NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
530163 |
2lcs   |
17629 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lcs
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 1995
_Distance_constraint_stats_list.Viol_count 2138
_Distance_constraint_stats_list.Viol_total 1319.614
_Distance_constraint_stats_list.Viol_max 0.199
_Distance_constraint_stats_list.Viol_rms 0.0104
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0017
_Distance_constraint_stats_list.Viol_average_violations_only 0.0309
_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 2 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 ILE 0.856 0.040 18 0 "[ . 1 . 2]"
1 4 VAL 0.054 0.021 12 0 "[ . 1 . 2]"
1 5 ASN 0.775 0.066 15 0 "[ . 1 . 2]"
1 6 GLN 0.595 0.066 15 0 "[ . 1 . 2]"
1 7 ARG 0.970 0.050 12 0 "[ . 1 . 2]"
1 8 ALA 0.729 0.050 12 0 "[ . 1 . 2]"
1 9 VAL 0.447 0.065 12 0 "[ . 1 . 2]"
1 10 ALA 1.421 0.061 8 0 "[ . 1 . 2]"
1 11 LEU 0.378 0.045 15 0 "[ . 1 . 2]"
1 12 TYR 3.071 0.073 2 0 "[ . 1 . 2]"
1 13 ASP 2.788 0.155 9 0 "[ . 1 . 2]"
1 14 PHE 0.724 0.151 15 0 "[ . 1 . 2]"
1 15 GLU 0.166 0.113 15 0 "[ . 1 . 2]"
1 16 PRO 2.603 0.113 15 0 "[ . 1 . 2]"
1 17 GLU 0.360 0.053 9 0 "[ . 1 . 2]"
1 18 ASN 1.328 0.073 12 0 "[ . 1 . 2]"
1 19 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 ASN 0.759 0.035 4 0 "[ . 1 . 2]"
1 21 GLU 0.565 0.042 9 0 "[ . 1 . 2]"
1 22 LEU 4.822 0.122 6 0 "[ . 1 . 2]"
1 23 ARG 2.072 0.110 16 0 "[ . 1 . 2]"
1 24 LEU 10.921 0.199 14 0 "[ . 1 . 2]"
1 25 ALA 0.744 0.061 8 0 "[ . 1 . 2]"
1 26 GLU 2.378 0.100 19 0 "[ . 1 . 2]"
1 27 GLY 0.025 0.017 14 0 "[ . 1 . 2]"
1 28 ASP 7.828 0.199 14 0 "[ . 1 . 2]"
1 29 ILE 6.972 0.155 10 0 "[ . 1 . 2]"
1 30 VAL 3.797 0.155 10 0 "[ . 1 . 2]"
1 31 PHE 2.070 0.112 10 0 "[ . 1 . 2]"
1 32 ILE 1.881 0.067 15 0 "[ . 1 . 2]"
1 33 SER 2.107 0.112 10 0 "[ . 1 . 2]"
1 34 TYR 2.142 0.070 15 0 "[ . 1 . 2]"
1 35 LYS 2.045 0.070 15 0 "[ . 1 . 2]"
1 36 HIS 2.085 0.055 14 0 "[ . 1 . 2]"
1 37 GLY 0.816 0.044 9 0 "[ . 1 . 2]"
1 38 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 GLY 1.497 0.078 15 0 "[ . 1 . 2]"
1 40 TRP 5.643 0.119 17 0 "[ . 1 . 2]"
1 41 LEU 2.860 0.093 12 0 "[ . 1 . 2]"
1 42 VAL 2.311 0.091 11 0 "[ . 1 . 2]"
1 43 ALA 1.180 0.093 12 0 "[ . 1 . 2]"
1 44 GLU 1.780 0.070 10 0 "[ . 1 . 2]"
1 45 ASN 1.490 0.104 10 0 "[ . 1 . 2]"
1 46 GLU 0.460 0.075 16 0 "[ . 1 . 2]"
1 47 SER 0.003 0.003 12 0 "[ . 1 . 2]"
1 48 GLY 0.296 0.063 16 0 "[ . 1 . 2]"
1 49 SER 1.012 0.169 16 0 "[ . 1 . 2]"
1 50 LYS 3.999 0.169 16 0 "[ . 1 . 2]"
1 51 THR 1.677 0.083 11 0 "[ . 1 . 2]"
1 52 GLY 0.700 0.064 8 0 "[ . 1 . 2]"
1 53 LEU 2.708 0.122 6 0 "[ . 1 . 2]"
1 54 VAL 5.778 0.182 6 0 "[ . 1 . 2]"
1 55 PRO 0.355 0.038 3 0 "[ . 1 . 2]"
1 56 GLU 2.832 0.084 7 0 "[ . 1 . 2]"
1 57 GLU 1.241 0.051 5 0 "[ . 1 . 2]"
1 58 PHE 2.864 0.099 20 0 "[ . 1 . 2]"
1 59 VAL 1.239 0.057 16 0 "[ . 1 . 2]"
1 60 SER 0.028 0.020 14 0 "[ . 1 . 2]"
1 61 TYR 0.101 0.013 15 0 "[ . 1 . 2]"
1 62 ILE 0.705 0.045 3 0 "[ . 1 . 2]"
1 63 GLN 2.225 0.114 16 0 "[ . 1 . 2]"
