]" 1
570 1 26 TRP HZ2 1 59 ILE MG . . 3.310 2.690 2.364 3.027 . 0 0 "[ . 1 . 2]" 1
571 1 26 TRP HZ2 1 60 ILE HA . . 3.120 2.485 2.180 2.739 . 0 0 "[ . 1 . 2]" 1
572 1 26 TRP HZ2 1 60 ILE MG . . 4.430 4.295 4.087 4.430 0.000 17 0 "[ . 1 . 2]" 1
573 1 26 TRP HZ2 1 63 PRO HA . . 3.920 2.509 2.090 2.885 . 0 0 "[ . 1 . 2]" 1
574 1 26 TRP HZ2 1 63 PRO HB2 . . 4.630 3.947 3.562 4.321 . 0 0 "[ . 1 . 2]" 1
575 1 26 TRP HZ2 1 63 PRO HB3 . . 4.270 2.512 2.156 2.879 . 0 0 "[ . 1 . 2]" 1
576 1 26 TRP HZ2 1 63 PRO HD3 . . 4.480 4.139 4.012 4.281 . 0 0 "[ . 1 . 2]" 1
577 1 26 TRP HZ2 1 63 PRO HG3 . . 4.860 4.571 4.283 4.862 0.002 3 0 "[ . 1 . 2]" 1
578 1 26 TRP HZ2 1 64 PRO HD2 . . 4.890 3.355 3.050 3.645 . 0 0 "[ . 1 . 2]" 1
579 1 26 TRP HZ2 1 64 PRO HD3 . . 4.800 3.689 3.258 4.054 . 0 0 "[ . 1 . 2]" 1
580 1 26 TRP HZ3 1 59 ILE MG . . 4.270 3.773 3.629 3.891 . 0 0 "[ . 1 . 2]" 1
581 1 26 TRP HZ3 1 64 PRO HD2 . . 5.060 3.336 3.129 3.574 . 0 0 "[ . 1 . 2]" 1
582 1 26 TRP HZ3 1 64 PRO HD3 . . 4.790 3.799 3.183 4.194 . 0 0 "[ . 1 . 2]" 1
583 1 27 THR H 1 27 THR MG . . 3.190 3.118 3.031 3.196 0.006 18 0 "[ . 1 . 2]" 1
584 1 27 THR H 1 30 GLU HA . . 4.790 4.770 4.697 4.794 0.004 19 0 "[ . 1 . 2]" 1
585 1 27 THR H 1 31 ARG H . . 3.860 3.090 3.004 3.156 . 0 0 "[ . 1 . 2]" 1
586 1 27 THR H 1 31 ARG HB2 . . 5.500 4.395 4.189 4.561 . 0 0 "[ . 1 . 2]" 1
587 1 27 THR H 1 31 ARG HB3 . . 5.500 4.824 4.630 5.265 . 0 0 "[ . 1 . 2]" 1
588 1 27 THR H 1 32 VAL HA . . 4.130 3.447 3.274 3.628 . 0 0 "[ . 1 . 2]" 1
589 1 27 THR H 1 32 VAL MG1 . . 5.400 5.237 5.077 5.361 . 0 0 "[ . 1 . 2]" 1
590 1 27 THR HA 1 27 THR MG . . 3.260 2.223 2.166 2.292 . 0 0 "[ . 1 . 2]" 1
591 1 27 THR HA 1 28 GLY HA2 . . 4.760 4.323 4.309 4.335 . 0 0 "[ . 1 . 2]" 1
592 1 27 THR HA 1 28 GLY HA3 . . 5.180 4.572 4.528 4.603 . 0 0 "[ . 1 . 2]" 1
593 1 27 THR HA 1 31 ARG H . . 5.500 5.049 4.930 5.133 . 0 0 "[ . 1 . 2]" 1
594 1 27 THR HB 1 28 GLY H . . 4.470 2.046 1.901 2.302 . 0 0 "[ . 1 . 2]" 1
595 1 27 THR HB 1 28 GLY HA2 . . 5.500 4.548 4.517 4.613 . 0 0 "[ . 1 . 2]" 1
596 1 27 THR HB 1 28 GLY HA3 . . 5.500 4.187 4.134 4.278 . 0 0 "[ . 1 . 2]" 1
597 1 27 THR HB 1 29 ASP H . . 4.320 2.535 2.389 2.642 . 0 0 "[ . 1 . 2]" 1
598 1 27 THR HG1 1 29 ASP H . . 4.780 3.020 2.094 4.186 . 0 0 "[ . 1 . 2]" 1
599 1 27 THR HG1 1 31 ARG H . . 4.360 2.710 1.904 3.140 . 0 0 "[ . 1 . 2]" 1
600 1 27 THR MG 1 28 GLY H . . 4.920 3.445 3.412 3.477 . 0 0 "[ . 1 . 2]" 1
601 1 27 THR MG 1 28 GLY HA2 . . 5.500 5.503 5.497 5.518 0.018 17 0 "[ . 1 . 2]" 1
602 1 27 THR MG 1 28 GLY HA3 . . 5.500 5.368 5.331 5.393 . 0 0 "[ . 1 . 2]" 1
603 1 27 THR MG 1 29 ASP H . . 4.930 4.108 4.046 4.164 . 0 0 "[ . 1 . 2]" 1
604 1 27 THR MG 1 29 ASP HB2 . . 5.130 5.083 4.947 5.135 0.005 17 0 "[ . 1 . 2]" 1
605 1 27 THR MG 1 29 ASP HB3 . . 5.130 4.909 4.801 4.973 . 0 0 "[ . 1 . 2]" 1
606 1 27 THR MG 1 31 ARG H . . 4.470 4.455 4.410 4.480 0.010 17 0 "[ . 1 . 2]" 1
607 1 27 THR MG 1 31 ARG HB2 . . 4.940 3.862 3.698 3.999 . 0 0 "[ . 1 . 2]" 1
608 1 27 THR MG 1 31 ARG QB . . 4.190 3.492 3.408 3.608 . 0 0 "[ . 1 . 2]" 1
609 1 27 THR MG 1 31 ARG HB3 . . 4.940 3.991 3.881 4.333 . 0 0 "[ . 1 . 2]" 1
610 1 27 THR MG 1 32 VAL H . . 5.010 4.875 4.601 5.010 0.000 4 0 "[ . 1 . 2]" 1
611 1 27 THR MG 1 32 VAL MG2 . . 4.890 4.815 4.629 4.893 0.003 19 0 "[ . 1 . 2]" 1
612 1 27 THR MG 1 33 PHE QD . . 3.380 2.472 2.126 2.776 . 0 0 "[ . 1 . 2]" 1
613 1 27 THR MG 1 33 PHE QE . . 3.270 2.320 1.928 2.638 . 0 0 "[ . 1 . 2]" 1
614 1 27 THR MG 1 44 TRP HH2 . . 3.470 2.833 1.991 3.399 . 0 0 "[ . 1 . 2]" 1
615 1 27 THR MG 1 44 TRP HZ2 . . 5.190 4.533 3.594 5.179 . 0 0 "[ . 1 . 2]" 1
616 1 27 THR MG 1 44 TRP HZ3 . . 4.660 3.504 3.096 3.926 . 0 0 "[ . 1 . 2]" 1
617 1 28 GLY H 1 29 ASP H . . 4.970 2.464 2.392 2.565 . 0 0 "[ . 1 . 2]" 1
618 1 28 GLY HA2 1 30 GLU H . . 4.680 3.562 3.413 3.683 . 0 0 "[ . 1 . 2]" 1
619 1 29 ASP H 1 30 GLU H . . 3.690 3.168 2.902 3.311 . 0 0 "[ . 1 . 2]" 1
620 1 29 ASP H 1 30 GLU HA . . 5.130 4.985 4.826 5.055 . 0 0 "[ . 1 . 2]" 1
621 1 29 ASP H 1 31 ARG H . . 4.210 3.503 3.304 3.658 . 0 0 "[ . 1 . 2]" 1
622 1 29 ASP HA 1 30 GLU HA . . 5.290 4.824 4.780 4.890 . 0 0 "[ . 1 . 2]" 1
623 1 29 ASP HA 1 30 GLU QG . . 4.700 3.955 2.987 4.418 . 0 0 "[ . 1 . 2]" 1
624 1 29 ASP HB2 1 30 GLU H . . 4.770 4.567 4.498 4.604 . 0 0 "[ . 1 . 2]" 1
625 1 29 ASP HB3 1 30 GLU H . . 4.770 4.231 4.112 4.287 . 0 0 "[ . 1 . 2]" 1
626 1 30 GLU H 1 30 GLU QB . . 3.560 3.158 3.028 3.283 . 0 0 "[ . 1 . 2]" 1
627 1 30 GLU H 1 30 GLU HG2 . . 4.170 3.289 2.639 4.163 . 0 0 "[ . 1 . 2]" 1
628 1 30 GLU H 1 30 GLU QG . . 3.580 2.667 2.452 2.862 . 0 0 "[ . 1 . 2]" 1
629 1 30 GLU H 1 30 GLU HG3 . . 4.170 3.082 2.502 4.091 . 0 0 "[ . 1 . 2]" 1
630 1 30 GLU H 1 31 ARG H . . 3.340 2.953 2.760 3.053 . 0 0 "[ . 1 . 2]" 1
631 1 30 GLU HA 1 30 GLU HG2 . . 3.690 2.588 2.271 3.592 . 0 0 "[ . 1 . 2]" 1
632 1 30 GLU HA 1 30 GLU QG . . 3.100 2.424 2.212 3.241 0.141 17 0 "[ . 1 . 2]" 1
633 1 30 GLU HA 1 30 GLU HG3 . . 3.690 3.163 2.488 3.702 0.012 17 0 "[ . 1 . 2]" 1
634 1 30 GLU HA 1 31 ARG H . . 3.460 2.771 2.724 2.871 . 0 0 "[ . 1 . 2]" 1
635 1 30 GLU QB 1 31 ARG H . . 4.190 3.869 3.815 3.987 . 0 0 "[ . 1 . 2]" 1
636 1 30 GLU HB2 1 31 ARG H . . 4.940 4.280 4.159 4.343 . 0 0 "[ . 1 . 2]" 1
637 1 30 GLU HB3 1 31 ARG H . . 4.940 4.415 4.345 4.658 . 0 0 "[ . 1 . 2]" 1
638 1 31 ARG H 1 31 ARG QB . . 3.160 2.483 2.396 2.588 . 0 0 "[ . 1 . 2]" 1
639 1 31 ARG H 1 31 ARG QD . . 5.310 4.673 4.458 5.027 . 0 0 "[ . 1 . 2]" 1
640 1 31 ARG H 1 31 ARG QG . . 3.620 3.475 3.251 3.557 . 0 0 "[ . 1 . 2]" 1
641 1 31 ARG H 1 32 VAL H . . 4.520 4.452 4.397 4.476 . 0 0 "[ . 1 . 2]" 1
642 1 31 ARG HA 1 32 VAL H . . 2.820 2.440 2.335 2.624 . 0 0 "[ . 1 . 2]" 1
643 1 31 ARG HA 1 32 VAL MG1 . . 4.410 3.592 3.484 3.673 . 0 0 "[ . 1 . 2]" 1
644 1 31 ARG QB 1 31 ARG QD . . 3.110 2.182 2.081 2.295 . 0 0 "[ . 1 . 2]" 1
645 1 31 ARG QB 1 32 VAL H . . 3.570 2.390 1.999 2.638 . 0 0 "[ . 1 . 2]" 1
646 1 31 ARG QB 1 44 TRP HZ3 . . 3.500 2.581 1.982 3.114 . 0 0 "[ . 1 . 2]" 1
647 1 31 ARG HB2 1 32 VAL HA . . 5.500 4.933 4.735 5.026 . 0 0 "[ . 1 . 2]" 1
648 1 31 ARG HB2 1 44 TRP HH2 . . 5.500 4.571 3.623 5.285 . 0 0 "[ . 1 . 2]" 1
649 1 31 ARG HB3 1 32 VAL HA . . 5.500 4.048 3.912 4.194 . 0 0 "[ . 1 . 2]" 1
650 1 31 ARG HB3 1 44 TRP HH2 . . 5.500 4.456 3.668 5.230 . 0 0 "[ . 1 . 2]" 1
651 1 31 ARG QD 1 44 TRP HE3 . . 4.900 3.699 3.262 4.136 . 0 0 "[ . 1 . 2]" 1
652 1 31 ARG QD 1 44 TRP HH2 . . 5.200 4.834 3.893 5.202 0.002 4 0 "[ . 1 . 2]" 1
653 1 31 ARG QD 1 44 TRP HZ3 . . 3.920 3.200 2.653 3.499 . 0 0 "[ . 1 . 2]" 1
654 1 31 ARG HD2 1 32 VAL H . . 4.950 3.990 3.280 4.788 . 0 0 "[ . 1 . 2]" 1
655 1 31 ARG HD2 1 44 TRP HZ3 . . 4.460 3.438 2.675 4.463 0.003 5 0 "[ . 1 . 2]" 1
656 1 31 ARG HD3 1 32 VAL H . . 4.950 3.079 2.464 4.832 . 0 0 "[ . 1 . 2]" 1
657 1 31 ARG HD3 1 44 TRP HZ3 . . 4.460 4.073 3.043 4.462 0.002 12 0 "[ . 1 . 2]" 1
658 1 31 ARG QG 1 32 VAL H . . 4.770 3.749 3.228 4.122 . 0 0 "[ . 1 . 2]" 1
659 1 31 ARG QG 1 44 TRP HZ3 . . 4.830 4.071 3.367 4.740 . 0 0 "[ . 1 . 2]" 1
660 1 31 ARG HG2 1 32 VAL H . . 5.500 3.993 3.313 4.463 . 0 0 "[ . 1 . 2]" 1
661 1 31 ARG HG2 1 44 TRP HZ3 . . 5.500 5.083 4.748 5.502 0.002 6 0 "[ . 1 . 2]" 1
662 1 31 ARG HG3 1 32 VAL H . . 5.500 4.623 4.461 4.843 . 0 0 "[ . 1 . 2]" 1
663 1 31 ARG HG3 1 44 TRP HZ3 . . 5.500 4.375 3.442 5.473 . 0 0 "[ . 1 . 2]" 1
664 1 32 VAL H 1 32 VAL HB . . 3.530 3.409 3.318 3.536 0.006 1 0 "[ . 1 . 2]" 1
665 1 32 VAL H 1 32 VAL MG1 . . 3.620 2.364 2.244 2.563 . 0 0 "[ . 1 . 2]" 1
666 1 32 VAL H 1 32 VAL MG2 . . 4.040 3.936 3.903 3.985 . 0 0 "[ . 1 . 2]" 1
667 1 32 VAL H 1 33 PHE H . . 4.600 4.274 4.179 4.331 . 0 0 "[ . 1 . 2]" 1
668 1 32 VAL H 1 44 TRP HZ3 . . 4.370 4.142 3.233 4.372 0.002 1 0 "[ . 1 . 2]" 1
669 1 32 VAL HA 1 32 VAL MG1 . . 3.360 3.191 3.186 3.198 . 0 0 "[ . 1 . 2]" 1
670 1 32 VAL HA 1 32 VAL MG2 . . 3.410 2.400 2.300 2.450 . 0 0 "[ . 1 . 2]" 1
671 1 32 VAL HA 1 33 PHE H . . 2.900 2.194 2.185 2.216 . 0 0 "[ . 1 . 2]" 1
672 1 32 VAL HA 1 33 PHE QD . . 4.620 3.318 3.037 3.690 . 0 0 "[ . 1 . 2]" 1
673 1 32 VAL HB 1 33 PHE H . . 4.100 4.046 3.968 4.092 . 0 0 "[ . 1 . 2]" 1
674 1 32 VAL HB 1 60 ILE MG . . 4.480 4.027 3.490 4.329 . 0 0 "[ . 1 . 2]" 1
675 1 32 VAL MG1 1 33 PHE H . . 3.930 3.914 3.875 3.932 0.002 13 0 "[ . 1 . 2]" 1
676 1 32 VAL MG1 1 33 PHE HA . . 4.320 3.979 3.928 4.031 . 0 0 "[ . 1 . 2]" 1
677 1 32 VAL MG1 1 60 ILE HA . . 4.210 3.789 3.606 4.009 . 0 0 "[ . 1 . 2]" 1