1 64 PRO 1.415 0.114 16 0 "[ . 1 . 2]"
1 65 GLU 0.169 0.047 7 0 "[ . 1 . 2]"
1 66 LEU 0.525 0.098 9 0 "[ . 1 . 2]"
1 67 GLU 0.169 0.098 9 0 "[ . 1 . 2]"
2 3 PHE 0.652 0.027 11 0 "[ . 1 . 2]"
2 4 ILE 0.090 0.030 17 0 "[ . 1 . 2]"
2 5 PRO 0.534 0.038 5 0 "[ . 1 . 2]"
2 6 SER 0.829 0.073 12 0 "[ . 1 . 2]"
2 7 ARG 0.337 0.034 12 0 "[ . 1 . 2]"
2 8 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
2 9 ALA 0.600 0.034 20 0 "[ . 1 . 2]"
2 10 PRO 0.554 0.038 3 0 "[ . 1 . 2]"
2 11 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 12 PRO 0.704 0.043 6 0 "[ . 1 . 2]"
2 13 PRO 2.800 0.099 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 3 ILE MG 1 5 ASN HB2 . . 5.500 4.143 2.631 5.515 0.015 4 0 "[ . 1 . 2]" 1
2 1 3 ILE MG 1 5 ASN HB3 . . 5.500 4.515 3.828 5.511 0.011 16 0 "[ . 1 . 2]" 1
3 1 6 GLN HA 1 6 GLN HG2 . . 3.800 3.715 3.645 3.762 . 0 0 "[ . 1 . 2]" 1
4 1 6 GLN HA 1 6 GLN HG3 . . 3.870 3.018 2.890 3.337 . 0 0 "[ . 1 . 2]" 1
5 1 6 GLN HA 1 7 ARG HG2 . . 4.950 4.386 4.353 4.455 . 0 0 "[ . 1 . 2]" 1
6 1 6 GLN HB2 1 61 TYR QD . . 4.980 4.560 4.417 4.710 . 0 0 "[ . 1 . 2]" 1
7 1 6 GLN HG3 1 8 ALA MB . . 5.190 4.289 4.085 4.397 . 0 0 "[ . 1 . 2]" 1
8 1 6 GLN HG3 1 7 ARG HG2 . . 5.040 3.908 3.647 4.379 . 0 0 "[ . 1 . 2]" 1
9 1 6 GLN HG2 1 7 ARG HG2 . . 5.500 5.467 5.263 5.505 0.005 16 0 "[ . 1 . 2]" 1
10 1 6 GLN HG3 1 61 TYR QD . . 4.990 3.249 2.943 3.458 . 0 0 "[ . 1 . 2]" 1
11 1 7 ARG HA 1 7 ARG QD . . 4.580 4.364 4.170 4.471 . 0 0 "[ . 1 . 2]" 1
12 1 7 ARG HA 1 7 ARG HG2 . . 4.210 3.620 3.591 3.712 . 0 0 "[ . 1 . 2]" 1
13 1 7 ARG HA 1 32 ILE HG12 . . 4.640 3.878 3.733 4.133 . 0 0 "[ . 1 . 2]" 1
14 1 7 ARG HA 1 7 ARG HG3 . . 4.030 3.886 3.736 3.931 . 0 0 "[ . 1 . 2]" 1
15 1 7 ARG HA 1 29 ILE MG . . 4.740 4.456 4.231 4.674 . 0 0 "[ . 1 . 2]" 1
16 1 7 ARG HB2 1 31 PHE HA . . 5.150 3.826 3.701 3.922 . 0 0 "[ . 1 . 2]" 1
17 1 7 ARG HB3 1 31 PHE HA . . 4.970 4.086 3.974 4.174 . 0 0 "[ . 1 . 2]" 1
18 1 7 ARG HB2 1 29 ILE MG . . 4.330 3.139 2.807 3.382 . 0 0 "[ . 1 . 2]" 1
19 1 7 ARG HB2 1 62 ILE MD . . 4.870 3.482 3.378 3.618 . 0 0 "[ . 1 . 2]" 1
20 1 7 ARG HB3 1 29 ILE MG . . 4.990 4.402 4.090 4.618 . 0 0 "[ . 1 . 2]" 1
21 1 7 ARG HB3 1 62 ILE MD . . 5.460 4.595 4.456 4.706 . 0 0 "[ . 1 . 2]" 1
22 1 7 ARG HB2 1 8 ALA MB . . 4.810 4.700 4.663 4.747 . 0 0 "[ . 1 . 2]" 1
23 1 7 ARG HB3 1 8 ALA MB . . 5.500 5.516 5.499 5.550 0.050 12 0 "[ . 1 . 2]" 1
24 1 7 ARG HB3 1 62 ILE MG . . 5.500 5.495 5.446 5.541 0.041 14 0 "[ . 1 . 2]" 1
25 1 7 ARG HG2 1 62 ILE HB . . 4.220 2.423 2.367 2.526 . 0 0 "[ . 1 . 2]" 1
26 1 7 ARG HG2 1 62 ILE MG . . 4.500 3.800 3.689 3.916 . 0 0 "[ . 1 . 2]" 1
27 1 7 ARG HG3 1 62 ILE MG . . 5.040 3.255 3.195 3.414 . 0 0 "[ . 1 . 2]" 1
28 1 7 ARG HG2 1 8 ALA HA . . 4.940 4.180 4.048 4.408 . 0 0 "[ . 1 . 2]" 1
29 1 7 ARG HG3 1 31 PHE QD . . 4.830 4.804 4.758 4.835 0.005 8 0 "[ . 1 . 2]" 1
30 1 7 ARG HG2 1 31 PHE QD . . 4.790 4.689 4.635 4.726 . 0 0 "[ . 1 . 2]" 1
31 1 7 ARG QD 1 31 PHE QD . . 5.130 4.202 3.998 4.400 . 0 0 "[ . 1 . 2]" 1