678 1 32 VAL MG1 1 60 ILE HB . . 4.720 4.463 4.165 4.700 . 0 0 "[ . 1 . 2]" 1
679 1 32 VAL MG1 1 60 ILE MD . . 3.640 3.270 2.942 3.616 . 0 0 "[ . 1 . 2]" 1
680 1 32 VAL MG1 1 60 ILE HG12 . . 4.260 2.509 2.232 2.722 . 0 0 "[ . 1 . 2]" 1
681 1 32 VAL MG1 1 60 ILE QG . . 3.400 2.487 2.218 2.692 . 0 0 "[ . 1 . 2]" 1
682 1 32 VAL MG1 1 60 ILE HG13 . . 4.260 4.100 3.856 4.270 0.010 19 0 "[ . 1 . 2]" 1
683 1 32 VAL MG1 1 60 ILE MG . . 3.210 2.152 1.842 2.438 . 0 0 "[ . 1 . 2]" 1
684 1 32 VAL MG2 1 33 PHE H . . 3.760 2.120 1.950 2.378 . 0 0 "[ . 1 . 2]" 1
685 1 32 VAL MG2 1 33 PHE HA . . 4.800 3.507 3.363 3.643 . 0 0 "[ . 1 . 2]" 1
686 1 32 VAL MG2 1 33 PHE HB3 . . 4.800 4.654 4.599 4.740 . 0 0 "[ . 1 . 2]" 1
687 1 32 VAL MG2 1 33 PHE QD . . 4.880 4.160 3.979 4.407 . 0 0 "[ . 1 . 2]" 1
688 1 32 VAL MG2 1 34 PHE QE . . 5.450 4.613 4.354 4.773 . 0 0 "[ . 1 . 2]" 1
689 1 32 VAL MG2 1 59 ILE MG . . 4.560 4.369 4.204 4.560 0.000 13 0 "[ . 1 . 2]" 1
690 1 32 VAL MG2 1 60 ILE HA . . 4.350 3.704 3.411 4.090 . 0 0 "[ . 1 . 2]" 1
691 1 32 VAL MG2 1 60 ILE HB . . 5.440 5.092 4.731 5.352 . 0 0 "[ . 1 . 2]" 1
692 1 32 VAL MG2 1 60 ILE MD . . 3.930 3.543 3.287 3.871 . 0 0 "[ . 1 . 2]" 1
693 1 32 VAL MG2 1 60 ILE QG . . 3.060 2.481 2.139 2.702 . 0 0 "[ . 1 . 2]" 1
694 1 32 VAL MG2 1 60 ILE MG . . 3.780 3.271 2.717 3.622 . 0 0 "[ . 1 . 2]" 1
695 1 33 PHE H 1 33 PHE QD . . 3.940 2.481 2.215 2.851 . 0 0 "[ . 1 . 2]" 1
696 1 33 PHE HA 1 33 PHE QD . . 4.000 3.722 3.698 3.729 . 0 0 "[ . 1 . 2]" 1
697 1 33 PHE HA 1 34 PHE H . . 3.300 2.454 2.362 2.525 . 0 0 "[ . 1 . 2]" 1
698 1 33 PHE HA 1 34 PHE QD . . 3.990 3.237 2.941 3.992 0.002 4 0 "[ . 1 . 2]" 1
699 1 33 PHE HA 1 34 PHE QE . . 4.860 3.937 3.593 4.622 . 0 0 "[ . 1 . 2]" 1
700 1 33 PHE HA 1 44 TRP HZ3 . . 5.490 5.208 4.567 5.490 . 0 0 "[ . 1 . 2]" 1
701 1 33 PHE HB2 1 34 PHE H . . 3.460 2.351 2.198 2.538 . 0 0 "[ . 1 . 2]" 1
702 1 33 PHE HB2 1 34 PHE QD . . 5.190 4.031 3.727 4.730 . 0 0 "[ . 1 . 2]" 1
703 1 33 PHE HB2 1 43 MET H . . 5.110 4.336 4.083 4.578 . 0 0 "[ . 1 . 2]" 1
704 1 33 PHE HB2 1 44 TRP H . . 5.390 4.808 4.447 5.053 . 0 0 "[ . 1 . 2]" 1
705 1 33 PHE HB2 1 44 TRP HA . . 4.130 2.649 2.438 2.854 . 0 0 "[ . 1 . 2]" 1
706 1 33 PHE HB2 1 44 TRP HB3 . . 5.500 5.239 4.924 5.449 . 0 0 "[ . 1 . 2]" 1
707 1 33 PHE HB2 1 44 TRP HE3 . . 4.600 4.087 3.814 4.404 . 0 0 "[ . 1 . 2]" 1
708 1 33 PHE HB3 1 34 PHE H . . 3.830 3.750 3.636 3.836 0.006 16 0 "[ . 1 . 2]" 1
709 1 33 PHE HB3 1 44 TRP HA . . 4.190 2.909 2.419 3.191 . 0 0 "[ . 1 . 2]" 1
710 1 33 PHE HB3 1 44 TRP HE3 . . 4.640 2.935 2.593 3.281 . 0 0 "[ . 1 . 2]" 1
711 1 33 PHE HB3 1 44 TRP HZ3 . . 4.630 3.416 2.914 3.789 . 0 0 "[ . 1 . 2]" 1
712 1 33 PHE QD 1 34 PHE H . . 3.800 3.137 2.871 3.370 . 0 0 "[ . 1 . 2]" 1
713 1 33 PHE QD 1 35 TYR HA . . 4.470 3.792 3.554 3.921 . 0 0 "[ . 1 . 2]" 1
714 1 33 PHE QD 1 35 TYR HB2 . . 4.120 3.313 2.886 3.552 . 0 0 "[ . 1 . 2]" 1
715 1 33 PHE QD 1 35 TYR HB3 . . 5.030 4.534 3.912 4.850 . 0 0 "[ . 1 . 2]" 1
716 1 33 PHE QD 1 42 SER HA . . 4.220 3.863 3.599 4.061 . 0 0 "[ . 1 . 2]" 1
717 1 33 PHE QD 1 42 SER QB . . 3.630 3.184 2.544 3.635 0.005 7 0 "[ . 1 . 2]" 1
718 1 33 PHE QD 1 43 MET H . . 4.200 3.820 3.341 4.094 . 0 0 "[ . 1 . 2]" 1
719 1 33 PHE QE 1 35 TYR H . . 5.050 4.695 4.279 4.982 . 0 0 "[ . 1 . 2]" 1
720 1 33 PHE QE 1 35 TYR HB2 . . 3.830 2.167 1.999 2.445 . 0 0 "[ . 1 . 2]" 1
721 1 33 PHE QE 1 35 TYR HB3 . . 4.340 3.639 2.956 3.902 . 0 0 "[ . 1 . 2]" 1
722 1 33 PHE QE 1 42 SER HB2 . . 4.680 3.422 2.649 4.608 . 0 0 "[ . 1 . 2]" 1
723 1 33 PHE QE 1 42 SER QB . . 3.930 3.078 2.393 3.589 . 0 0 "[ . 1 . 2]" 1
724 1 33 PHE QE 1 42 SER HB3 . . 4.680 3.801 2.418 4.413 . 0 0 "[ . 1 . 2]" 1
725 1 34 PHE H 1 34 PHE HB2 . . 3.800 2.653 2.574 2.712 . 0 0 "[ . 1 . 2]" 1
726 1 34 PHE H 1 34 PHE HB3 . . 3.990 3.712 3.674 3.753 . 0 0 "[ . 1 . 2]" 1
727 1 34 PHE H 1 34 PHE QD . . 3.470 2.131 1.898 2.955 . 0 0 "[ . 1 . 2]" 1
728 1 34 PHE H 1 34 PHE QE . . 5.250 4.168 3.989 4.686 . 0 0 "[ . 1 . 2]" 1
729 1 34 PHE H 1 43 MET H . . 4.010 3.860 3.514 4.016 0.006 17 0 "[ . 1 . 2]" 1
730 1 34 PHE HA 1 34 PHE QD . . 3.620 3.113 2.626 3.237 . 0 0 "[ . 1 . 2]" 1
731 1 34 PHE HA 1 35 TYR H . . 3.040 2.157 2.138 2.176 . 0 0 "[ . 1 . 2]" 1
732 1 34 PHE HA 1 35 TYR HB3 . . 5.080 4.399 4.318 4.510 . 0 0 "[ . 1 . 2]" 1
733 1 34 PHE HA 1 50 LEU MD1 . . 5.060 4.446 4.315 4.583 . 0 0 "[ . 1 . 2]" 1
734 1 34 PHE HB2 1 35 TYR H . . 4.440 4.074 3.965 4.235 . 0 0 "[ . 1 . 2]" 1
735 1 34 PHE HB2 1 43 MET H . . 4.690 3.698 3.225 3.998 . 0 0 "[ . 1 . 2]" 1
736 1 34 PHE HB2 1 43 MET HB2 . . 3.860 3.650 3.425 3.838 . 0 0 "[ . 1 . 2]" 1
737 1 34 PHE HB2 1 47 PRO HD2 . . 4.280 3.428 3.265 3.664 . 0 0 "[ . 1 . 2]" 1
738 1 34 PHE HB2 1 47 PRO HD3 . . 4.400 3.001 2.512 3.361 . 0 0 "[ . 1 . 2]" 1
739 1 34 PHE HB2 1 47 PRO HG2 . . 4.800 4.456 4.273 4.611 . 0 0 "[ . 1 . 2]" 1
740 1 34 PHE HB2 1 47 PRO HG3 . . 4.500 3.443 3.275 3.607 . 0 0 "[ . 1 . 2]" 1
741 1 34 PHE HB2 1 50 LEU MD1 . . 4.870 3.669 3.287 3.876 . 0 0 "[ . 1 . 2]" 1
742 1 34 PHE HB3 1 35 TYR H . . 3.950 3.276 3.168 3.487 . 0 0 "[ . 1 . 2]" 1
743 1 34 PHE HB3 1 43 MET HB2 . . 5.500 5.364 5.093 5.503 0.003 3 0 "[ . 1 . 2]" 1
744 1 34 PHE HB3 1 47 PRO HG2 . . 4.710 4.527 4.301 4.711 0.001 4 0 "[ . 1 . 2]" 1
745 1 34 PHE HB3 1 47 PRO HG3 . . 4.450 3.994 3.604 4.286 . 0 0 "[ . 1 . 2]" 1
746 1 34 PHE HB3 1 50 LEU MD1 . . 4.210 2.772 2.588 2.904 . 0 0 "[ . 1 . 2]" 1
747 1 34 PHE HB3 1 56 VAL MG2 . . 5.500 4.846 4.634 5.065 . 0 0 "[ . 1 . 2]" 1
748 1 34 PHE QD 1 35 TYR H . . 4.610 4.496 4.184 4.605 . 0 0 "[ . 1 . 2]" 1
749 1 34 PHE QD 1 43 MET H . . 5.500 4.737 4.396 4.945 . 0 0 "[ . 1 . 2]" 1
750 1 34 PHE QD 1 43 MET HB2 . . 4.400 3.795 3.577 3.946 . 0 0 "[ . 1 . 2]" 1
751 1 34 PHE QD 1 43 MET HB3 . . 5.270 5.221 5.012 5.273 0.003 5 0 "[ . 1 . 2]" 1
752 1 34 PHE QD 1 46 ARG HA . . 3.910 3.044 2.378 3.205 . 0 0 "[ . 1 . 2]" 1
753 1 34 PHE QD 1 46 ARG HD3 . . 5.500 5.461 5.350 5.504 0.004 15 0 "[ . 1 . 2]" 1
754 1 34 PHE QD 1 47 PRO HD2 . . 4.250 3.338 2.468 3.477 . 0 0 "[ . 1 . 2]" 1
755 1 34 PHE QD 1 47 PRO HD3 . . 3.940 3.181 2.545 3.470 . 0 0 "[ . 1 . 2]" 1
756 1 34 PHE QD 1 47 PRO HG2 . . 4.790 4.712 4.352 4.797 0.007 16 0 "[ . 1 . 2]" 1
757 1 34 PHE QD 1 47 PRO HG3 . . 4.780 4.533 3.999 4.783 0.003 15 0 "[ . 1 . 2]" 1
758 1 34 PHE QD 1 50 LEU MD1 . . 3.530 2.148 1.930 2.647 . 0 0 "[ . 1 . 2]" 1
759 1 34 PHE QE 1 46 ARG H . . 3.830 3.122 2.846 3.768 . 0 0 "[ . 1 . 2]" 1
760 1 34 PHE QE 1 46 ARG HA . . 3.900 2.703 2.029 2.908 . 0 0 "[ . 1 . 2]" 1
761 1 34 PHE QE 1 46 ARG HB2 . . 4.760 2.752 2.347 3.046 . 0 0 "[ . 1 . 2]" 1
762 1 34 PHE QE 1 46 ARG QB . . 4.110 2.713 2.322 2.994 . 0 0 "[ . 1 . 2]" 1
763 1 34 PHE QE 1 46 ARG HB3 . . 4.760 4.126 3.693 4.414 . 0 0 "[ . 1 . 2]" 1
764 1 34 PHE QE 1 46 ARG HD2 . . 5.500 5.070 4.487 5.372 . 0 0 "[ . 1 . 2]" 1
765 1 34 PHE QE 1 46 ARG HD3 . . 5.120 4.647 4.414 4.926 . 0 0 "[ . 1 . 2]" 1
766 1 34 PHE QE 1 46 ARG HG2 . . 4.240 2.951 2.269 3.127 . 0 0 "[ . 1 . 2]" 1
767 1 34 PHE QE 1 46 ARG HG3 . . 4.650 3.257 2.871 3.674 . 0 0 "[ . 1 . 2]" 1
768 1 34 PHE QE 1 47 PRO HD2 . . 4.530 3.872 3.260 4.027 . 0 0 "[ . 1 . 2]" 1
769 1 34 PHE QE 1 50 LEU MD1 . . 3.810 2.693 2.412 3.199 . 0 0 "[ . 1 . 2]" 1
770 1 34 PHE QE 1 56 VAL HA . . 5.020 4.582 3.757 4.950 . 0 0 "[ . 1 . 2]" 1
771 1 34 PHE QE 1 56 VAL MG2 . . 3.020 1.954 1.842 2.178 . 0 0 "[ . 1 . 2]" 1
772 1 34 PHE QE 1 60 ILE HB . . 5.500 5.367 5.142 5.497 . 0 0 "[ . 1 . 2]" 1
773 1 34 PHE QE 1 60 ILE MD . . 3.110 2.188 1.970 2.370 . 0 0 "[ . 1 . 2]" 1
774 1 34 PHE QE 1 60 ILE QG . . 4.990 3.663 3.107 3.928 . 0 0 "[ . 1 . 2]" 1
775 1 34 PHE HZ 1 46 ARG HB2 . . 5.330 2.550 2.001 3.822 . 0 0 "[ . 1 . 2]" 1
776 1 34 PHE HZ 1 46 ARG QB . . 4.590 2.523 1.992 3.720 . 0 0 "[ . 1 . 2]" 1
777 1 34 PHE HZ 1 46 ARG HB3 . . 5.330 4.145 3.702 5.108 . 0 0 "[ . 1 . 2]" 1
778 1 34 PHE HZ 1 46 ARG HD2 . . 5.500 5.226 5.057 5.497 . 0 0 "[ . 1 . 2]" 1
779 1 34 PHE HZ 1 46 ARG HD3 . . 5.500 5.057 4.657 5.476 . 0 0 "[ . 1 . 2]" 1
780 1 34 PHE HZ 1 46 ARG HG2 . . 4.100 3.046 2.650 3.547 . 0 0 "[ . 1 . 2]" 1
781 1 34 PHE HZ 1 46 ARG HG3 . . 4.910 2.800 2.612 3.090 . 0 0 "[ . 1 . 2]" 1
782 1 34 PHE HZ 1 60 ILE HB . . 5.500 5.447 5.042 5.502 0.002 2 0 "[ . 1 . 2]" 1
783 1 34 PHE HZ 1 60 ILE MD . . 3.460 2.227 1.900 2.422 . 0 0 "[ . 1 . 2]" 1
784 1 34 PHE HZ 1 60 ILE QG . . 5.340 4.105 3.714 4.338 . 0 0 "[ . 1 . 2]" 1
785 1 35 TYR H 1 35 TYR HB2 . . 3.870 3.224 3.001 3.366 . 0 0 "[ . 1 . 2]" 1