32 1 7 ARG HB2 1 7 ARG QD . . 3.570 2.767 2.652 2.863 . 0 0 "[ . 1 . 2]" 1
33 1 7 ARG QD 1 62 ILE HB . . 3.940 2.978 2.761 3.549 . 0 0 "[ . 1 . 2]" 1
34 1 7 ARG HB3 1 7 ARG QD . . 3.480 2.223 2.001 2.377 . 0 0 "[ . 1 . 2]" 1
35 1 7 ARG QD 1 62 ILE MG . . 4.300 3.046 2.784 3.748 . 0 0 "[ . 1 . 2]" 1
36 1 7 ARG QD 1 62 ILE MD . . 3.840 3.286 2.614 3.550 . 0 0 "[ . 1 . 2]" 1
37 1 8 ALA MB 1 30 VAL MG2 . . 3.040 2.485 2.220 2.689 . 0 0 "[ . 1 . 2]" 1
38 1 8 ALA MB 1 61 TYR QE . . 4.440 3.493 3.440 3.590 . 0 0 "[ . 1 . 2]" 1
39 1 8 ALA MB 1 59 VAL HA . . 4.440 4.445 4.398 4.458 0.018 2 0 "[ . 1 . 2]" 1
40 1 8 ALA MB 1 9 VAL H . . 5.120 2.718 2.647 2.788 . 0 0 "[ . 1 . 2]" 1
41 1 7 ARG HA 1 8 ALA MB . . 4.530 3.732 3.712 3.789 . 0 0 "[ . 1 . 2]" 1
42 1 8 ALA MB 1 30 VAL HA . . 5.500 5.487 5.386 5.521 0.021 19 0 "[ . 1 . 2]" 1
43 1 8 ALA MB 1 61 TYR HB3 . . 4.930 4.540 4.396 4.704 . 0 0 "[ . 1 . 2]" 1
44 1 8 ALA MB 1 61 TYR HB2 . . 5.040 4.561 4.439 4.703 . 0 0 "[ . 1 . 2]" 1
45 1 8 ALA MB 1 32 ILE HB . . 4.740 4.095 3.968 4.203 . 0 0 "[ . 1 . 2]" 1
46 1 8 ALA MB 1 9 VAL HB . . 5.110 4.950 4.926 4.984 . 0 0 "[ . 1 . 2]" 1
47 1 7 ARG HG3 1 8 ALA MB . . 5.260 4.841 4.558 4.938 . 0 0 "[ . 1 . 2]" 1
48 1 8 ALA MB 1 62 ILE HG12 . . 5.500 4.987 4.934 5.057 . 0 0 "[ . 1 . 2]" 1
49 1 8 ALA HA 1 61 TYR HA . . 3.190 2.560 2.517 2.614 . 0 0 "[ . 1 . 2]" 1
50 1 7 ARG H 1 8 ALA HA . . 5.480 5.398 5.300 5.482 0.002 12 0 "[ . 1 . 2]" 1
51 1 7 ARG HG3 1 8 ALA HA . . 4.300 3.803 3.468 3.922 . 0 0 "[ . 1 . 2]" 1
52 1 8 ALA HA 1 62 ILE HG13 . . 3.760 2.006 1.993 2.087 . 0 0 "[ . 1 . 2]" 1
53 1 8 ALA HA 1 30 VAL MG2 . . 4.730 4.460 4.317 4.658 . 0 0 "[ . 1 . 2]" 1
54 1 8 ALA HA 1 62 ILE MD . . 3.990 3.007 2.890 3.116 . 0 0 "[ . 1 . 2]" 1
55 1 8 ALA MB 1 62 ILE HG13 . . 3.710 3.665 3.629 3.710 . 0 0 "[ . 1 . 2]" 1
56 1 9 VAL HA 1 9 VAL MG1 . . 3.730 3.189 3.185 3.201 . 0 0 "[ . 1 . 2]" 1
57 1 8 ALA HA 1 9 VAL MG1 . . 4.880 4.003 3.903 4.066 . 0 0 "[ . 1 . 2]" 1
58 1 9 VAL MG1 1 10 ALA HA . . 5.080 4.140 4.062 4.246 . 0 0 "[ . 1 . 2]" 1
59 1 9 VAL MG1 1 60 SER QB . . 3.160 1.934 1.896 2.078 . 0 0 "[ . 1 . 2]" 1
60 1 9 VAL MG1 1 62 ILE HG12 . . 4.240 2.906 2.766 3.047 . 0 0 "[ . 1 . 2]" 1
61 1 9 VAL MG1 1 11 LEU HG . . 4.250 3.607 3.441 3.917 . 0 0 "[ . 1 . 2]" 1
62 1 9 VAL MG1 1 11 LEU HB3 . . 5.100 4.918 4.809 5.074 . 0 0 "[ . 1 . 2]" 1
63 1 9 VAL MG1 1 59 VAL MG1 . . 5.410 4.568 4.477 4.660 . 0 0 "[ . 1 . 2]" 1
64 1 9 VAL MG2 1 29 ILE HA . . 4.190 3.632 3.536 3.751 . 0 0 "[ . 1 . 2]" 1
65 1 9 VAL MG2 1 28 ASP HA . . 5.500 4.835 4.718 4.951 . 0 0 "[ . 1 . 2]" 1
66 1 9 VAL MG2 1 60 SER QB . . 4.540 4.257 4.186 4.400 . 0 0 "[ . 1 . 2]" 1
67 1 9 VAL MG2 1 27 GLY HA2 . . 3.530 3.062 2.812 3.204 . 0 0 "[ . 1 . 2]" 1
68 1 9 VAL MG2 1 10 ALA MB . . 3.930 3.456 3.425 3.536 . 0 0 "[ . 1 . 2]" 1
69 1 9 VAL MG2 1 29 ILE HG13 . . 5.040 4.813 4.126 5.046 0.006 10 0 "[ . 1 . 2]" 1
70 1 9 VAL MG2 1 62 ILE HG12 . . 4.400 4.341 4.190 4.401 0.001 1 0 "[ . 1 . 2]" 1