786 1 35 TYR H 1 35 TYR HB3 . . 3.670 2.519 2.470 2.580 . 0 0 "[ . 1 . 2]" 1
787 1 35 TYR H 1 35 TYR QD . . 4.460 4.214 4.103 4.288 . 0 0 "[ . 1 . 2]" 1
788 1 35 TYR HA 1 35 TYR QD . . 3.380 2.501 2.350 2.767 . 0 0 "[ . 1 . 2]" 1
789 1 35 TYR HA 1 36 ASN H . . 3.160 2.282 2.175 2.330 . 0 0 "[ . 1 . 2]" 1
790 1 35 TYR HA 1 36 ASN HB2 . . 5.500 4.273 4.231 4.375 . 0 0 "[ . 1 . 2]" 1
791 1 35 TYR HA 1 42 SER HA . . 3.380 2.415 2.234 2.549 . 0 0 "[ . 1 . 2]" 1
792 1 35 TYR HA 1 42 SER QB . . 4.560 3.239 2.897 4.256 . 0 0 "[ . 1 . 2]" 1
793 1 35 TYR HA 1 43 MET H . . 4.570 3.748 3.495 3.998 . 0 0 "[ . 1 . 2]" 1
794 1 35 TYR HB2 1 36 ASN H . . 4.550 3.818 3.751 3.998 . 0 0 "[ . 1 . 2]" 1
795 1 35 TYR HB2 1 42 SER HA . . 4.540 3.993 3.574 4.310 . 0 0 "[ . 1 . 2]" 1
796 1 35 TYR HB3 1 36 ASN H . . 4.880 3.974 3.841 4.241 . 0 0 "[ . 1 . 2]" 1
797 1 35 TYR HB3 1 42 SER HA . . 5.410 5.221 4.978 5.412 0.002 4 0 "[ . 1 . 2]" 1
798 1 35 TYR QD 1 36 ASN H . . 3.730 2.387 2.109 2.971 . 0 0 "[ . 1 . 2]" 1
799 1 35 TYR QD 1 36 ASN HA . . 4.980 4.325 4.268 4.442 . 0 0 "[ . 1 . 2]" 1
800 1 35 TYR QD 1 37 PRO HA . . 4.520 4.448 4.313 4.535 0.015 5 0 "[ . 1 . 2]" 1
801 1 35 TYR QD 1 37 PRO HB3 . . 4.340 3.867 3.667 4.014 . 0 0 "[ . 1 . 2]" 1
802 1 35 TYR QD 1 37 PRO HD2 . . 4.510 4.427 4.302 4.524 0.014 16 0 "[ . 1 . 2]" 1
803 1 35 TYR QD 1 37 PRO HD3 . . 4.460 2.768 2.597 2.901 . 0 0 "[ . 1 . 2]" 1
804 1 35 TYR QD 1 37 PRO HG3 . . 4.420 4.043 3.944 4.151 . 0 0 "[ . 1 . 2]" 1
805 1 35 TYR QD 1 42 SER HA . . 3.720 3.169 2.838 3.580 . 0 0 "[ . 1 . 2]" 1
806 1 35 TYR QD 1 42 SER HB2 . . 4.120 3.463 3.092 4.116 . 0 0 "[ . 1 . 2]" 1
807 1 35 TYR QD 1 42 SER QB . . 3.480 2.256 1.977 3.491 0.011 7 0 "[ . 1 . 2]" 1
808 1 35 TYR QD 1 42 SER HB3 . . 4.120 2.316 1.997 4.132 0.012 7 0 "[ . 1 . 2]" 1
809 1 35 TYR QE 1 37 PRO HA . . 3.330 2.976 2.771 3.093 . 0 0 "[ . 1 . 2]" 1
810 1 35 TYR QE 1 37 PRO HB2 . . 4.040 3.798 3.702 4.001 . 0 0 "[ . 1 . 2]" 1
811 1 35 TYR QE 1 37 PRO HB3 . . 3.570 2.074 1.996 2.294 . 0 0 "[ . 1 . 2]" 1
812 1 35 TYR QE 1 37 PRO HD2 . . 4.910 4.623 4.468 4.826 . 0 0 "[ . 1 . 2]" 1
813 1 35 TYR QE 1 37 PRO HG3 . . 4.000 3.550 3.308 3.861 . 0 0 "[ . 1 . 2]" 1
814 1 35 TYR QE 1 40 ARG H . . 4.870 4.554 4.309 4.801 . 0 0 "[ . 1 . 2]" 1
815 1 35 TYR QE 1 40 ARG HA . . 3.710 2.728 2.508 2.943 . 0 0 "[ . 1 . 2]" 1
816 1 35 TYR QE 1 40 ARG HB2 . . 5.430 5.380 5.205 5.439 0.009 19 0 "[ . 1 . 2]" 1
817 1 35 TYR QE 1 40 ARG HB3 . . 4.290 4.230 3.986 4.304 0.014 16 0 "[ . 1 . 2]" 1
818 1 35 TYR QE 1 40 ARG HG2 . . 4.520 4.458 4.233 4.524 0.004 6 0 "[ . 1 . 2]" 1
819 1 35 TYR QE 1 41 LEU H . . 4.480 4.084 3.645 4.394 . 0 0 "[ . 1 . 2]" 1
820 1 35 TYR QE 1 42 SER QB . . 5.110 3.691 3.326 4.783 . 0 0 "[ . 1 . 2]" 1
821 1 36 ASN H 1 36 ASN HB2 . . 3.760 3.042 2.827 3.128 . 0 0 "[ . 1 . 2]" 1
822 1 36 ASN H 1 36 ASN HB3 . . 3.600 2.790 2.649 2.838 . 0 0 "[ . 1 . 2]" 1
823 1 36 ASN H 1 37 PRO HD2 . . 5.250 4.454 4.414 4.584 . 0 0 "[ . 1 . 2]" 1
824 1 36 ASN H 1 40 ARG HA . . 5.500 4.498 4.232 4.749 . 0 0 "[ . 1 . 2]" 1
825 1 36 ASN H 1 41 LEU H . . 4.130 3.328 3.090 3.531 . 0 0 "[ . 1 . 2]" 1
826 1 36 ASN H 1 41 LEU HB3 . . 5.500 4.041 3.565 4.360 . 0 0 "[ . 1 . 2]" 1
827 1 36 ASN H 1 42 SER HA . . 4.080 3.580 3.446 3.693 . 0 0 "[ . 1 . 2]" 1
828 1 36 ASN HA 1 37 PRO HD2 . . 3.130 1.915 1.913 1.916 . 0 0 "[ . 1 . 2]" 1
829 1 36 ASN HA 1 37 PRO HD3 . . 3.270 2.538 2.475 2.546 . 0 0 "[ . 1 . 2]" 1
830 1 36 ASN HA 1 38 THR H . . 4.420 3.278 3.272 3.327 . 0 0 "[ . 1 . 2]" 1
831 1 36 ASN HB2 1 37 PRO HD2 . . 4.600 4.345 4.321 4.367 . 0 0 "[ . 1 . 2]" 1
832 1 36 ASN HB2 1 37 PRO HD3 . . 4.990 4.966 4.957 4.974 . 0 0 "[ . 1 . 2]" 1
833 1 36 ASN HB2 1 39 THR H . . 5.040 4.315 4.274 4.394 . 0 0 "[ . 1 . 2]" 1
834 1 36 ASN HB2 1 39 THR HG1 . . 4.850 3.723 3.334 4.115 . 0 0 "[ . 1 . 2]" 1
835 1 36 ASN HB2 1 39 THR MG . . 4.810 4.783 4.681 4.815 0.005 7 0 "[ . 1 . 2]" 1
836 1 36 ASN HB2 1 41 LEU H . . 4.300 3.800 3.587 4.036 . 0 0 "[ . 1 . 2]" 1
837 1 36 ASN HB2 1 41 LEU HB2 . . 4.720 4.398 4.176 4.648 . 0 0 "[ . 1 . 2]" 1
838 1 36 ASN HB2 1 41 LEU HB3 . . 5.500 3.147 2.950 3.274 . 0 0 "[ . 1 . 2]" 1
839 1 36 ASN HB2 1 41 LEU MD1 . . 5.450 4.327 4.004 4.646 . 0 0 "[ . 1 . 2]" 1
840 1 36 ASN HB3 1 39 THR H . . 4.360 3.046 2.864 3.124 . 0 0 "[ . 1 . 2]" 1
841 1 36 ASN HB3 1 39 THR HB . . 4.960 4.670 4.363 4.895 . 0 0 "[ . 1 . 2]" 1
842 1 36 ASN HB3 1 39 THR HG1 . . 4.520 2.840 2.124 3.263 . 0 0 "[ . 1 . 2]" 1
843 1 36 ASN HB3 1 39 THR MG . . 4.690 4.170 3.980 4.243 . 0 0 "[ . 1 . 2]" 1
844 1 36 ASN HB3 1 40 ARG H . . 4.660 3.882 3.541 4.073 . 0 0 "[ . 1 . 2]" 1
845 1 36 ASN HB3 1 41 LEU H . . 3.740 2.126 1.941 2.462 . 0 0 "[ . 1 . 2]" 1
846 1 36 ASN HB3 1 41 LEU HB2 . . 4.280 3.246 2.999 3.439 . 0 0 "[ . 1 . 2]" 1
847 1 36 ASN HB3 1 41 LEU HB3 . . 4.320 2.562 2.397 2.719 . 0 0 "[ . 1 . 2]" 1
848 1 36 ASN HB3 1 41 LEU MD2 . . 5.500 4.946 4.818 5.115 . 0 0 "[ . 1 . 2]" 1
849 1 36 ASN HD21 1 39 THR MG . . 4.720 3.844 3.339 4.102 . 0 0 "[ . 1 . 2]" 1
850 1 36 ASN HD22 1 38 THR HB . . 4.460 3.203 3.064 3.275 . 0 0 "[ . 1 . 2]" 1
851 1 36 ASN HD22 1 39 THR MG . . 3.660 2.900 2.494 3.185 . 0 0 "[ . 1 . 2]" 1
852 1 37 PRO HA 1 40 ARG H . . 4.050 3.552 3.441 3.637 . 0 0 "[ . 1 . 2]" 1
853 1 37 PRO HA 1 40 ARG HA . . 4.070 3.565 3.462 3.622 . 0 0 "[ . 1 . 2]" 1
854 1 37 PRO HA 1 40 ARG HG2 . . 4.440 4.144 3.914 4.395 . 0 0 "[ . 1 . 2]" 1
855 1 37 PRO HB2 1 38 THR H . . 3.900 3.886 3.851 3.905 0.005 16 0 "[ . 1 . 2]" 1
856 1 37 PRO HB2 1 38 THR HA . . 4.500 4.330 4.309 4.340 . 0 0 "[ . 1 . 2]" 1
857 1 37 PRO HB3 1 38 THR H . . 4.600 4.459 4.440 4.470 . 0 0 "[ . 1 . 2]" 1
858 1 37 PRO HD2 1 38 THR H . . 4.120 2.930 2.892 2.951 . 0 0 "[ . 1 . 2]" 1
859 1 37 PRO HD3 1 38 THR H . . 4.160 3.991 3.971 4.003 . 0 0 "[ . 1 . 2]" 1
860 1 37 PRO HG3 1 38 THR H . . 4.730 4.505 4.458 4.532 . 0 0 "[ . 1 . 2]" 1
861 1 38 THR H 1 38 THR HB . . 3.110 2.600 2.542 2.676 . 0 0 "[ . 1 . 2]" 1
862 1 38 THR H 1 38 THR MG . . 4.000 3.821 3.808 3.830 . 0 0 "[ . 1 . 2]" 1
863 1 38 THR H 1 39 THR H . . 3.050 2.187 2.140 2.243 . 0 0 "[ . 1 . 2]" 1
864 1 38 THR H 1 39 THR MG . . 4.530 4.242 4.123 4.371 . 0 0 "[ . 1 . 2]" 1
865 1 38 THR HA 1 38 THR MG . . 2.920 2.327 2.195 2.440 . 0 0 "[ . 1 . 2]" 1
866 1 38 THR HA 1 39 THR MG . . 4.680 4.382 4.272 4.513 . 0 0 "[ . 1 . 2]" 1
867 1 38 THR HB 1 39 THR H . . 3.320 2.789 2.715 2.900 . 0 0 "[ . 1 . 2]" 1
868 1 38 THR HB 1 39 THR MG . . 3.530 2.894 2.677 3.104 . 0 0 "[ . 1 . 2]" 1
869 1 38 THR HB 1 40 ARG H . . 5.040 4.802 4.719 4.863 . 0 0 "[ . 1 . 2]" 1
870 1 38 THR MG 1 39 THR H . . 3.880 3.734 3.628 3.839 . 0 0 "[ . 1 . 2]" 1
871 1 39 THR H 1 39 THR HB . . 4.130 3.794 3.758 3.817 . 0 0 "[ . 1 . 2]" 1
872 1 39 THR H 1 39 THR HG1 . . 4.290 3.158 2.157 3.735 . 0 0 "[ . 1 . 2]" 1
873 1 39 THR H 1 39 THR MG . . 3.140 2.873 2.734 3.053 . 0 0 "[ . 1 . 2]" 1
874 1 39 THR H 1 40 ARG H . . 3.020 2.234 2.073 2.360 . 0 0 "[ . 1 . 2]" 1
875 1 39 THR H 1 40 ARG HA . . 4.410 4.248 4.193 4.288 . 0 0 "[ . 1 . 2]" 1
876 1 39 THR H 1 41 LEU H . . 3.920 3.334 3.216 3.450 . 0 0 "[ . 1 . 2]" 1
877 1 39 THR H 1 41 LEU HB2 . . 4.770 4.647 4.514 4.766 . 0 0 "[ . 1 . 2]" 1
878 1 39 THR HA 1 39 THR MG . . 2.910 2.294 2.192 2.375 . 0 0 "[ . 1 . 2]" 1
879 1 39 THR HA 1 40 ARG HG3 . . 4.420 3.906 3.631 4.176 . 0 0 "[ . 1 . 2]" 1
880 1 39 THR HB 1 40 ARG H . . 4.570 4.420 4.325 4.480 . 0 0 "[ . 1 . 2]" 1
881 1 39 THR HB 1 41 LEU H . . 4.270 4.237 4.166 4.275 0.005 6 0 "[ . 1 . 2]" 1
882 1 39 THR HB 1 41 LEU HB3 . . 5.140 4.654 4.431 4.874 . 0 0 "[ . 1 . 2]" 1
883 1 39 THR HB 1 41 LEU HG . . 5.280 4.903 4.745 5.074 . 0 0 "[ . 1 . 2]" 1
884 1 39 THR HG1 1 39 THR MG . . 3.140 2.318 1.958 2.967 . 0 0 "[ . 1 . 2]" 1
885 1 39 THR HG1 1 41 LEU H . . 4.810 3.431 2.201 3.961 . 0 0 "[ . 1 . 2]" 1
886 1 39 THR MG 1 40 ARG H . . 4.310 4.256 4.203 4.305 . 0 0 "[ . 1 . 2]" 1
887 1 39 THR MG 1 41 LEU HB2 . . 4.360 4.241 4.095 4.368 0.008 7 0 "[ . 1 . 2]" 1
888 1 40 ARG H 1 40 ARG HD2 . . 5.500 5.129 4.841 5.384 . 0 0 "[ . 1 . 2]" 1
889 1 40 ARG H 1 40 ARG HD3 . . 5.500 5.163 5.020 5.324 . 0 0 "[ . 1 . 2]" 1
890 1 40 ARG H 1 40 ARG HG2 . . 4.190 3.088 2.796 3.389 . 0 0 "[ . 1 . 2]" 1
891 1 40 ARG H 1 40 ARG HG3 . . 3.750 2.898 2.651 3.222 . 0 0 "[ . 1 . 2]" 1
892 1 40 ARG H 1 41 LEU H . . 3.250 2.874 2.720 2.943 . 0 0 "[ . 1 . 2]" 1
893 1 40 ARG HA 1 40 ARG HD2 . . 5.500 4.482 3.839 4.861 . 0 0 "[ . 1 . 2]" 1
894 1 40 ARG HA 1 40 ARG QD . . 4.730 3.934 3.654 4.268 . 0 0 "[ . 1 . 2]" 1
895 1 40 ARG HA 1 40 ARG HD3 . . 5.500 4.445 3.865 4.885 . 0 0 "[ . 1 . 2]" 1
896 1 40 ARG HA 1 40 ARG HG2 . . 3.510 2.483 2.348 2.627 . 0 0 "[ . 1 . 2]" 1
897 1 40 ARG HA 1 40 ARG HG3 . . 3.750 3.284 3.081 3.465 . 0 0 "[ . 1 . 2]" 1
898 1 40 ARG HA 1 41 LEU H . . 3.520 2.837 2.766 2.920 . 0 0 "[ . 1 . 2]" 1
899 1 40 ARG HB2 1 40 ARG HD2 . . 4.130 3.076 2.556 3.882 . 0 0 "[ . 1 . 2]" 1
900 1 40 ARG HB2 1 40 ARG QD . . 3.480 2.714 2.414 3.188 . 0 0 "[ . 1 . 2]" 1
901 1 40 ARG HB2 1 40 ARG HD3 . . 4.130 3.288 2.561 3.923 . 0 0 "[ . 1 . 2]" 1
902 1 40 ARG HB2 1 41 LEU H . . 4.550 4.185 4.099 4.249 . 0 0 "[ . 1 . 2]" 1
903 1 40 ARG HB3 1 40 ARG QD . . 3.720 2.348 2.094 2.883 . 0 0 "[ . 1 . 2]" 1
904 1 41 LEU H 1 41 LEU HB2 . . 3.200 2.582 2.468 2.682 . 0 0 "[ . 1 . 2]" 1
905 1 41 LEU H 1 41 LEU HB3 . . 3.490 2.797 2.731 2.849 . 0 0 "[ . 1 . 2]" 1
906 1 41 LEU H 1 41 LEU MD2 . . 4.290 3.967 3.860 4.124 . 0 0 "[ . 1 . 2]" 1
907 1 41 LEU H 1 41 LEU HG . . 4.910 4.760 4.679 4.820 . 0 0 "[ . 1 . 2]" 1
908 1 41 LEU H 1 42 SER H . . 4.840 4.459 4.420 4.509 . 0 0 "[ . 1 . 2]" 1
909 1 41 LEU HA 1 41 LEU MD1 . . 3.450 2.724 2.389 2.964 . 0 0 "[ . 1 . 2]" 1
910 1 41 LEU HA 1 41 LEU MD2 . . 3.440 2.007 1.923 2.097 . 0 0 "[ . 1 . 2]" 1
911 1 41 LEU HA 1 41 LEU HG . . 4.020 3.678 3.631 3.719 . 0 0 "[ . 1 . 2]" 1
912 1 41 LEU HA 1 42 SER H . . 2.870 2.166 2.153 2.190 . 0 0 "[ . 1 . 2]" 1
913 1 41 LEU HB2 1 41 LEU MD1 . . 3.560 3.180 3.162 3.194 . 0 0 "[ . 1 . 2]" 1
914 1 41 LEU HB2 1 42 SER H . . 4.470 4.339 4.268 4.390 . 0 0 "[ . 1 . 2]" 1
915 1 41 LEU HB3 1 41 LEU MD1 . . 3.270 2.248 2.137 2.377 . 0 0 "[ . 1 . 2]" 1
916 1 41 LEU HB3 1 42 SER H . . 4.000 3.890 3.768 3.980 . 0 0 "[ . 1 . 2]" 1
917 1 41 LEU HB3 1 42 SER HA . . 5.100 4.406 4.321 4.492 . 0 0 "[ . 1 . 2]" 1
918 1 41 LEU MD1 1 42 SER H . . 3.700 2.096 1.881 2.473 . 0 0 "[ . 1 . 2]" 1
919 1 41 LEU MD1 1 42 SER HA . . 5.040 3.154 3.050 3.289 . 0 0 "[ . 1 . 2]" 1
920 1 41 LEU MD1 1 43 MET HB2 . . 5.270 3.919 3.752 4.096 . 0 0 "[ . 1 . 2]" 1
921 1 41 LEU MD1 1 43 MET HB3 . . 4.560 4.001 3.923 4.103 . 0 0 "[ . 1 . 2]" 1
922 1 41 LEU MD1 1 43 MET ME . . 3.890 3.753 3.576 3.884 . 0 0 "[ . 1 . 2]" 1
923 1 41 LEU MD1 1 43 MET HG2 . . 4.210 1.917 1.838 2.041 . 0 0 "[ . 1 . 2]" 1
924 1 41 LEU MD1 1 43 MET HG3 . . 4.100 2.148 2.006 2.311 . 0 0 "[ . 1 . 2]" 1
925 1 41 LEU MD2 1 42 SER H . . 3.430 2.785 2.363 3.307 . 0 0 "[ . 1 . 2]" 1
926 1 41 LEU MD2 1 43 MET HG2 . . 4.390 3.860 3.565 4.193 . 0 0 "[ . 1 . 2]" 1
927 1 41 LEU HG 1 42 SER H . . 4.590 4.533 4.383 4.591 0.001 11 0 "[ . 1 . 2]" 1
928 1 41 LEU HG 1 43 MET HG2 . . 4.870 4.371 4.245 4.514 . 0 0 "[ . 1 . 2]" 1
929 1 41 LEU HG 1 43 MET HG3 . . 4.640 4.431 4.241 4.642 0.002 7 0 "[ . 1 . 2]" 1
930 1 42 SER H 1 42 SER HB2 . . 3.970 3.712 2.591 3.893 . 0 0 "[ . 1 . 2]" 1
931 1 42 SER H 1 42 SER QB . . 3.400 3.019 2.540 3.194 . 0 0 "[ . 1 . 2]" 1
932 1 42 SER H 1 42 SER HB3 . . 3.970 3.300 3.010 3.899 . 0 0 "[ . 1 . 2]" 1
933 1 42 SER HA 1 43 MET H . . 3.030 2.149 2.139 2.162 . 0 0 "[ . 1 . 2]" 1
934 1 42 SER HA 1 43 MET HB2 . . 5.110 4.865 4.730 4.974 . 0 0 "[ . 1 . 2]" 1
935 1 42 SER HA 1 43 MET HG2 . . 5.000 4.228 4.022 4.465 . 0 0 "[ . 1 . 2]" 1
936 1 42 SER HA 1 43 MET HG3 . . 5.090 4.063 3.829 4.171 . 0 0 "[ . 1 . 2]" 1
937 1 42 SER QB 1 43 MET H . . 3.710 3.465 3.218 3.568 . 0 0 "[ . 1 . 2]" 1
938 1 42 SER HB2 1 43 MET H . . 4.460 3.726 3.336 4.471 0.011 7 0 "[ . 1 . 2]" 1
939 1 42 SER HB3 1 43 MET H . . 4.460 4.287 3.539 4.463 0.003 10 0 "[ . 1 . 2]" 1
940 1 43 MET H 1 43 MET HB2 . . 3.960 2.773 2.656 2.886 . 0 0 "[ . 1 . 2]" 1
941 1 43 MET H 1 43 MET ME . . 4.770 4.360 4.230 4.451 . 0 0 "[ . 1 . 2]" 1
942 1 43 MET H 1 43 MET HG2 . . 4.010 3.073 2.875 3.294 . 0 0 "[ . 1 . 2]" 1
943 1 43 MET H 1 43 MET HG3 . . 4.240 2.677 2.547 2.839 . 0 0 "[ . 1 . 2]" 1
944 1 43 MET HA 1 43 MET ME . . 4.350 4.066 3.930 4.156 . 0 0 "[ . 1 . 2]" 1
945 1 43 MET HA 1 43 MET HG2 . . 3.820 2.626 2.500 2.723 . 0 0 "[ . 1 . 2]" 1
946 1 43 MET HA 1 43 MET HG3 . . 4.090 3.609 3.524 3.694 . 0 0 "[ . 1 . 2]" 1
947 1 43 MET HA 1 44 TRP H . . 3.040 2.393 2.182 2.540 . 0 0 "[ . 1 . 2]" 1
948 1 43 MET HA 1 44 TRP HB2 . . 4.640 4.383 4.314 4.450 . 0 0 "[ . 1 . 2]" 1
949 1 43 MET HB2 1 44 TRP H . . 4.180 3.394 3.143 4.010 . 0 0 "[ . 1 . 2]" 1
950 1 43 MET HB2 1 45 ASP H . . 4.120 2.948 2.648 3.216 . 0 0 "[ . 1 . 2]" 1
951 1 43 MET HB2 1 47 PRO HG3 . . 4.620 4.145 3.660 4.496 . 0 0 "[ . 1 . 2]" 1
952 1 43 MET HB3 1 43 MET ME . . 2.950 2.054 1.911 2.166 . 0 0 "[ . 1 . 2]" 1
953 1 43 MET HB3 1 44 TRP H . . 4.070 2.577 2.246 3.122 . 0 0 "[ . 1 . 2]" 1
954 1 43 MET HB3 1 45 ASP H . . 4.000 2.748 2.585 2.919 . 0 0 "[ . 1 . 2]" 1
955 1 43 MET ME 1 43 MET HG3 . . 3.400 2.724 2.652 2.831 . 0 0 "[ . 1 . 2]" 1
956 1 43 MET ME 1 44 TRP H . . 4.940 3.992 3.637 4.449 . 0 0 "[ . 1 . 2]" 1
957 1 43 MET ME 1 45 ASP H . . 3.740 3.154 2.997 3.417 . 0 0 "[ . 1 . 2]" 1
958 1 43 MET ME 1 45 ASP QB . . 3.520 3.126 2.986 3.529 0.009 4 0 "[ . 1 . 2]" 1
959 1 43 MET ME 1 46 ARG H . . 5.150 4.630 4.434 4.903 . 0 0 "[ . 1 . 2]" 1
960 1 43 MET ME 1 46 ARG HA . . 4.780 4.066 3.832 4.676 . 0 0 "[ . 1 . 2]" 1
961 1 43 MET ME 1 47 PRO HA . . 3.090 2.382 2.100 2.606 . 0 0 "[ . 1 . 2]" 1
962 1 43 MET ME 1 47 PRO HB2 . . 4.210 3.345 3.256 3.529 . 0 0 "[ . 1 . 2]" 1
963 1 43 MET ME 1 47 PRO HD3 . . 3.980 2.353 2.016 3.230 . 0 0 "[ . 1 . 2]" 1
964 1 43 MET ME 1 47 PRO HG2 . . 4.540 3.981 3.732 4.525 . 0 0 "[ . 1 . 2]" 1
965 1 43 MET ME 1 47 PRO HG3 . . 3.690 3.008 2.622 3.673 . 0 0 "[ . 1 . 2]" 1
966 1 43 MET ME 1 48 ASP H . . 4.120 4.002 3.772 4.124 0.004 5 0 "[ . 1 . 2]" 1
967 1 43 MET HG2 1 44 TRP H . . 4.870 4.528 4.367 4.712 . 0 0 "[ . 1 . 2]" 1
968 1 43 MET HG2 1 45 ASP H . . 5.400 5.251 5.067 5.361 . 0 0 "[ . 1 . 2]" 1
969 1 43 MET HG2 1 47 PRO HG3 . . 5.500 5.341 5.112 5.502 0.002 5 0 "[ . 1 . 2]" 1
970 1 43 MET HG3 1 45 ASP H . . 5.320 5.136 4.911 5.254 . 0 0 "[ . 1 . 2]" 1
971 1 43 MET HG3 1 47 PRO HB3 . . 4.950 3.792 3.421 4.106 . 0 0 "[ . 1 . 2]" 1
972 1 43 MET HG3 1 47 PRO HG2 . . 5.480 5.386 5.156 5.482 0.002 1 0 "[ . 1 . 2]" 1
973 1 43 MET HG3 1 47 PRO HG3 . . 4.370 3.645 3.396 3.753 . 0 0 "[ . 1 . 2]" 1
974 1 44 TRP H 1 44 TRP HB2 . . 3.530 2.254 2.177 2.325 . 0 0 "[ . 1 . 2]" 1
975 1 44 TRP H 1 44 TRP HB3 . . 3.770 3.512 3.484 3.535 . 0 0 "[ . 1 . 2]" 1
976 1 44 TRP H 1 44 TRP HD1 . . 3.960 3.581 3.090 3.901 . 0 0 "[ . 1 . 2]" 1
977 1 44 TRP H 1 45 ASP H . . 3.340 2.244 2.041 2.535 . 0 0 "[ . 1 . 2]" 1
978 1 44 TRP H 1 45 ASP QB . . 5.340 4.171 3.927 4.981 . 0 0 "[ . 1 . 2]" 1
979 1 44 TRP HA 1 44 TRP HE3 . . 4.130 2.727 2.534 2.940 . 0 0 "[ . 1 . 2]" 1
980 1 44 TRP HB2 1 44 TRP HD1 . . 3.720 2.566 2.550 2.590 . 0 0 "[ . 1 . 2]" 1
981 1 44 TRP HB2 1 45 ASP H . . 3.890 3.398 3.210 3.513 . 0 0 "[ . 1 . 2]" 1
982 1 44 TRP HB3 1 44 TRP HE3 . . 3.870 2.820 2.723 2.910 . 0 0 "[ . 1 . 2]" 1
983 1 44 TRP HB3 1 45 ASP H . . 4.080 3.861 3.696 3.944 . 0 0 "[ . 1 . 2]" 1
984 1 44 TRP HB3 1 45 ASP HA . . 4.480 4.452 4.371 4.482 0.002 11 0 "[ . 1 . 2]" 1
985 1 44 TRP HB3 1 45 ASP QB . . 5.340 4.678 4.121 5.280 . 0 0 "[ . 1 . 2]" 1
986 1 45 ASP H 1 45 ASP HB2 . . 3.680 2.665 2.449 3.569 . 0 0 "[ . 1 . 2]" 1
987 1 45 ASP H 1 45 ASP QB . . 3.090 2.518 2.413 3.093 0.003 4 0 "[ . 1 . 2]" 1
988 1 45 ASP H 1 45 ASP HB3 . . 3.680 3.431 2.719 3.688 0.008 5 0 "[ . 1 . 2]" 1
989 1 45 ASP H 1 46 ARG H . . 4.580 4.457 4.393 4.520 . 0 0 "[ . 1 . 2]" 1
990 1 45 ASP HA 1 46 ARG H . . 3.050 2.531 2.423 2.653 . 0 0 "[ . 1 . 2]" 1
991 1 45 ASP HA 1 46 ARG HA . . 4.590 4.328 4.311 4.361 . 0 0 "[ . 1 . 2]" 1
992 1 45 ASP QB 1 46 ARG H . . 3.120 2.371 1.915 3.081 . 0 0 "[ . 1 . 2]" 1
993 1 45 ASP HB2 1 46 ARG H . . 3.800 3.525 2.024 3.797 . 0 0 "[ . 1 . 2]" 1
994 1 45 ASP HB3 1 46 ARG H . . 3.800 2.488 1.926 3.265 . 0 0 "[ . 1 . 2]" 1
995 1 46 ARG H 1 46 ARG HB2 . . 3.310 2.488 2.346 2.579 . 0 0 "[ . 1 . 2]" 1
996 1 46 ARG H 1 46 ARG QB . . 2.900 2.286 2.227 2.351 . 0 0 "[ . 1 . 2]" 1
997 1 46 ARG H 1 46 ARG HB3 . . 3.310 2.683 2.550 2.852 . 0 0 "[ . 1 . 2]" 1
998 1 46 ARG H 1 46 ARG HG2 . . 4.540 4.400 4.305 4.444 . 0 0 "[ . 1 . 2]" 1
999 1 46 ARG H 1 46 ARG HG3 . . 4.800 4.602 4.512 4.665 . 0 0 "[ . 1 . 2]" 1
1000 1 46 ARG H 1 47 PRO HD2 . . 5.020 4.718 4.684 4.766 . 0 0 "[ . 1 . 2]" 1
1001 1 46 ARG HA 1 46 ARG HD2 . . 4.590 3.612 3.340 4.012 . 0 0 "[ . 1 . 2]" 1