71 1 9 VAL MG2 1 29 ILE HG12 . . 4.110 3.545 2.731 3.801 . 0 0 "[ . 1 . 2]" 1
72 1 9 VAL MG2 1 11 LEU HG . . 5.160 4.885 4.749 5.116 . 0 0 "[ . 1 . 2]" 1
73 1 9 VAL MG2 1 11 LEU MD2 . . 3.970 3.404 3.292 3.534 . 0 0 "[ . 1 . 2]" 1
74 1 9 VAL HB 1 29 ILE HG12 . . 5.500 5.159 4.011 5.496 . 0 0 "[ . 1 . 2]" 1
75 1 8 ALA HA 1 9 VAL HB . . 4.880 4.361 4.340 4.373 . 0 0 "[ . 1 . 2]" 1
76 1 9 VAL HB 1 29 ILE HA . . 5.380 4.683 4.549 4.783 . 0 0 "[ . 1 . 2]" 1
77 1 9 VAL HB 1 62 ILE HG13 . . 4.320 3.294 3.193 3.418 . 0 0 "[ . 1 . 2]" 1
78 1 9 VAL HB 1 11 LEU MD2 . . 4.900 4.607 4.517 4.752 . 0 0 "[ . 1 . 2]" 1
79 1 9 VAL HA 1 29 ILE HA . . 3.230 2.713 2.520 2.961 . 0 0 "[ . 1 . 2]" 1
80 1 9 VAL HA 1 10 ALA MB . . 4.190 3.967 3.927 3.998 . 0 0 "[ . 1 . 2]" 1
81 1 9 VAL HA 1 29 ILE HG12 . . 4.700 4.198 3.181 4.513 . 0 0 "[ . 1 . 2]" 1
82 1 9 VAL HA 1 9 VAL MG2 . . 3.130 2.265 2.183 2.322 . 0 0 "[ . 1 . 2]" 1
83 1 9 VAL HA 1 30 VAL MG2 . . 4.420 3.655 3.479 4.024 . 0 0 "[ . 1 . 2]" 1
84 1 9 VAL HA 1 62 ILE MD . . 4.140 2.933 2.783 3.277 . 0 0 "[ . 1 . 2]" 1
85 1 10 ALA HA 1 24 LEU MD1 . . 5.080 4.607 4.393 4.768 . 0 0 "[ . 1 . 2]" 1
86 1 10 ALA MB 1 26 GLU HG2 . . 4.750 4.578 4.523 4.662 . 0 0 "[ . 1 . 2]" 1
87 1 10 ALA MB 1 24 LEU HG . . 4.420 1.957 1.942 1.979 . 0 0 "[ . 1 . 2]" 1
88 1 10 ALA MB 1 28 ASP HB3 . . 3.940 3.379 2.161 3.682 . 0 0 "[ . 1 . 2]" 1
89 1 10 ALA MB 1 28 ASP HB2 . . 3.940 2.419 2.128 3.179 . 0 0 "[ . 1 . 2]" 1
90 1 10 ALA MB 1 25 ALA MB . . 3.920 3.957 3.920 3.981 0.061 8 0 "[ . 1 . 2]" 1
91 1 10 ALA MB 1 24 LEU MD1 . . 3.400 3.043 2.880 3.204 . 0 0 "[ . 1 . 2]" 1
92 1 10 ALA MB 1 24 LEU MD2 . . 3.400 2.767 2.652 2.849 . 0 0 "[ . 1 . 2]" 1
93 1 10 ALA MB 1 11 LEU HG . . 4.970 4.896 4.752 4.990 0.020 5 0 "[ . 1 . 2]" 1
94 1 10 ALA MB 1 30 VAL MG2 . . 3.940 3.431 3.320 3.738 . 0 0 "[ . 1 . 2]" 1
95 1 10 ALA MB 1 59 VAL MG1 . . 4.120 2.968 2.720 3.109 . 0 0 "[ . 1 . 2]" 1
96 1 10 ALA MB 1 30 VAL MG1 . . 3.970 3.874 3.730 3.971 0.001 18 0 "[ . 1 . 2]" 1
97 1 10 ALA MB 1 13 ASP HA . . 4.420 3.967 3.870 4.102 . 0 0 "[ . 1 . 2]" 1
98 1 10 ALA MB 1 28 ASP HA . . 4.380 3.933 3.803 4.052 . 0 0 "[ . 1 . 2]" 1
99 1 10 ALA MB 1 24 LEU HA . . 4.390 3.968 3.910 4.032 . 0 0 "[ . 1 . 2]" 1
100 1 10 ALA MB 1 12 TYR HA . . 4.810 4.647 4.580 4.722 . 0 0 "[ . 1 . 2]" 1
101 1 10 ALA MB 1 59 VAL HA . . 4.490 4.186 4.040 4.292 . 0 0 "[ . 1 . 2]" 1
102 1 11 LEU HA 1 26 GLU HG3 . . 4.780 4.055 3.869 4.279 . 0 0 "[ . 1 . 2]" 1
103 1 11 LEU HA 1 11 LEU HG . . 4.050 3.321 3.226 3.407 . 0 0 "[ . 1 . 2]" 1
104 1 9 VAL MG1 1 11 LEU HA . . 4.470 3.939 3.732 4.159 . 0 0 "[ . 1 . 2]" 1
105 1 9 VAL MG2 1 11 LEU HA . . 4.950 4.043 3.915 4.282 . 0 0 "[ . 1 . 2]" 1
106 1 11 LEU HB2 1 58 PHE HA . . 4.830 3.253 3.128 3.432 . 0 0 "[ . 1 . 2]" 1
107 1 11 LEU HB3 1 12 TYR HA . . 5.500 5.100 5.034 5.178 . 0 0 "[ . 1 . 2]" 1
108 1 11 LEU HB3 1 58 PHE HA . . 5.500 4.916 4.793 5.135 . 0 0 "[ . 1 . 2]" 1
109 1 11 LEU HB2 1 11 LEU MD2 . . 3.290 3.177 3.168 3.179 . 0 0 "[ . 1 . 2]" 1
110 1 9 VAL MG1 1 11 LEU MD2 . . 3.100 2.032 1.941 2.119 . 0 0 "[ . 1 . 2]" 1