1002 1 46 ARG HA 1 46 ARG HD3 . . 4.300 3.974 3.389 4.300 . 0 0 "[ . 1 . 2]" 1
1003 1 46 ARG HA 1 46 ARG HG2 . . 3.800 2.265 2.165 2.358 . 0 0 "[ . 1 . 2]" 1
1004 1 46 ARG HA 1 46 ARG HG3 . . 4.050 3.492 3.454 3.521 . 0 0 "[ . 1 . 2]" 1
1005 1 46 ARG HA 1 47 PRO HD2 . . 3.160 1.934 1.921 1.969 . 0 0 "[ . 1 . 2]" 1
1006 1 46 ARG HA 1 47 PRO HD3 . . 3.160 2.392 2.334 2.429 . 0 0 "[ . 1 . 2]" 1
1007 1 46 ARG HA 1 47 PRO HG2 . . 4.380 4.139 4.127 4.169 . 0 0 "[ . 1 . 2]" 1
1008 1 46 ARG HA 1 47 PRO HG3 . . 4.380 4.335 4.318 4.348 . 0 0 "[ . 1 . 2]" 1
1009 1 46 ARG HA 1 50 LEU MD1 . . 3.980 3.604 3.432 3.869 . 0 0 "[ . 1 . 2]" 1
1010 1 46 ARG QB 1 46 ARG HD2 . . 3.590 2.296 2.062 2.437 . 0 0 "[ . 1 . 2]" 1
1011 1 46 ARG HB2 1 46 ARG HD2 . . 4.140 3.554 3.397 3.638 . 0 0 "[ . 1 . 2]" 1
1012 1 46 ARG HB3 1 46 ARG HD2 . . 4.140 2.326 2.080 2.476 . 0 0 "[ . 1 . 2]" 1
1013 1 46 ARG HD2 1 47 PRO HD2 . . 4.800 3.905 3.498 4.555 . 0 0 "[ . 1 . 2]" 1
1014 1 46 ARG HD2 1 50 LEU HB2 . . 4.540 3.258 2.900 3.695 . 0 0 "[ . 1 . 2]" 1
1015 1 46 ARG HD2 1 50 LEU HB3 . . 4.360 4.296 4.014 4.393 0.033 16 0 "[ . 1 . 2]" 1
1016 1 46 ARG HD2 1 50 LEU MD1 . . 4.630 4.309 3.964 4.631 0.001 11 0 "[ . 1 . 2]" 1
1017 1 46 ARG HD2 1 51 ILE H . . 4.820 3.272 3.029 3.613 . 0 0 "[ . 1 . 2]" 1
1018 1 46 ARG HD2 1 51 ILE HA . . 3.810 3.467 2.730 3.781 . 0 0 "[ . 1 . 2]" 1
1019 1 46 ARG HD2 1 51 ILE HB . . 4.920 4.589 4.514 4.760 . 0 0 "[ . 1 . 2]" 1
1020 1 46 ARG HD2 1 51 ILE MD . . 4.220 3.458 3.222 3.737 . 0 0 "[ . 1 . 2]" 1
1021 1 46 ARG HD2 1 51 ILE HG12 . . 4.310 2.625 2.131 2.850 . 0 0 "[ . 1 . 2]" 1
1022 1 46 ARG HD2 1 51 ILE HG13 . . 4.710 2.332 2.170 2.663 . 0 0 "[ . 1 . 2]" 1
1023 1 46 ARG HD2 1 51 ILE MG . . 4.590 4.481 4.129 4.601 0.011 18 0 "[ . 1 . 2]" 1
1024 1 46 ARG HD2 1 56 VAL MG2 . . 5.500 4.624 4.220 4.937 . 0 0 "[ . 1 . 2]" 1
1025 1 46 ARG HD3 1 47 PRO HD2 . . 4.610 3.754 3.023 4.170 . 0 0 "[ . 1 . 2]" 1
1026 1 46 ARG HD3 1 47 PRO HG2 . . 5.430 4.379 3.685 4.750 . 0 0 "[ . 1 . 2]" 1
1027 1 46 ARG HD3 1 50 LEU H . . 4.480 3.577 3.389 3.972 . 0 0 "[ . 1 . 2]" 1
1028 1 46 ARG HD3 1 50 LEU HB2 . . 4.480 2.002 1.986 2.041 . 0 0 "[ . 1 . 2]" 1
1029 1 46 ARG HD3 1 50 LEU HB3 . . 4.010 2.747 2.456 3.119 . 0 0 "[ . 1 . 2]" 1
1030 1 46 ARG HD3 1 50 LEU MD1 . . 4.500 3.331 2.965 3.538 . 0 0 "[ . 1 . 2]" 1
1031 1 46 ARG HD3 1 51 ILE H . . 4.640 2.780 2.515 3.290 . 0 0 "[ . 1 . 2]" 1
1032 1 46 ARG HD3 1 51 ILE HA . . 4.110 3.157 2.867 3.631 . 0 0 "[ . 1 . 2]" 1
1033 1 46 ARG HD3 1 51 ILE HG12 . . 4.560 3.474 3.077 4.021 . 0 0 "[ . 1 . 2]" 1
1034 1 46 ARG HD3 1 51 ILE HG13 . . 4.460 2.981 2.710 3.612 . 0 0 "[ . 1 . 2]" 1
1035 1 46 ARG HD3 1 51 ILE MG . . 5.500 4.806 4.546 5.149 . 0 0 "[ . 1 . 2]" 1
1036 1 46 ARG HD3 1 56 VAL MG2 . . 4.150 3.474 2.749 4.083 . 0 0 "[ . 1 . 2]" 1
1037 1 46 ARG HG2 1 47 PRO HD2 . . 3.920 2.576 2.295 2.718 . 0 0 "[ . 1 . 2]" 1
1038 1 46 ARG HG2 1 47 PRO HD3 . . 4.140 4.069 3.853 4.164 0.024 4 0 "[ . 1 . 2]" 1
1039 1 46 ARG HG2 1 50 LEU HB2 . . 4.310 2.916 2.552 3.430 . 0 0 "[ . 1 . 2]" 1
1040 1 46 ARG HG2 1 50 LEU MD1 . . 4.260 2.572 2.318 2.954 . 0 0 "[ . 1 . 2]" 1
1041 1 46 ARG HG2 1 51 ILE HA . . 5.400 5.241 5.094 5.380 . 0 0 "[ . 1 . 2]" 1
1042 1 46 ARG HG3 1 47 PRO HD2 . . 4.540 4.300 4.029 4.424 . 0 0 "[ . 1 . 2]" 1
1043 1 46 ARG HG3 1 50 LEU MD1 . . 4.400 3.757 3.498 4.207 . 0 0 "[ . 1 . 2]" 1
1044 1 46 ARG HG3 1 51 ILE HA . . 4.890 4.800 4.616 4.896 0.006 5 0 "[ . 1 . 2]" 1
1045 1 47 PRO HA 1 48 ASP H . . 2.940 2.320 2.263 2.340 . 0 0 "[ . 1 . 2]" 1
1046 1 47 PRO HA 1 48 ASP QB . . 4.710 4.480 4.157 4.705 . 0 0 "[ . 1 . 2]" 1
1047 1 47 PRO HA 1 49 ASP H . . 4.770 4.389 4.284 4.505 . 0 0 "[ . 1 . 2]" 1
1048 1 47 PRO HA 1 50 LEU H . . 4.890 4.871 4.795 4.898 0.008 15 0 "[ . 1 . 2]" 1
1049 1 47 PRO HB2 1 48 ASP H . . 4.290 2.828 2.770 2.996 . 0 0 "[ . 1 . 2]" 1
1050 1 47 PRO HB2 1 48 ASP HB2 . . 5.500 5.027 4.338 5.524 0.024 16 0 "[ . 1 . 2]" 1
1051 1 47 PRO HB2 1 48 ASP HB3 . . 5.500 5.336 4.673 5.529 0.029 5 0 "[ . 1 . 2]" 1
1052 1 47 PRO HB2 1 49 ASP H . . 4.150 2.737 2.586 2.912 . 0 0 "[ . 1 . 2]" 1
1053 1 47 PRO HB2 1 49 ASP HA . . 5.500 5.075 5.002 5.184 . 0 0 "[ . 1 . 2]" 1
1054 1 47 PRO HB2 1 49 ASP HB2 . . 4.400 2.929 2.785 3.086 . 0 0 "[ . 1 . 2]" 1
1055 1 47 PRO HB2 1 49 ASP HB3 . . 5.340 4.671 4.487 4.773 . 0 0 "[ . 1 . 2]" 1
1056 1 47 PRO HB2 1 50 LEU H . . 4.210 3.644 3.512 3.790 . 0 0 "[ . 1 . 2]" 1
1057 1 47 PRO HB3 1 48 ASP H . . 4.020 3.568 3.535 3.663 . 0 0 "[ . 1 . 2]" 1
1058 1 47 PRO HB3 1 49 ASP H . . 4.750 4.406 4.271 4.562 . 0 0 "[ . 1 . 2]" 1
1059 1 47 PRO HD2 1 50 LEU H . . 4.980 4.603 4.556 4.660 . 0 0 "[ . 1 . 2]" 1
1060 1 47 PRO HD2 1 50 LEU HB2 . . 4.240 3.295 3.071 3.415 . 0 0 "[ . 1 . 2]" 1
1061 1 47 PRO HD2 1 50 LEU HB3 . . 4.830 4.625 4.337 4.796 . 0 0 "[ . 1 . 2]" 1
1062 1 47 PRO HD2 1 50 LEU MD1 . . 3.370 2.444 2.164 2.625 . 0 0 "[ . 1 . 2]" 1
1063 1 47 PRO HD2 1 50 LEU HG . . 4.760 3.950 3.805 4.178 . 0 0 "[ . 1 . 2]" 1
1064 1 47 PRO HG2 1 49 ASP HB3 . . 5.480 4.651 4.382 4.998 . 0 0 "[ . 1 . 2]" 1
1065 1 47 PRO HG2 1 50 LEU H . . 4.990 3.209 3.119 3.303 . 0 0 "[ . 1 . 2]" 1
1066 1 47 PRO HG2 1 50 LEU HB2 . . 5.190 3.107 2.812 3.386 . 0 0 "[ . 1 . 2]" 1
1067 1 47 PRO HG2 1 50 LEU MD1 . . 3.720 2.760 2.363 3.076 . 0 0 "[ . 1 . 2]" 1
1068 1 47 PRO HG2 1 50 LEU MD2 . . 4.480 4.314 4.111 4.485 0.005 13 0 "[ . 1 . 2]" 1
1069 1 47 PRO HG2 1 50 LEU HG . . 3.890 2.723 2.554 2.920 . 0 0 "[ . 1 . 2]" 1
1070 1 47 PRO HG3 1 49 ASP HB2 . . 5.240 4.179 4.001 4.374 . 0 0 "[ . 1 . 2]" 1
1071 1 48 ASP H 1 48 ASP QB . . 3.160 2.468 2.136 2.784 . 0 0 "[ . 1 . 2]" 1
1072 1 48 ASP H 1 49 ASP H . . 4.240 2.765 2.682 2.845 . 0 0 "[ . 1 . 2]" 1
1073 1 48 ASP H 1 51 ILE MD . . 4.670 3.291 3.055 3.610 . 0 0 "[ . 1 . 2]" 1
1074 1 48 ASP HA 1 50 LEU H . . 4.360 3.558 3.482 3.627 . 0 0 "[ . 1 . 2]" 1
1075 1 48 ASP HA 1 51 ILE H . . 3.900 2.681 2.632 2.733 . 0 0 "[ . 1 . 2]" 1
1076 1 48 ASP HA 1 51 ILE HB . . 3.790 2.064 1.985 2.224 . 0 0 "[ . 1 . 2]" 1
1077 1 48 ASP HA 1 51 ILE MD . . 2.970 1.971 1.920 2.116 . 0 0 "[ . 1 . 2]" 1
1078 1 48 ASP HA 1 51 ILE HG12 . . 3.520 3.481 3.449 3.523 0.003 9 0 "[ . 1 . 2]" 1
1079 1 48 ASP HA 1 51 ILE HG13 . . 3.350 2.072 1.996 2.159 . 0 0 "[ . 1 . 2]" 1
1080 1 48 ASP HA 1 51 ILE MG . . 3.990 3.487 3.415 3.610 . 0 0 "[ . 1 . 2]" 1
1081 1 48 ASP QB 1 49 ASP H . . 3.700 2.848 2.552 3.117 . 0 0 "[ . 1 . 2]" 1
1082 1 48 ASP QB 1 49 ASP HA . . 3.980 3.887 3.780 3.982 0.002 10 0 "[ . 1 . 2]" 1
1083 1 48 ASP QB 1 50 LEU H . . 4.830 4.399 4.289 4.506 . 0 0 "[ . 1 . 2]" 1
1084 1 48 ASP QB 1 51 ILE MD . . 3.570 2.880 2.482 3.361 . 0 0 "[ . 1 . 2]" 1
1085 1 48 ASP QB 1 51 ILE HG13 . . 4.540 4.079 3.868 4.318 . 0 0 "[ . 1 . 2]" 1
1086 1 48 ASP HB2 1 51 ILE H . . 5.500 4.881 4.553 5.244 . 0 0 "[ . 1 . 2]" 1
1087 1 48 ASP HB2 1 51 ILE HB . . 5.100 4.092 3.566 4.660 . 0 0 "[ . 1 . 2]" 1
1088 1 48 ASP HB2 1 51 ILE HG13 . . 5.390 4.711 4.407 4.917 . 0 0 "[ . 1 . 2]" 1
1089 1 48 ASP HB2 1 51 ILE MG . . 5.500 5.002 4.561 5.546 0.046 5 0 "[ . 1 . 2]" 1
1090 1 48 ASP HB3 1 51 ILE H . . 5.500 4.832 4.542 5.031 . 0 0 "[ . 1 . 2]" 1
1091 1 48 ASP HB3 1 51 ILE HB . . 5.100 3.844 3.583 4.501 . 0 0 "[ . 1 . 2]" 1
1092 1 48 ASP HB3 1 51 ILE HG13 . . 5.390 4.517 4.136 4.988 . 0 0 "[ . 1 . 2]" 1
1093 1 48 ASP HB3 1 51 ILE MG . . 5.500 4.701 4.287 5.506 0.006 17 0 "[ . 1 . 2]" 1
1094 1 49 ASP H 1 49 ASP HB2 . . 3.880 2.464 2.283 2.668 . 0 0 "[ . 1 . 2]" 1
1095 1 49 ASP H 1 49 ASP HB3 . . 4.050 3.600 3.553 3.613 . 0 0 "[ . 1 . 2]" 1
1096 1 49 ASP H 1 50 LEU H . . 3.510 2.890 2.833 2.913 . 0 0 "[ . 1 . 2]" 1
1097 1 49 ASP H 1 51 ILE H . . 4.520 4.155 4.095 4.233 . 0 0 "[ . 1 . 2]" 1
1098 1 49 ASP HA 1 50 LEU MD2 . . 5.450 5.163 5.007 5.277 . 0 0 "[ . 1 . 2]" 1
1099 1 49 ASP HA 1 50 LEU HG . . 5.500 5.204 5.101 5.346 . 0 0 "[ . 1 . 2]" 1
1100 1 49 ASP HA 1 51 ILE H . . 4.810 4.676 4.596 4.785 . 0 0 "[ . 1 . 2]" 1
1101 1 49 ASP HB2 1 50 LEU H . . 4.300 3.045 2.973 3.191 . 0 0 "[ . 1 . 2]" 1
1102 1 49 ASP HB2 1 50 LEU HB2 . . 5.040 4.699 4.576 4.907 . 0 0 "[ . 1 . 2]" 1
1103 1 49 ASP HB2 1 50 LEU MD1 . . 5.500 4.673 4.433 4.981 . 0 0 "[ . 1 . 2]" 1
1104 1 49 ASP HB2 1 50 LEU MD2 . . 4.450 4.356 4.053 4.458 0.008 16 0 "[ . 1 . 2]" 1
1105 1 49 ASP HB2 1 50 LEU HG . . 4.690 3.455 3.143 3.712 . 0 0 "[ . 1 . 2]" 1
1106 1 49 ASP HB3 1 50 LEU H . . 4.490 3.782 3.635 3.949 . 0 0 "[ . 1 . 2]" 1
1107 1 49 ASP HB3 1 50 LEU HA . . 5.070 4.448 4.330 4.646 . 0 0 "[ . 1 . 2]" 1
1108 1 49 ASP HB3 1 50 LEU MD1 . . 5.500 5.178 4.974 5.378 . 0 0 "[ . 1 . 2]" 1
1109 1 49 ASP HB3 1 50 LEU MD2 . . 4.070 3.942 3.584 4.082 0.012 16 0 "[ . 1 . 2]" 1
1110 1 49 ASP HB3 1 50 LEU HG . . 5.500 3.823 3.585 4.043 . 0 0 "[ . 1 . 2]" 1
1111 1 50 LEU H 1 50 LEU HB2 . . 3.420 2.417 2.377 2.454 . 0 0 "[ . 1 . 2]" 1
1112 1 50 LEU H 1 50 LEU HB3 . . 3.790 3.644 3.619 3.666 . 0 0 "[ . 1 . 2]" 1
1113 1 50 LEU H 1 50 LEU MD1 . . 4.100 3.973 3.856 4.077 . 0 0 "[ . 1 . 2]" 1
1114 1 50 LEU H 1 50 LEU MD2 . . 3.950 3.855 3.782 3.912 . 0 0 "[ . 1 . 2]" 1
1115 1 50 LEU H 1 50 LEU HG . . 3.310 2.986 2.889 3.092 . 0 0 "[ . 1 . 2]" 1
1116 1 50 LEU H 1 51 ILE H . . 2.940 2.061 2.022 2.124 . 0 0 "[ . 1 . 2]" 1
1117 1 50 LEU H 1 51 ILE HA . . 4.760 4.691 4.651 4.752 . 0 0 "[ . 1 . 2]" 1
1118 1 50 LEU H 1 51 ILE HB . . 4.550 4.207 4.146 4.270 . 0 0 "[ . 1 . 2]" 1
1119 1 50 LEU H 1 51 ILE MD . . 4.870 4.734 4.626 4.837 . 0 0 "[ . 1 . 2]" 1
1120 1 50 LEU H 1 51 ILE HG12 . . 5.320 5.190 4.996 5.321 0.001 11 0 "[ . 1 . 2]" 1
1121 1 50 LEU H 1 51 ILE HG13 . . 4.280 3.647 3.510 3.772 . 0 0 "[ . 1 . 2]" 1
1122 1 50 LEU HA 1 50 LEU MD1 . . 4.130 3.845 3.801 3.883 . 0 0 "[ . 1 . 2]" 1
1123 1 50 LEU HA 1 50 LEU MD2 . . 2.880 2.007 1.947 2.143 . 0 0 "[ . 1 . 2]" 1
1124 1 50 LEU HA 1 50 LEU HG . . 3.860 3.031 2.991 3.093 . 0 0 "[ . 1 . 2]" 1
1125 1 50 LEU HA 1 53 ARG H . . 5.110 4.077 3.892 4.225 . 0 0 "[ . 1 . 2]" 1
1126 1 50 LEU HA 1 53 ARG HB2 . . 4.120 3.568 3.180 3.732 . 0 0 "[ . 1 . 2]" 1
1127 1 50 LEU HA 1 53 ARG HB3 . . 5.190 4.987 4.590 5.192 0.002 13 0 "[ . 1 . 2]" 1
1128 1 50 LEU HA 1 53 ARG QD . . 3.470 3.035 1.967 3.396 . 0 0 "[ . 1 . 2]" 1
1129 1 50 LEU HA 1 53 ARG QG . . 4.040 3.145 2.714 4.055 0.015 11 0 "[ . 1 . 2]" 1
1130 1 50 LEU HA 1 56 VAL HB . . 5.460 4.432 4.257 4.658 . 0 0 "[ . 1 . 2]" 1
1131 1 50 LEU HA 1 56 VAL MG1 . . 3.990 3.732 3.396 3.988 . 0 0 "[ . 1 . 2]" 1
1132 1 50 LEU HB2 1 50 LEU MD1 . . 3.400 2.289 2.160 2.400 . 0 0 "[ . 1 . 2]" 1
1133 1 50 LEU HB2 1 51 ILE H . . 4.310 2.844 2.752 2.910 . 0 0 "[ . 1 . 2]" 1
1134 1 50 LEU HB3 1 50 LEU MD1 . . 3.390 2.368 2.288 2.463 . 0 0 "[ . 1 . 2]" 1
1135 1 50 LEU HB3 1 50 LEU MD2 . . 3.390 2.326 2.271 2.371 . 0 0 "[ . 1 . 2]" 1
1136 1 50 LEU HB3 1 51 ILE H . . 4.420 3.714 3.576 3.805 . 0 0 "[ . 1 . 2]" 1
1137 1 50 LEU HB3 1 53 ARG HB2 . . 5.040 3.814 3.421 4.055 . 0 0 "[ . 1 . 2]" 1
1138 1 50 LEU HB3 1 53 ARG QD . . 4.790 4.464 3.670 4.692 . 0 0 "[ . 1 . 2]" 1
1139 1 50 LEU HB3 1 56 VAL HB . . 5.110 3.067 2.858 3.202 . 0 0 "[ . 1 . 2]" 1
1140 1 50 LEU HB3 1 56 VAL MG1 . . 3.530 2.436 2.194 2.647 . 0 0 "[ . 1 . 2]" 1
1141 1 50 LEU MD1 1 56 VAL MG1 . . 3.800 3.568 3.420 3.779 . 0 0 "[ . 1 . 2]" 1
1142 1 50 LEU MD1 1 56 VAL MG2 . . 3.510 1.958 1.828 2.216 . 0 0 "[ . 1 . 2]" 1
1143 1 50 LEU MD2 1 53 ARG HB2 . . 3.970 3.396 3.163 3.534 . 0 0 "[ . 1 . 2]" 1
1144 1 50 LEU MD2 1 53 ARG HB3 . . 4.550 4.344 4.060 4.528 . 0 0 "[ . 1 . 2]" 1
1145 1 50 LEU MD2 1 53 ARG HD2 . . 3.970 2.926 2.613 3.982 0.012 11 0 "[ . 1 . 2]" 1
1146 1 50 LEU MD2 1 53 ARG QD . . 3.280 2.705 2.464 2.845 . 0 0 "[ . 1 . 2]" 1
1147 1 50 LEU MD2 1 53 ARG HD3 . . 3.970 3.646 2.570 3.976 0.006 19 0 "[ . 1 . 2]" 1
1148 1 50 LEU MD2 1 53 ARG HE . . 5.020 4.602 4.044 5.011 . 0 0 "[ . 1 . 2]" 1
1149 1 50 LEU MD2 1 53 ARG QG . . 3.830 3.703 3.394 3.833 0.003 10 0 "[ . 1 . 2]" 1
1150 1 50 LEU MD2 1 56 VAL H . . 4.360 4.347 4.242 4.367 0.007 13 0 "[ . 1 . 2]" 1
1151 1 50 LEU MD2 1 56 VAL HB . . 4.440 2.555 2.296 2.657 . 0 0 "[ . 1 . 2]" 1
1152 1 50 LEU MD2 1 56 VAL MG1 . . 3.370 3.156 2.949 3.343 . 0 0 "[ . 1 . 2]" 1
1153 1 51 ILE H 1 51 ILE HB . . 2.890 2.529 2.465 2.603 . 0 0 "[ . 1 . 2]" 1
1154 1 51 ILE H 1 51 ILE MD . . 3.680 3.625 3.558 3.680 . 0 0 "[ . 1 . 2]" 1
1155 1 51 ILE H 1 51 ILE HG12 . . 3.470 3.378 3.207 3.485 0.015 16 0 "[ . 1 . 2]" 1
1156 1 51 ILE H 1 51 ILE HG13 . . 3.230 2.153 2.063 2.271 . 0 0 "[ . 1 . 2]" 1
1157 1 51 ILE H 1 51 ILE MG . . 3.840 3.766 3.756 3.775 . 0 0 "[ . 1 . 2]" 1
1158 1 51 ILE HA 1 51 ILE MD . . 4.000 3.787 3.768 3.811 . 0 0 "[ . 1 . 2]" 1
1159 1 51 ILE HA 1 51 ILE HG12 . . 3.470 2.447 2.407 2.497 . 0 0 "[ . 1 . 2]" 1
1160 1 51 ILE HA 1 51 ILE HG13 . . 3.710 2.930 2.859 3.051 . 0 0 "[ . 1 . 2]" 1
1161 1 51 ILE HA 1 51 ILE MG . . 3.030 2.457 2.430 2.511 . 0 0 "[ . 1 . 2]" 1
1162 1 51 ILE HA 1 52 GLY H . . 3.480 2.147 2.144 2.154 . 0 0 "[ . 1 . 2]" 1
1163 1 51 ILE HA 1 53 ARG H . . 4.050 3.762 3.588 3.925 . 0 0 "[ . 1 . 2]" 1
1164 1 51 ILE HB 1 51 ILE MD . . 3.050 2.398 2.313 2.525 . 0 0 "[ . 1 . 2]" 1
1165 1 51 ILE HG12 1 51 ILE MG . . 3.110 2.356 2.304 2.406 . 0 0 "[ . 1 . 2]" 1
1166 1 51 ILE HG13 1 51 ILE MG . . 3.290 3.189 3.185 3.203 . 0 0 "[ . 1 . 2]" 1
1167 1 51 ILE MG 1 52 GLY H . . 3.820 2.704 2.489 3.032 . 0 0 "[ . 1 . 2]" 1
1168 1 51 ILE MG 1 52 GLY HA2 . . 3.950 3.366 3.282 3.485 . 0 0 "[ . 1 . 2]" 1
1169 1 51 ILE MG 1 52 GLY HA3 . . 3.950 3.511 3.290 3.643 . 0 0 "[ . 1 . 2]" 1
1170 1 51 ILE MG 1 53 ARG H . . 4.730 4.580 4.435 4.715 . 0 0 "[ . 1 . 2]" 1
1171 1 52 GLY H 1 53 ARG H . . 3.750 2.625 2.447 2.853 . 0 0 "[ . 1 . 2]" 1
1172 1 53 ARG H 1 53 ARG HB2 . . 3.150 2.449 2.239 2.550 . 0 0 "[ . 1 . 2]" 1
1173 1 53 ARG H 1 53 ARG HB3 . . 3.750 3.607 3.525 3.643 . 0 0 "[ . 1 . 2]" 1
1174 1 53 ARG H 1 53 ARG HD2 . . 4.980 4.406 1.898 5.001 0.021 16 0 "[ . 1 . 2]" 1
1175 1 53 ARG H 1 53 ARG HD3 . . 4.980 4.710 3.151 4.898 . 0 0 "[ . 1 . 2]" 1
1176 1 53 ARG H 1 53 ARG HG2 . . 4.030 3.372 3.074 4.037 0.007 11 0 "[ . 1 . 2]" 1
1177 1 53 ARG H 1 53 ARG QG . . 3.510 2.490 2.247 3.135 . 0 0 "[ . 1 . 2]" 1
1178 1 53 ARG H 1 53 ARG HG3 . . 4.030 2.567 2.305 3.267 . 0 0 "[ . 1 . 2]" 1
1179 1 53 ARG H 1 56 VAL H . . 5.500 5.484 5.433 5.509 0.009 5 0 "[ . 1 . 2]" 1
1180 1 53 ARG H 1 56 VAL HB . . 5.500 5.431 5.142 5.511 0.011 12 0 "[ . 1 . 2]" 1
1181 1 53 ARG H 1 56 VAL MG1 . . 4.410 3.262 3.110 3.470 . 0 0 "[ . 1 . 2]" 1
1182 1 53 ARG HA 1 53 ARG QD . . 3.920 3.865 3.392 4.017 0.097 16 0 "[ . 1 . 2]" 1
1183 1 53 ARG HA 1 53 ARG QG . . 3.140 2.360 2.180 2.440 . 0 0 "[ . 1 . 2]" 1
1184 1 53 ARG HB2 1 53 ARG HD2 . . 4.020 3.019 2.617 3.681 . 0 0 "[ . 1 . 2]" 1
1185 1 53 ARG HB2 1 53 ARG QD . . 3.520 2.597 2.219 2.737 . 0 0 "[ . 1 . 2]" 1
1186 1 53 ARG HB2 1 53 ARG HD3 . . 4.020 2.882 2.399 3.092 . 0 0 "[ . 1 . 2]" 1
1187 1 53 ARG HB2 1 54 ALA H . . 4.330 4.004 3.840 4.180 . 0 0 "[ . 1 . 2]" 1
1188 1 53 ARG HB2 1 56 VAL H . . 3.940 3.357 3.176 3.559 . 0 0 "[ . 1 . 2]" 1
1189 1 53 ARG HB2 1 56 VAL MG1 . . 3.360 2.185 1.841 2.487 . 0 0 "[ . 1 . 2]" 1
1190 1 53 ARG HB3 1 53 ARG HD2 . . 4.050 3.260 3.055 3.717 . 0 0 "[ . 1 . 2]" 1
1191 1 53 ARG HB3 1 53 ARG HD3 . . 4.050 2.256 2.074 3.511 . 0 0 "[ . 1 . 2]" 1
1192 1 53 ARG HB3 1 53 ARG HE . . 4.940 4.258 2.949 4.980 0.040 11 0 "[ . 1 . 2]" 1
1193 1 53 ARG HB3 1 54 ALA H . . 4.010 2.950 2.805 3.103 . 0 0 "[ . 1 . 2]" 1
1194 1 53 ARG HB3 1 54 ALA MB . . 4.700 4.604 4.527 4.703 0.003 20 0 "[ . 1 . 2]" 1
1195 1 53 ARG HB3 1 55 ASP H . . 4.330 3.134 2.894 3.389 . 0 0 "[ . 1 . 2]" 1
1196 1 53 ARG HB3 1 56 VAL H . . 3.890 3.084 2.527 3.379 . 0 0 "[ . 1 . 2]" 1
1197 1 53 ARG HB3 1 56 VAL MG1 . . 3.540 3.037 2.215 3.341 . 0 0 "[ . 1 . 2]" 1
1198 1 53 ARG QD 1 56 VAL MG1 . . 3.970 3.778 3.251 3.976 0.006 5 0 "[ . 1 . 2]" 1
1199 1 53 ARG HD2 1 56 VAL MG1 . . 4.550 4.345 3.901 4.569 0.019 12 0 "[ . 1 . 2]" 1
1200 1 53 ARG HD3 1 56 VAL MG1 . . 4.550 4.230 3.328 4.522 . 0 0 "[ . 1 . 2]" 1
1201 1 53 ARG QG 1 56 VAL MG1 . . 4.200 3.781 3.444 4.201 0.001 11 0 "[ . 1 . 2]" 1
1202 1 54 ALA H 1 56 VAL MG1 . . 4.250 4.007 3.885 4.184 . 0 0 "[ . 1 . 2]" 1
1203 1 54 ALA HA 1 56 VAL H . . 4.630 4.517 4.262 4.627 . 0 0 "[ . 1 . 2]" 1
1204 1 54 ALA HA 1 57 ASP H . . 3.860 3.454 3.339 3.538 . 0 0 "[ . 1 . 2]" 1
1205 1 54 ALA HA 1 57 ASP QB . . 3.350 2.876 2.557 3.057 . 0 0 "[ . 1 . 2]" 1
1206 1 54 ALA HA 1 58 LYS H . . 4.680 4.134 3.947 4.380 . 0 0 "[ . 1 . 2]" 1
1207 1 54 ALA MB 1 55 ASP H . . 3.660 2.687 2.418 2.858 . 0 0 "[ . 1 . 2]" 1
1208 1 54 ALA MB 1 55 ASP HA . . 4.040 3.745 3.660 3.852 . 0 0 "[ . 1 . 2]" 1
1209 1 54 ALA MB 1 55 ASP HB2 . . 5.500 5.189 4.851 5.457 . 0 0 "[ . 1 . 2]" 1
1210 1 54 ALA MB 1 55 ASP QB . . 4.830 4.473 4.268 4.644 . 0 0 "[ . 1 . 2]" 1
1211 1 54 ALA MB 1 55 ASP HB3 . . 5.500 4.980 4.467 5.410 . 0 0 "[ . 1 . 2]" 1
1212 1 54 ALA MB 1 56 VAL H . . 4.820 4.767 4.651 4.825 0.005 16 0 "[ . 1 . 2]" 1
1213 1 54 ALA MB 1 57 ASP H . . 4.570 4.513 4.370 4.579 0.009 12 0 "[ . 1 . 2]" 1