111 1 11 LEU HB3 1 11 LEU MD2 . . 3.220 2.298 2.222 2.357 . 0 0 "[ . 1 . 2]" 1
112 1 11 LEU MD2 1 60 SER QB . . 2.950 1.817 1.752 1.975 . 0 0 "[ . 1 . 2]" 1
113 1 11 LEU HA 1 11 LEU MD2 . . 2.790 2.174 2.094 2.310 . 0 0 "[ . 1 . 2]" 1
114 1 10 ALA HA 1 11 LEU MD2 . . 4.760 4.168 3.816 4.418 . 0 0 "[ . 1 . 2]" 1
115 1 11 LEU MD2 1 12 TYR QE . . 4.800 4.721 4.606 4.805 0.005 18 0 "[ . 1 . 2]" 1
116 1 10 ALA HA 1 11 LEU HG . . 4.780 3.670 3.545 3.764 . 0 0 "[ . 1 . 2]" 1
117 1 11 LEU HB2 1 11 LEU MD1 . . 3.180 2.233 2.152 2.337 . 0 0 "[ . 1 . 2]" 1
118 1 9 VAL MG1 1 11 LEU MD1 . . 4.100 4.063 4.007 4.145 0.045 15 0 "[ . 1 . 2]" 1
119 1 11 LEU MD1 1 58 PHE HA . . 4.290 3.247 3.131 3.403 . 0 0 "[ . 1 . 2]" 1
120 1 11 LEU MD1 1 60 SER HA . . 4.150 3.401 3.266 3.556 . 0 0 "[ . 1 . 2]" 1
121 1 11 LEU HA 1 11 LEU MD1 . . 4.100 3.946 3.899 3.977 . 0 0 "[ . 1 . 2]" 1
122 1 11 LEU MD1 1 60 SER QB . . 3.090 2.223 2.062 2.455 . 0 0 "[ . 1 . 2]" 1
123 1 11 LEU MD1 2 12 PRO HB3 . . 4.860 4.698 4.454 4.864 0.004 12 0 "[ . 1 . 2]" 1
124 1 11 LEU HB3 1 11 LEU MD1 . . 3.260 2.444 2.367 2.489 . 0 0 "[ . 1 . 2]" 1
125 1 12 TYR HB3 2 13 PRO HG3 . . 5.060 4.206 3.895 4.354 . 0 0 "[ . 1 . 2]" 1
126 1 12 TYR HB2 2 13 PRO HG3 . . 5.500 5.361 5.160 5.513 0.013 3 0 "[ . 1 . 2]" 1
127 1 13 ASP HA 1 25 ALA HA . . 3.210 1.988 1.965 2.029 . 0 0 "[ . 1 . 2]" 1
128 1 13 ASP HA 1 25 ALA MB . . 3.940 3.712 3.691 3.760 . 0 0 "[ . 1 . 2]" 1
129 1 14 PHE HB2 1 24 LEU HB3 . . 4.880 4.093 3.849 4.247 . 0 0 "[ . 1 . 2]" 1
130 1 14 PHE HB3 1 24 LEU HB3 . . 3.890 2.592 2.460 2.729 . 0 0 "[ . 1 . 2]" 1
131 1 14 PHE HB2 1 24 LEU HB2 . . 4.750 4.457 4.261 4.608 . 0 0 "[ . 1 . 2]" 1
132 1 14 PHE HB2 1 55 PRO QB . . 5.220 4.354 4.127 4.539 . 0 0 "[ . 1 . 2]" 1
133 1 14 PHE HA 1 24 LEU HB3 . . 5.500 4.791 4.678 4.901 . 0 0 "[ . 1 . 2]" 1
134 1 15 GLU HA 1 16 PRO HD2 . . 3.350 2.185 2.130 2.271 . 0 0 "[ . 1 . 2]" 1
135 1 15 GLU QB 1 16 PRO HD2 . . 3.840 3.249 2.930 3.453 . 0 0 "[ . 1 . 2]" 1
136 1 16 PRO HD2 1 23 ARG HG2 . . 4.560 2.638 2.218 3.140 . 0 0 "[ . 1 . 2]" 1
137 1 16 PRO HD2 1 23 ARG HG3 . . 4.560 4.034 2.767 4.570 0.010 7 0 "[ . 1 . 2]" 1
138 1 15 GLU HG3 1 16 PRO HD2 . . 4.700 2.361 1.989 3.536 . 0 0 "[ . 1 . 2]" 1
139 1 15 GLU HG2 1 16 PRO HD2 . . 4.700 2.341 1.941 3.565 . 0 0 "[ . 1 . 2]" 1
140 1 16 PRO HD3 1 23 ARG HG3 . . 4.530 3.325 2.135 4.061 . 0 0 "[ . 1 . 2]" 1
141 1 16 PRO HG2 1 17 GLU HA . . 5.490 5.060 4.968 5.156 . 0 0 "[ . 1 . 2]" 1
142 1 16 PRO HG2 1 22 LEU HA . . 5.500 5.479 5.197 5.578 0.078 6 0 "[ . 1 . 2]" 1
143 1 15 GLU HA 1 16 PRO HG3 . . 4.540 4.362 4.341 4.399 . 0 0 "[ . 1 . 2]" 1
144 1 16 PRO HG3 1 22 LEU HA . . 5.110 3.780 3.473 3.888 . 0 0 "[ . 1 . 2]" 1
145 1 14 PHE QE 1 16 PRO HB2 . . 5.280 5.014 4.845 5.212 . 0 0 "[ . 1 . 2]" 1
146 1 64 PRO QG 1 65 GLU HA . . 4.720 4.552 4.425 4.592 . 0 0 "[ . 1 . 2]" 1
147 1 16 PRO HG3 1 23 ARG HA . . 4.030 3.628 3.486 3.835 . 0 0 "[ . 1 . 2]" 1
148 1 16 PRO HD2 1 23 ARG HB3 . . 4.180 3.648 3.516 3.752 . 0 0 "[ . 1 . 2]" 1
149 1 16 PRO HG3 1 21 GLU HB3 . . 5.000 4.414 4.229 4.672 . 0 0 "[ . 1 . 2]" 1
150 1 29 ILE HG13 1 46 GLU QG . . 5.230 3.801 3.365 5.161 . 0 0 "[ . 1 . 2]" 1
151 1 16 PRO HB2 1 21 GLU HB3 . . 3.540 3.173 2.956 3.399 . 0 0 "[ . 1 . 2]" 1
152 1 16 PRO HB3 1 21 GLU HB3 . . 3.260 2.154 1.995 2.390 . 0 0 "[ . 1 . 2]" 1
153 1 16 PRO HA 1 21 GLU HB3 . . 3.850 2.786 2.398 3.001 . 0 0 "[ . 1 . 2]" 1
154 1 4 VAL HA 1 6 GLN HB2 . . 5.500 5.286 5.164 5.497 . 0 0 "[ . 1 . 2]" 1
155 1 15 GLU HA 1 23 ARG HA . . 4.020 3.094 2.910 3.233 . 0 0 "[ . 1 . 2]" 1
156 1 15 GLU HA 1 16 PRO HG2 . . 4.490 4.340 4.297 4.408 . 0 0 "[ . 1 . 2]" 1
157 1 17 GLU HA 1 17 GLU HG2 . . 3.850 2.654 2.152 3.820 . 0 0 "[ . 1 . 2]" 1
158 1 17 GLU HA 1 17 GLU HG3 . . 3.850 3.223 2.282 3.628 . 0 0 "[ . 1 . 2]" 1
159 1 20 ASN HD21 1 21 GLU HG2 . . 4.990 3.908 3.423 4.224 . 0 0 "[ . 1 . 2]" 1
160 1 20 ASN HD21 1 21 GLU HG3 . . 4.990 4.167 3.623 4.995 0.005 15 0 "[ . 1 . 2]" 1
161 1 14 PHE QE 1 21 GLU HB2 . . 4.940 4.651 4.415 4.872 . 0 0 "[ . 1 . 2]" 1
162 1 21 GLU HA 1 53 LEU HB3 . . 4.590 3.964 3.785 4.180 . 0 0 "[ . 1 . 2]" 1
163 1 21 GLU HA 1 53 LEU HG . . 4.920 3.556 3.303 4.089 . 0 0 "[ . 1 . 2]" 1
164 1 21 GLU HA 1 53 LEU HB2 . . 3.990 2.236 2.066 2.470 . 0 0 "[ . 1 . 2]" 1
165 1 16 PRO HB2 1 21 GLU HB2 . . 4.200 2.209 2.127 2.325 . 0 0 "[ . 1 . 2]" 1
166 1 16 PRO HA 1 21 GLU HB2 . . 4.540 3.085 2.861 3.258 . 0 0 "[ . 1 . 2]" 1
167 1 22 LEU HA 1 52 GLY QA . . 4.550 3.517 3.373 3.667 . 0 0 "[ . 1 . 2]" 1
168 1 22 LEU HA 1 22 LEU HG . . 3.790 2.890 2.250 3.392 . 0 0 "[ . 1 . 2]" 1
169 1 22 LEU MD1 1 50 LYS HG3 . . 4.320 2.321 1.892 3.110 . 0 0 "[ . 1 . 2]" 1
170 1 22 LEU MD1 1 50 LYS HG2 . . 4.620 2.541 1.931 3.487 . 0 0 "[ . 1 . 2]" 1
171 1 22 LEU MD1 1 50 LYS QE . . 5.030 3.082 1.904 4.675 . 0 0 "[ . 1 . 2]" 1
172 1 22 LEU MD1 1 52 GLY QA . . 4.290 3.161 2.388 3.737 . 0 0 "[ . 1 . 2]" 1
173 1 22 LEU HA 1 22 LEU MD1 . . 3.950 2.655 1.965 3.790 . 0 0 "[ . 1 . 2]" 1
174 1 22 LEU MD1 1 51 THR HA . . 4.230 3.227 1.954 4.175 . 0 0 "[ . 1 . 2]" 1
175 1 22 LEU MD1 1 44 GLU HA . . 4.420 3.315 2.160 4.230 . 0 0 "[ . 1 . 2]" 1
176 1 22 LEU MD1 1 45 ASN HA . . 5.100 4.266 3.454 5.012 . 0 0 "[ . 1 . 2]" 1
177 1 22 LEU MD2 1 51 THR HA . . 4.230 3.566 2.813 4.313 0.083 11 0 "[ . 1 . 2]" 1
178 1 22 LEU MD2 1 44 GLU HA . . 4.420 3.065 2.330 4.349 . 0 0 "[ . 1 . 2]" 1
179 1 22 LEU HA 1 22 LEU MD2 . . 3.950 3.511 2.068 3.949 . 0 0 "[ . 1 . 2]" 1
180 1 22 LEU MD2 1 50 LYS QE . . 5.030 4.002 3.216 4.749 . 0 0 "[ . 1 . 2]" 1
181 1 24 LEU HG 1 54 VAL MG2 . . 5.190 5.348 5.310 5.372 0.182 6 0 "[ . 1 . 2]" 1
182 1 54 VAL MG2 1 55 PRO HD2 . . 4.810 3.375 3.311 3.490 . 0 0 "[ . 1 . 2]" 1
183 1 22 LEU MD2 1 50 LYS HG3 . . 4.320 3.302 2.239 4.051 . 0 0 "[ . 1 . 2]" 1
184 1 22 LEU MD2 1 50 LYS HG2 . . 4.620 3.178 2.257 3.647 . 0 0 "[ . 1 . 2]" 1
185 1 22 LEU HB3 1 43 ALA MB . . 5.500 4.750 4.601 4.915 . 0 0 "[ . 1 . 2]" 1
186 1 22 LEU HB3 1 53 LEU HB2 . . 5.500 5.196 4.784 5.622 0.122 6 0 "[ . 1 . 2]" 1