1214 1 54 ALA MB 1 57 ASP QB . . 3.910 3.777 3.626 3.911 0.001 12 0 "[ . 1 . 2]" 1
1215 1 54 ALA MB 1 58 LYS H . . 4.810 4.163 3.923 4.368 . 0 0 "[ . 1 . 2]" 1
1216 1 55 ASP H 1 55 ASP HB2 . . 4.140 3.105 2.569 3.572 . 0 0 "[ . 1 . 2]" 1
1217 1 55 ASP H 1 55 ASP QB . . 3.600 2.718 2.516 2.851 . 0 0 "[ . 1 . 2]" 1
1218 1 55 ASP H 1 55 ASP HB3 . . 4.140 3.273 2.781 3.599 . 0 0 "[ . 1 . 2]" 1
1219 1 55 ASP H 1 56 VAL H . . 3.330 2.943 2.702 3.061 . 0 0 "[ . 1 . 2]" 1
1220 1 55 ASP H 1 56 VAL MG1 . . 4.560 3.729 3.523 3.851 . 0 0 "[ . 1 . 2]" 1
1221 1 55 ASP HA 1 56 VAL MG1 . . 4.980 4.699 4.600 4.789 . 0 0 "[ . 1 . 2]" 1
1222 1 55 ASP HA 1 58 LYS H . . 3.970 3.613 3.447 3.811 . 0 0 "[ . 1 . 2]" 1
1223 1 55 ASP HA 1 58 LYS HB2 . . 3.940 3.440 2.671 3.834 . 0 0 "[ . 1 . 2]" 1
1224 1 55 ASP HA 1 58 LYS HB3 . . 3.420 2.830 2.552 3.313 . 0 0 "[ . 1 . 2]" 1
1225 1 55 ASP HA 1 58 LYS QD . . 4.070 3.522 2.973 3.943 . 0 0 "[ . 1 . 2]" 1
1226 1 55 ASP HA 1 59 ILE H . . 4.390 3.920 3.612 4.211 . 0 0 "[ . 1 . 2]" 1
1227 1 55 ASP QB 1 56 VAL H . . 3.690 2.570 2.221 3.023 . 0 0 "[ . 1 . 2]" 1
1228 1 55 ASP QB 1 56 VAL MG1 . . 4.510 4.101 3.772 4.477 . 0 0 "[ . 1 . 2]" 1
1229 1 55 ASP QB 1 58 LYS HB3 . . 4.690 4.353 4.223 4.682 . 0 0 "[ . 1 . 2]" 1
1230 1 55 ASP QB 1 59 ILE HG13 . . 4.830 3.757 3.339 4.130 . 0 0 "[ . 1 . 2]" 1
1231 1 55 ASP HB2 1 56 VAL H . . 4.230 2.630 2.248 3.140 . 0 0 "[ . 1 . 2]" 1
1232 1 55 ASP HB2 1 58 LYS HB3 . . 5.500 5.229 4.686 5.500 . 0 0 "[ . 1 . 2]" 1
1233 1 55 ASP HB2 1 59 ILE MD . . 4.460 3.455 2.408 4.275 . 0 0 "[ . 1 . 2]" 1
1234 1 55 ASP HB2 1 59 ILE HG13 . . 5.500 4.440 3.425 5.192 . 0 0 "[ . 1 . 2]" 1
1235 1 55 ASP HB3 1 56 VAL H . . 4.230 3.741 3.441 3.955 . 0 0 "[ . 1 . 2]" 1
1236 1 55 ASP HB3 1 58 LYS HB3 . . 5.500 4.711 4.457 5.300 . 0 0 "[ . 1 . 2]" 1
1237 1 55 ASP HB3 1 59 ILE MD . . 4.460 3.751 2.897 4.448 . 0 0 "[ . 1 . 2]" 1
1238 1 55 ASP HB3 1 59 ILE HG13 . . 5.500 4.354 3.732 5.147 . 0 0 "[ . 1 . 2]" 1
1239 1 56 VAL H 1 56 VAL HB . . 2.980 2.600 2.547 2.634 . 0 0 "[ . 1 . 2]" 1
1240 1 56 VAL H 1 56 VAL MG1 . . 2.920 1.966 1.879 2.128 . 0 0 "[ . 1 . 2]" 1
1241 1 56 VAL H 1 56 VAL MG2 . . 3.780 3.768 3.763 3.774 . 0 0 "[ . 1 . 2]" 1
1242 1 56 VAL H 1 57 ASP H . . 3.220 2.872 2.722 3.001 . 0 0 "[ . 1 . 2]" 1
1243 1 56 VAL HA 1 56 VAL MG1 . . 3.200 3.189 3.179 3.196 . 0 0 "[ . 1 . 2]" 1
1244 1 56 VAL HA 1 56 VAL MG2 . . 3.080 2.463 2.398 2.489 . 0 0 "[ . 1 . 2]" 1
1245 1 56 VAL HA 1 59 ILE H . . 4.130 4.109 3.968 4.134 0.004 14 0 "[ . 1 . 2]" 1
1246 1 56 VAL HA 1 59 ILE HB . . 3.580 3.380 3.012 3.581 0.001 14 0 "[ . 1 . 2]" 1
1247 1 56 VAL HA 1 59 ILE HG12 . . 5.460 5.116 4.887 5.382 . 0 0 "[ . 1 . 2]" 1
1248 1 56 VAL HA 1 59 ILE HG13 . . 4.160 3.889 3.535 4.085 . 0 0 "[ . 1 . 2]" 1
1249 1 56 VAL HA 1 59 ILE MG . . 4.810 4.517 4.257 4.716 . 0 0 "[ . 1 . 2]" 1
1250 1 56 VAL HA 1 60 ILE H . . 4.660 4.529 4.388 4.652 . 0 0 "[ . 1 . 2]" 1
1251 1 56 VAL HA 1 60 ILE QG . . 4.850 4.522 4.105 4.780 . 0 0 "[ . 1 . 2]" 1
1252 1 56 VAL HB 1 57 ASP H . . 4.170 3.946 3.847 4.098 . 0 0 "[ . 1 . 2]" 1
1253 1 56 VAL MG1 1 57 ASP H . . 3.960 1.993 1.846 2.284 . 0 0 "[ . 1 . 2]" 1
1254 1 56 VAL MG1 1 57 ASP QB . . 4.460 3.179 2.862 3.471 . 0 0 "[ . 1 . 2]" 1
1255 1 56 VAL MG2 1 57 ASP H . . 3.840 3.360 3.150 3.650 . 0 0 "[ . 1 . 2]" 1
1256 1 56 VAL MG2 1 57 ASP HA . . 4.120 3.341 3.219 3.545 . 0 0 "[ . 1 . 2]" 1
1257 1 56 VAL MG2 1 57 ASP QB . . 5.100 4.391 4.067 4.659 . 0 0 "[ . 1 . 2]" 1
1258 1 56 VAL MG2 1 60 ILE H . . 4.610 4.347 4.095 4.445 . 0 0 "[ . 1 . 2]" 1
1259 1 56 VAL MG2 1 60 ILE HB . . 4.520 4.506 4.443 4.524 0.004 5 0 "[ . 1 . 2]" 1
1260 1 56 VAL MG2 1 60 ILE QG . . 3.650 3.463 3.262 3.649 . 0 0 "[ . 1 . 2]" 1
1261 1 57 ASP H 1 57 ASP HB2 . . 3.700 2.301 2.198 2.441 . 0 0 "[ . 1 . 2]" 1
1262 1 57 ASP H 1 57 ASP QB . . 3.160 2.239 2.169 2.403 . 0 0 "[ . 1 . 2]" 1
1263 1 57 ASP H 1 57 ASP HB3 . . 3.700 3.240 2.691 3.585 . 0 0 "[ . 1 . 2]" 1
1264 1 57 ASP H 1 58 LYS H . . 3.170 2.770 2.595 2.958 . 0 0 "[ . 1 . 2]" 1
1265 1 57 ASP H 1 58 LYS HB2 . . 5.500 4.991 4.564 5.345 . 0 0 "[ . 1 . 2]" 1
1266 1 57 ASP H 1 58 LYS HB3 . . 5.490 4.857 4.587 5.296 . 0 0 "[ . 1 . 2]" 1
1267 1 57 ASP HA 1 60 ILE H . . 4.110 3.658 3.481 3.955 . 0 0 "[ . 1 . 2]" 1
1268 1 57 ASP HA 1 60 ILE HB . . 3.420 2.974 2.819 3.283 . 0 0 "[ . 1 . 2]" 1
1269 1 57 ASP HA 1 60 ILE MD . . 3.500 2.709 2.246 3.031 . 0 0 "[ . 1 . 2]" 1
1270 1 57 ASP HA 1 60 ILE QG . . 4.100 4.013 3.822 4.103 0.003 19 0 "[ . 1 . 2]" 1
1271 1 57 ASP HA 1 60 ILE MG . . 4.470 4.301 4.149 4.470 . 0 0 "[ . 1 . 2]" 1
1272 1 57 ASP QB 1 58 LYS H . . 3.150 2.266 2.063 2.646 . 0 0 "[ . 1 . 2]" 1
1273 1 57 ASP QB 1 58 LYS HB2 . . 4.440 4.099 3.936 4.288 . 0 0 "[ . 1 . 2]" 1
1274 1 57 ASP QB 1 58 LYS HB3 . . 5.340 4.694 4.485 5.101 . 0 0 "[ . 1 . 2]" 1
1275 1 57 ASP QB 1 60 ILE HB . . 5.340 4.705 4.434 4.977 . 0 0 "[ . 1 . 2]" 1
1276 1 57 ASP HB2 1 58 LYS H . . 3.690 2.834 2.246 3.546 . 0 0 "[ . 1 . 2]" 1
1277 1 57 ASP HB3 1 58 LYS H . . 3.690 2.708 2.079 3.432 . 0 0 "[ . 1 . 2]" 1
1278 1 58 LYS H 1 58 LYS HB2 . . 2.840 2.423 2.141 2.759 . 0 0 "[ . 1 . 2]" 1
1279 1 58 LYS H 1 58 LYS HB3 . . 3.140 2.697 2.320 3.086 . 0 0 "[ . 1 . 2]" 1
1280 1 58 LYS H 1 58 LYS HD2 . . 5.500 4.905 4.363 5.508 0.008 18 0 "[ . 1 . 2]" 1
1281 1 58 LYS H 1 58 LYS HD3 . . 5.500 5.021 4.347 5.623 0.123 19 0 "[ . 1 . 2]" 1
1282 1 58 LYS H 1 58 LYS HG2 . . 4.580 4.500 4.304 4.643 0.063 14 0 "[ . 1 . 2]" 1
1283 1 58 LYS H 1 58 LYS HG3 . . 4.580 4.356 3.992 4.617 0.037 19 0 "[ . 1 . 2]" 1
1284 1 58 LYS H 1 59 ILE H . . 3.370 3.057 2.836 3.156 . 0 0 "[ . 1 . 2]" 1
1285 1 58 LYS H 1 61 GLN HB2 . . 5.060 4.945 4.729 5.067 0.007 19 0 "[ . 1 . 2]" 1
1286 1 58 LYS H 1 61 GLN HG3 . . 5.050 4.005 3.696 4.481 . 0 0 "[ . 1 . 2]" 1
1287 1 58 LYS HA 1 58 LYS HB2 . . 2.890 2.483 2.365 2.681 . 0 0 "[ . 1 . 2]" 1
1288 1 58 LYS HA 1 58 LYS HD2 . . 5.350 4.464 4.238 4.754 . 0 0 "[ . 1 . 2]" 1
1289 1 58 LYS HA 1 58 LYS QD . . 4.600 4.048 3.871 4.228 . 0 0 "[ . 1 . 2]" 1
1290 1 58 LYS HA 1 58 LYS HD3 . . 5.350 4.656 4.224 4.985 . 0 0 "[ . 1 . 2]" 1
1291 1 58 LYS HA 1 58 LYS HG2 . . 3.760 3.020 2.768 3.210 . 0 0 "[ . 1 . 2]" 1
1292 1 58 LYS HA 1 58 LYS QG . . 3.270 2.458 2.115 2.659 . 0 0 "[ . 1 . 2]" 1
1293 1 58 LYS HA 1 58 LYS HG3 . . 3.760 2.625 2.150 3.007 . 0 0 "[ . 1 . 2]" 1
1294 1 58 LYS HA 1 61 GLN H . . 3.930 3.529 3.174 3.826 . 0 0 "[ . 1 . 2]" 1
1295 1 58 LYS HA 1 61 GLN HB2 . . 3.240 2.554 2.383 2.787 . 0 0 "[ . 1 . 2]" 1
1296 1 58 LYS HA 1 61 GLN HG2 . . 4.840 4.357 4.183 4.518 . 0 0 "[ . 1 . 2]" 1
1297 1 58 LYS HA 1 61 GLN HG3 . . 4.680 2.725 2.550 2.870 . 0 0 "[ . 1 . 2]" 1
1298 1 58 LYS HA 1 62 GLU H . . 4.620 4.011 3.776 4.317 . 0 0 "[ . 1 . 2]" 1
1299 1 58 LYS HB2 1 59 ILE H . . 3.830 3.670 3.360 3.828 . 0 0 "[ . 1 . 2]" 1
1300 1 58 LYS HB2 1 61 GLN HG3 . . 5.500 4.968 4.754 5.169 . 0 0 "[ . 1 . 2]" 1
1301 1 58 LYS HB3 1 59 ILE H . . 2.930 2.319 2.210 2.415 . 0 0 "[ . 1 . 2]" 1
1302 1 58 LYS HB3 1 59 ILE MD . . 4.830 4.605 4.327 4.789 . 0 0 "[ . 1 . 2]" 1
1303 1 58 LYS HB3 1 61 GLN HG3 . . 5.500 5.434 5.179 5.503 0.003 19 0 "[ . 1 . 2]" 1
1304 1 58 LYS QD 1 59 ILE H . . 4.840 4.097 3.175 4.846 0.006 14 0 "[ . 1 . 2]" 1
1305 1 58 LYS QE 1 58 LYS QG . . 3.340 2.216 2.102 2.371 . 0 0 "[ . 1 . 2]" 1
1306 1 58 LYS QG 1 61 GLN HB2 . . 4.280 3.751 3.528 3.972 . 0 0 "[ . 1 . 2]" 1
1307 1 58 LYS HG2 1 59 ILE H . . 4.870 3.558 2.997 4.252 . 0 0 "[ . 1 . 2]" 1
1308 1 58 LYS HG2 1 61 GLN HB2 . . 4.980 4.286 3.855 4.751 . 0 0 "[ . 1 . 2]" 1
1309 1 58 LYS HG3 1 59 ILE H . . 4.870 4.587 4.300 4.822 . 0 0 "[ . 1 . 2]" 1
1310 1 58 LYS HG3 1 61 GLN HB2 . . 4.980 4.178 3.857 4.547 . 0 0 "[ . 1 . 2]" 1
1311 1 59 ILE H 1 59 ILE HB . . 3.000 2.604 2.536 2.684 . 0 0 "[ . 1 . 2]" 1
1312 1 59 ILE H 1 59 ILE MD . . 3.620 3.420 3.210 3.563 . 0 0 "[ . 1 . 2]" 1
1313 1 59 ILE H 1 59 ILE HG12 . . 3.670 3.350 3.053 3.497 . 0 0 "[ . 1 . 2]" 1
1314 1 59 ILE H 1 59 ILE HG13 . . 3.020 1.985 1.900 2.091 . 0 0 "[ . 1 . 2]" 1
1315 1 59 ILE H 1 59 ILE MG . . 3.900 3.768 3.763 3.784 . 0 0 "[ . 1 . 2]" 1
1316 1 59 ILE H 1 60 ILE H . . 3.310 3.003 2.925 3.147 . 0 0 "[ . 1 . 2]" 1
1317 1 59 ILE H 1 60 ILE MD . . 5.420 5.213 4.989 5.399 . 0 0 "[ . 1 . 2]" 1
1318 1 59 ILE H 1 60 ILE QG . . 5.340 4.777 4.685 4.864 . 0 0 "[ . 1 . 2]" 1
1319 1 59 ILE HA 1 59 ILE MD . . 3.970 3.852 3.817 3.883 . 0 0 "[ . 1 . 2]" 1
1320 1 59 ILE HA 1 59 ILE HG12 . . 3.230 2.602 2.503 2.764 . 0 0 "[ . 1 . 2]" 1