187 1 22 LEU HB2 1 43 ALA MB . . 5.500 5.333 5.064 5.515 0.015 20 0 "[ . 1 . 2]" 1
188 1 22 LEU HB2 1 53 LEU HB2 . . 5.500 5.181 4.547 5.523 0.023 15 0 "[ . 1 . 2]" 1
189 1 16 PRO HD3 1 23 ARG HA . . 3.490 1.965 1.931 2.030 . 0 0 "[ . 1 . 2]" 1
190 1 16 PRO HD2 1 23 ARG HA . . 3.780 3.550 3.507 3.624 . 0 0 "[ . 1 . 2]" 1
191 1 23 ARG HA 1 23 ARG HD2 . . 4.950 4.488 4.104 4.974 0.024 1 0 "[ . 1 . 2]" 1
192 1 23 ARG HA 1 23 ARG HG3 . . 4.040 3.287 2.672 3.771 . 0 0 "[ . 1 . 2]" 1
193 1 23 ARG HA 1 23 ARG HG2 . . 4.040 2.867 2.693 3.464 . 0 0 "[ . 1 . 2]" 1
194 1 16 PRO HG2 1 23 ARG HA . . 5.010 4.806 4.713 4.945 . 0 0 "[ . 1 . 2]" 1
195 1 41 LEU HG 1 56 GLU HB3 . . 3.940 3.799 3.734 3.895 . 0 0 "[ . 1 . 2]" 1
196 1 16 PRO HD2 1 23 ARG HB2 . . 5.060 4.974 4.759 5.082 0.022 12 0 "[ . 1 . 2]" 1
197 1 16 PRO HD3 1 23 ARG HB2 . . 4.560 4.102 4.006 4.211 . 0 0 "[ . 1 . 2]" 1
198 1 16 PRO HG3 1 23 ARG HG3 . . 3.710 2.818 1.923 3.561 . 0 0 "[ . 1 . 2]" 1
199 1 16 PRO HG3 1 23 ARG HG2 . . 3.710 2.252 1.963 3.211 . 0 0 "[ . 1 . 2]" 1
200 1 16 PRO HD3 1 23 ARG HG2 . . 4.530 2.286 2.054 2.887 . 0 0 "[ . 1 . 2]" 1
201 1 16 PRO HD2 1 23 ARG HD3 . . 5.100 3.904 2.018 5.146 0.046 9 0 "[ . 1 . 2]" 1
202 1 16 PRO HD3 1 23 ARG HD3 . . 5.180 4.126 2.661 4.879 . 0 0 "[ . 1 . 2]" 1
203 1 16 PRO HD3 1 23 ARG HD2 . . 5.180 4.317 3.826 4.886 . 0 0 "[ . 1 . 2]" 1
204 1 16 PRO HD2 1 23 ARG HD2 . . 5.100 4.201 3.523 5.160 0.060 3 0 "[ . 1 . 2]" 1
205 1 23 ARG HA 1 23 ARG HD3 . . 4.950 4.527 3.605 4.934 . 0 0 "[ . 1 . 2]" 1
206 1 16 PRO HG3 1 23 ARG HD3 . . 4.590 3.830 2.929 4.627 0.037 14 0 "[ . 1 . 2]" 1
207 1 16 PRO HG3 1 23 ARG HD2 . . 4.590 4.233 3.611 4.662 0.072 3 0 "[ . 1 . 2]" 1
208 1 23 ARG HB3 1 23 ARG HD3 . . 3.900 3.173 2.061 3.626 . 0 0 "[ . 1 . 2]" 1
209 1 23 ARG HB3 1 23 ARG HD2 . . 3.900 2.873 2.146 3.948 0.048 5 0 "[ . 1 . 2]" 1
210 1 14 PHE QD 1 23 ARG HA . . 4.900 3.476 3.213 3.732 . 0 0 "[ . 1 . 2]" 1
211 1 24 LEU HA 1 24 LEU HG . . 4.110 2.776 2.745 2.808 . 0 0 "[ . 1 . 2]" 1
212 1 23 ARG HB2 1 24 LEU HA . . 4.950 4.363 4.264 4.518 . 0 0 "[ . 1 . 2]" 1
213 1 24 LEU HA 1 24 LEU MD1 . . 3.980 2.048 2.027 2.072 . 0 0 "[ . 1 . 2]" 1
214 1 14 PHE HB3 1 24 LEU HB2 . . 4.180 2.706 2.507 2.848 . 0 0 "[ . 1 . 2]" 1
215 1 24 LEU HB2 1 58 PHE HB3 . . 5.500 5.160 4.951 5.258 . 0 0 "[ . 1 . 2]" 1
216 1 24 LEU HB3 1 58 PHE HB3 . . 5.320 4.406 4.218 4.487 . 0 0 "[ . 1 . 2]" 1
217 1 10 ALA MB 1 24 LEU HB2 . . 4.760 4.536 4.478 4.575 . 0 0 "[ . 1 . 2]" 1
218 1 10 ALA MB 1 24 LEU HB3 . . 4.020 3.567 3.490 3.636 . 0 0 "[ . 1 . 2]" 1
219 1 24 LEU HG 1 55 PRO HD2 . . 5.460 4.904 4.740 5.005 . 0 0 "[ . 1 . 2]" 1
220 1 24 LEU MD1 1 43 ALA MB . . 4.730 3.885 3.755 3.999 . 0 0 "[ . 1 . 2]" 1
221 1 24 LEU HB2 1 24 LEU MD1 . . 3.580 2.384 2.363 2.403 . 0 0 "[ . 1 . 2]" 1
222 1 24 LEU MD2 1 30 VAL MG1 . . 3.570 3.540 3.457 3.586 0.016 15 0 "[ . 1 . 2]" 1
223 1 24 LEU MD1 1 30 VAL MG1 . . 3.570 1.883 1.855 1.918 . 0 0 "[ . 1 . 2]" 1
224 1 24 LEU MD2 1 43 ALA MB . . 4.730 4.490 4.365 4.622 . 0 0 "[ . 1 . 2]" 1