1321 1 59 ILE HA 1 59 ILE HG13 . . 3.170 2.896 2.734 3.113 . 0 0 "[ . 1 . 2]" 1
1322 1 59 ILE HA 1 59 ILE MG . . 3.010 2.374 2.294 2.467 . 0 0 "[ . 1 . 2]" 1
1323 1 59 ILE HA 1 62 GLU H . . 4.410 3.835 3.432 4.294 . 0 0 "[ . 1 . 2]" 1
1324 1 59 ILE HB 1 60 ILE H . . 3.430 2.283 2.079 2.669 . 0 0 "[ . 1 . 2]" 1
1325 1 59 ILE HG13 1 60 ILE H . . 4.370 4.176 3.992 4.302 . 0 0 "[ . 1 . 2]" 1
1326 1 59 ILE MG 1 60 ILE H . . 3.630 3.145 2.844 3.474 . 0 0 "[ . 1 . 2]" 1
1327 1 59 ILE MG 1 60 ILE HA . . 3.840 3.359 3.083 3.546 . 0 0 "[ . 1 . 2]" 1
1328 1 59 ILE MG 1 64 PRO HD2 . . 4.430 4.099 3.966 4.378 . 0 0 "[ . 1 . 2]" 1
1329 1 60 ILE H 1 60 ILE HB . . 2.980 2.489 2.437 2.588 . 0 0 "[ . 1 . 2]" 1
1330 1 60 ILE H 1 60 ILE MD . . 3.580 3.270 3.108 3.459 . 0 0 "[ . 1 . 2]" 1
1331 1 60 ILE H 1 60 ILE HG12 . . 3.710 3.658 3.540 3.714 0.004 19 0 "[ . 1 . 2]" 1
1332 1 60 ILE H 1 60 ILE QG . . 3.090 2.192 2.027 2.313 . 0 0 "[ . 1 . 2]" 1
1333 1 60 ILE H 1 60 ILE HG13 . . 3.710 2.210 2.039 2.336 . 0 0 "[ . 1 . 2]" 1
1334 1 60 ILE H 1 60 ILE MG . . 3.890 3.756 3.745 3.771 . 0 0 "[ . 1 . 2]" 1
1335 1 60 ILE HA 1 60 ILE MD . . 3.990 3.849 3.831 3.870 . 0 0 "[ . 1 . 2]" 1
1336 1 60 ILE HA 1 60 ILE HG12 . . 3.480 2.698 2.610 2.802 . 0 0 "[ . 1 . 2]" 1
1337 1 60 ILE HA 1 60 ILE QG . . 3.050 2.398 2.368 2.433 . 0 0 "[ . 1 . 2]" 1
1338 1 60 ILE HA 1 60 ILE HG13 . . 3.480 2.691 2.617 2.794 . 0 0 "[ . 1 . 2]" 1
1339 1 60 ILE HA 1 60 ILE MG . . 2.990 2.440 2.360 2.490 . 0 0 "[ . 1 . 2]" 1
1340 1 60 ILE HB 1 60 ILE MD . . 3.010 2.264 2.127 2.347 . 0 0 "[ . 1 . 2]" 1
1341 1 60 ILE HB 1 61 GLN H . . 3.370 2.634 2.400 2.901 . 0 0 "[ . 1 . 2]" 1
1342 1 60 ILE HB 1 61 GLN HA . . 4.450 4.303 4.170 4.401 . 0 0 "[ . 1 . 2]" 1
1343 1 60 ILE HB 1 61 GLN HG2 . . 4.630 4.207 3.975 4.527 . 0 0 "[ . 1 . 2]" 1
1344 1 60 ILE QG 1 60 ILE MG . . 3.220 2.196 2.032 2.270 . 0 0 "[ . 1 . 2]" 1
1345 1 60 ILE QG 1 61 GLN H . . 4.410 4.138 4.049 4.216 . 0 0 "[ . 1 . 2]" 1
1346 1 60 ILE MG 1 61 GLN H . . 3.760 3.313 3.180 3.531 . 0 0 "[ . 1 . 2]" 1
1347 1 60 ILE MG 1 61 GLN HA . . 3.570 3.303 3.160 3.477 . 0 0 "[ . 1 . 2]" 1
1348 1 60 ILE MG 1 61 GLN HB2 . . 5.500 5.114 5.004 5.294 . 0 0 "[ . 1 . 2]" 1
1349 1 60 ILE MG 1 61 GLN HB3 . . 5.500 5.315 5.223 5.453 . 0 0 "[ . 1 . 2]" 1
1350 1 60 ILE MG 1 61 GLN HG2 . . 4.430 3.947 3.782 4.246 . 0 0 "[ . 1 . 2]" 1
1351 1 60 ILE MG 1 61 GLN HG3 . . 4.880 4.476 4.253 4.714 . 0 0 "[ . 1 . 2]" 1
1352 1 60 ILE MG 1 62 GLU H . . 5.250 5.120 4.921 5.247 . 0 0 "[ . 1 . 2]" 1
1353 1 61 GLN H 1 61 GLN HB2 . . 2.970 2.491 2.403 2.588 . 0 0 "[ . 1 . 2]" 1
1354 1 61 GLN H 1 61 GLN HG2 . . 3.830 3.025 2.843 3.194 . 0 0 "[ . 1 . 2]" 1
1355 1 61 GLN H 1 61 GLN HG3 . . 3.600 2.421 2.271 2.600 . 0 0 "[ . 1 . 2]" 1
1356 1 61 GLN HA 1 61 GLN HB3 . . 2.880 2.499 2.453 2.581 . 0 0 "[ . 1 . 2]" 1
1357 1 61 GLN HA 1 61 GLN HG2 . . 3.420 2.358 2.238 2.434 . 0 0 "[ . 1 . 2]" 1
1358 1 61 GLN HA 1 61 GLN HG3 . . 3.620 3.360 3.266 3.411 . 0 0 "[ . 1 . 2]" 1
1359 1 61 GLN HA 1 63 PRO HD3 . . 4.800 4.081 3.926 4.241 . 0 0 "[ . 1 . 2]" 1
1360 1 61 GLN HB2 1 62 GLU H . . 3.310 2.326 2.049 2.600 . 0 0 "[ . 1 . 2]" 1
1361 1 61 GLN HG2 1 62 GLU H . . 4.920 4.720 4.603 4.810 . 0 0 "[ . 1 . 2]" 1
1362 1 62 GLU H 1 62 GLU QB . . 2.960 2.413 2.348 2.531 . 0 0 "[ . 1 . 2]" 1
1363 1 62 GLU H 1 62 GLU HG2 . . 4.800 4.373 4.029 4.673 . 0 0 "[ . 1 . 2]" 1
1364 1 62 GLU H 1 62 GLU QG . . 3.950 3.733 2.781 4.042 0.092 9 0 "[ . 1 . 2]" 1
1365 1 62 GLU H 1 62 GLU HG3 . . 4.800 4.147 2.834 4.690 . 0 0 "[ . 1 . 2]" 1
1366 1 62 GLU H 1 63 PRO HD2 . . 4.730 4.354 4.289 4.432 . 0 0 "[ . 1 . 2]" 1
1367 1 62 GLU H 1 63 PRO HD3 . . 4.230 3.765 3.651 3.887 . 0 0 "[ . 1 . 2]" 1
1368 1 62 GLU HA 1 62 GLU HG2 . . 3.960 3.129 2.166 3.877 . 0 0 "[ . 1 . 2]" 1
1369 1 62 GLU HA 1 62 GLU QG . . 3.350 2.415 2.145 2.830 . 0 0 "[ . 1 . 2]" 1
1370 1 62 GLU HA 1 62 GLU HG3 . . 3.960 2.731 2.182 3.469 . 0 0 "[ . 1 . 2]" 1
1371 1 62 GLU HA 1 63 PRO HD2 . . 2.940 1.952 1.929 1.956 . 0 0 "[ . 1 . 2]" 1
1372 1 62 GLU HA 1 63 PRO HD3 . . 3.500 2.682 2.615 2.695 . 0 0 "[ . 1 . 2]" 1
1373 1 62 GLU QB 1 63 PRO HD2 . . 4.220 3.965 3.775 4.111 . 0 0 "[ . 1 . 2]" 1
1374 1 62 GLU QG 1 63 PRO HD2 . . 4.340 3.629 3.393 4.069 . 0 0 "[ . 1 . 2]" 1
1375 1 62 GLU HG2 1 63 PRO HD2 . . 5.170 4.523 3.446 5.193 0.023 13 0 "[ . 1 . 2]" 1
1376 1 62 GLU HG3 1 63 PRO HD2 . . 5.170 4.102 3.566 5.084 . 0 0 "[ . 1 . 2]" 1
1377 1 63 PRO HA 1 64 PRO HD2 . . 2.980 2.264 2.148 2.397 . 0 0 "[ . 1 . 2]" 1
1378 1 63 PRO HA 1 64 PRO HD3 . . 3.020 2.272 2.262 2.305 . 0 0 "[ . 1 . 2]" 1
1379 1 63 PRO HB2 1 64 PRO HD2 . . 3.500 2.696 2.387 2.978 . 0 0 "[ . 1 . 2]" 1
1380 1 63 PRO HB2 1 64 PRO HD3 . . 4.130 4.014 3.771 4.227 0.097 20 0 "[ . 1 . 2]" 1
1381 1 63 PRO HB2 1 65 HIS H . . 4.570 3.167 2.590 3.526 . 0 0 "[ . 1 . 2]" 1
1382 1 63 PRO HB2 1 65 HIS HE1 . . 3.970 2.773 2.392 3.471 . 0 0 "[ . 1 . 2]" 1
1383 1 63 PRO HB2 1 66 LYS H . . 3.920 2.959 2.367 3.347 . 0 0 "[ . 1 . 2]" 1
1384 1 63 PRO HB2 1 66 LYS QB . . 4.130 3.239 2.624 3.580 . 0 0 "[ . 1 . 2]" 1
1385 1 63 PRO HB2 1 66 LYS QG . . 4.340 4.025 3.123 4.379 0.039 8 0 "[ . 1 . 2]" 1
1386 1 63 PRO HB3 1 64 PRO HD2 . . 3.710 3.059 2.882 3.233 . 0 0 "[ . 1 . 2]" 1
1387 1 63 PRO HB3 1 64 PRO HD3 . . 4.400 4.127 3.950 4.287 . 0 0 "[ . 1 . 2]" 1
1388 1 63 PRO HB3 1 65 HIS HE1 . . 3.990 3.142 2.668 3.994 0.004 13 0 "[ . 1 . 2]" 1
1389 1 63 PRO HD2 1 66 LYS QB . . 3.980 3.454 2.923 4.061 0.081 13 0 "[ . 1 . 2]" 1
1390 1 63 PRO HD2 1 66 LYS QG . . 4.490 3.950 2.974 4.492 0.002 15 0 "[ . 1 . 2]" 1
1391 1 63 PRO HD3 1 66 LYS QB . . 4.930 4.503 4.253 4.646 . 0 0 "[ . 1 . 2]" 1
1392 1 63 PRO HG2 1 66 LYS QG . . 3.900 2.603 1.935 3.032 . 0 0 "[ . 1 . 2]" 1
1393 1 63 PRO HG3 1 65 HIS HE1 . . 5.100 2.735 2.080 3.777 . 0 0 "[ . 1 . 2]" 1
1394 1 63 PRO HG3 1 66 LYS QG . . 4.570 3.297 2.700 3.818 . 0 0 "[ . 1 . 2]" 1
1395 1 64 PRO HA 1 67 LYS HD2 . . 5.140 3.879 2.211 5.145 0.005 20 0 "[ . 1 . 2]" 1
1396 1 64 PRO HA 1 67 LYS QD . . 4.390 3.247 2.163 4.187 . 0 0 "[ . 1 . 2]" 1
1397 1 64 PRO HA 1 67 LYS HD3 . . 5.140 3.829 2.238 5.133 . 0 0 "[ . 1 . 2]" 1
1398 1 64 PRO HA 1 67 LYS HG2 . . 5.500 3.895 2.081 5.503 0.003 11 0 "[ . 1 . 2]" 1
1399 1 64 PRO HA 1 67 LYS HG3 . . 5.500 4.286 2.281 5.503 0.003 11 0 "[ . 1 . 2]" 1
1400 1 64 PRO HB2 1 65 HIS HA . . 4.870 3.949 3.903 4.112 . 0 0 "[ . 1 . 2]" 1
1401 1 64 PRO HD2 1 65 HIS H . . 4.820 2.735 2.647 2.788 . 0 0 "[ . 1 . 2]" 1
1402 1 64 PRO HD2 1 65 HIS HE1 . . 5.500 4.957 4.147 5.499 . 0 0 "[ . 1 . 2]" 1
1403 1 64 PRO HG2 1 65 HIS H . . 4.320 1.988 1.871 2.467 . 0 0 "[ . 1 . 2]" 1
1404 1 64 PRO HG2 1 65 HIS HA . . 5.330 4.150 4.089 4.261 . 0 0 "[ . 1 . 2]" 1
1405 1 64 PRO HG2 1 65 HIS QB . . 4.680 3.361 3.235 3.668 . 0 0 "[ . 1 . 2]" 1
1406 1 65 HIS H 1 66 LYS H . . 4.220 2.786 2.599 2.929 . 0 0 "[ . 1 . 2]" 1
1407 1 65 HIS HA 1 65 HIS HB2 . . 2.970 2.358 2.301 2.550 . 0 0 "[ . 1 . 2]" 1
1408 1 65 HIS HA 1 65 HIS HB3 . . 2.970 2.568 2.368 2.643 . 0 0 "[ . 1 . 2]" 1
1409 1 65 HIS HA 1 65 HIS HD2 . . 4.620 4.403 4.240 4.629 0.009 2 0 "[ . 1 . 2]" 1
1410 1 65 HIS QB 1 65 HIS HD2 . . 3.370 2.730 2.651 2.788 . 0 0 "[ . 1 . 2]" 1
1411 1 66 LYS H 1 66 LYS QB . . 3.690 2.256 2.129 2.387 . 0 0 "[ . 1 . 2]" 1
1412 1 66 LYS H 1 66 LYS QG . . 4.310 3.388 2.826 3.949 . 0 0 "[ . 1 . 2]" 1
1413 1 66 LYS HA 1 66 LYS HD2 . . 4.100 3.180 2.011 4.148 0.048 11 0 "[ . 1 . 2]" 1
1414 1 66 LYS HA 1 66 LYS QD . . 3.520 2.599 1.993 3.279 . 0 0 "[ . 1 . 2]" 1
1415 1 66 LYS HA 1 66 LYS HD3 . . 4.100 3.167 2.215 3.830 . 0 0 "[ . 1 . 2]" 1
1416 1 66 LYS HA 1 66 LYS HE2 . . 5.500 3.965 1.975 5.275 . 0 0 "[ . 1 . 2]" 1
1417 1 66 LYS HA 1 66 LYS QE . . 4.840 3.428 1.896 4.551 . 0 0 "[ . 1 . 2]" 1
1418 1 66 LYS HA 1 66 LYS HE3 . . 5.500 3.978 1.984 5.012 . 0 0 "[ . 1 . 2]" 1
1419 1 66 LYS HA 1 66 LYS QG . . 3.720 2.498 2.268 3.048 . 0 0 "[ . 1 . 2]" 1
1420 1 66 LYS QB 1 66 LYS QE . . 4.180 2.887 1.985 3.786 . 0 0 "[ . 1 . 2]" 1
1421 1 66 LYS HB2 1 66 LYS HE2 . . 5.500 4.283 2.260 5.456 . 0 0 "[ . 1 . 2]" 1
1422 1 66 LYS HB2 1 66 LYS HE3 . . 5.500 4.290 3.144 5.488 . 0 0 "[ . 1 . 2]" 1
1423 1 66 LYS HB3 1 66 LYS HE2 . . 5.500 3.647 2.107 4.679 . 0 0 "[ . 1 . 2]" 1
1424 1 66 LYS HB3 1 66 LYS HE3 . . 5.500 3.720 2.020 5.481 . 0 0 "[ . 1 . 2]" 1
1425 1 66 LYS QE 1 66 LYS QG . . 3.330 2.204 2.078 2.556 . 0 0 "[ . 1 . 2]" 1
1426 1 67 LYS H 1 67 LYS QB . . 3.680 2.588 2.201 3.346 . 0 0 "[ . 1 . 2]" 1
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