225 1 24 LEU HB2 1 24 LEU MD2 . . 3.580 2.184 2.172 2.220 . 0 0 "[ . 1 . 2]" 1
226 1 64 PRO QG 1 66 LEU MD1 . . 5.210 3.238 2.781 3.419 . 0 0 "[ . 1 . 2]" 1
227 1 10 ALA HA 1 24 LEU MD2 . . 5.080 3.145 3.017 3.278 . 0 0 "[ . 1 . 2]" 1
228 1 24 LEU HA 1 24 LEU MD2 . . 3.980 3.764 3.759 3.769 . 0 0 "[ . 1 . 2]" 1
229 1 24 LEU HG 1 54 VAL MG1 . . 5.190 4.610 4.455 4.682 . 0 0 "[ . 1 . 2]" 1
230 1 14 PHE HB3 1 24 LEU HG . . 5.390 4.775 4.647 4.908 . 0 0 "[ . 1 . 2]" 1
231 1 14 PHE QD 1 24 LEU HG . . 5.500 5.450 5.229 5.532 0.032 14 0 "[ . 1 . 2]" 1
232 1 24 LEU HB3 1 58 PHE QE . . 5.500 5.542 5.521 5.594 0.094 15 0 "[ . 1 . 2]" 1
233 1 24 LEU HB3 1 25 ALA HA . . 5.060 4.109 4.075 4.130 . 0 0 "[ . 1 . 2]" 1
234 1 13 ASP HB2 1 25 ALA HA . . 4.820 2.410 1.986 3.897 . 0 0 "[ . 1 . 2]" 1
235 1 13 ASP HB3 1 25 ALA HA . . 4.820 2.487 2.057 3.596 . 0 0 "[ . 1 . 2]" 1
236 1 25 ALA HA 1 26 GLU HA . . 5.080 4.323 4.318 4.331 . 0 0 "[ . 1 . 2]" 1
237 1 13 ASP HB2 1 25 ALA MB . . 5.500 3.315 3.085 4.724 . 0 0 "[ . 1 . 2]" 1
238 1 25 ALA MB 1 28 ASP HB2 . . 5.500 3.179 2.142 3.481 . 0 0 "[ . 1 . 2]" 1
239 1 11 LEU HA 1 26 GLU HA . . 5.120 4.075 3.860 4.236 . 0 0 "[ . 1 . 2]" 1
240 1 10 ALA HA 1 26 GLU HA . . 4.950 4.697 4.629 4.780 . 0 0 "[ . 1 . 2]" 1
241 1 13 ASP HA 1 26 GLU HA . . 5.260 4.382 4.276 4.568 . 0 0 "[ . 1 . 2]" 1
242 1 12 TYR HA 1 26 GLU HA . . 4.750 3.403 3.194 3.659 . 0 0 "[ . 1 . 2]" 1
243 1 26 GLU HA 1 26 GLU HG3 . . 3.570 3.155 3.063 3.217 . 0 0 "[ . 1 . 2]" 1
244 1 26 GLU HA 1 26 GLU HG2 . . 3.590 2.551 2.490 2.613 . 0 0 "[ . 1 . 2]" 1
245 1 10 ALA MB 1 26 GLU HA . . 3.370 2.625 2.539 2.680 . 0 0 "[ . 1 . 2]" 1
246 1 25 ALA MB 1 26 GLU HA . . 4.580 4.499 4.484 4.522 . 0 0 "[ . 1 . 2]" 1
247 1 9 VAL MG2 1 26 GLU HA . . 5.080 4.962 4.868 5.086 0.006 12 0 "[ . 1 . 2]" 1
248 1 12 TYR HA 1 26 GLU HB3 . . 4.610 4.145 3.931 4.458 . 0 0 "[ . 1 . 2]" 1
249 1 12 TYR HA 1 26 GLU HB2 . . 4.700 2.390 2.179 2.705 . 0 0 "[ . 1 . 2]" 1
250 1 11 LEU HA 1 26 GLU HG2 . . 4.890 3.975 3.711 4.242 . 0 0 "[ . 1 . 2]" 1
251 1 12 TYR HA 1 26 GLU HG2 . . 4.820 4.268 4.030 4.523 . 0 0 "[ . 1 . 2]" 1
252 1 12 TYR HA 1 26 GLU HG3 . . 4.420 3.125 2.883 3.355 . 0 0 "[ . 1 . 2]" 1
253 1 10 ALA MB 1 26 GLU HB2 . . 4.550 4.577 4.544 4.601 0.051 1 0 "[ . 1 . 2]" 1
254 1 26 GLU HA 1 27 GLY HA2 . . 4.700 4.388 4.383 4.394 . 0 0 "[ . 1 . 2]" 1
255 1 26 GLU HA 1 27 GLY HA3 . . 4.740 4.396 4.393 4.399 . 0 0 "[ . 1 . 2]" 1
256 1 9 VAL MG2 1 27 GLY HA3 . . 4.710 4.439 4.209 4.593 . 0 0 "[ . 1 . 2]" 1
257 1 26 GLU HG2 1 27 GLY HA3 . . 5.270 3.826 3.662 3.937 . 0 0 "[ . 1 . 2]" 1
258 1 26 GLU HG2 1 27 GLY HA2 . . 5.150 3.836 3.786 3.899 . 0 0 "[ . 1 . 2]" 1
259 1 28 ASP HA 1 29 ILE HG13 . . 4.900 4.720 3.851 4.963 0.063 14 0 "[ . 1 . 2]" 1
260 1 28 ASP HA 1 29 ILE MD . . 5.500 4.936 4.829 5.206 . 0 0 "[ . 1 . 2]" 1
261 1 28 ASP HA 1 30 VAL MG1 . . 5.500 5.347 5.229 5.458 . 0 0 "[ . 1 . 2]" 1
262 1 13 ASP HB3 1 25 ALA MB . . 5.500 3.476 3.038 4.596 . 0 0 "[ . 1 . 2]" 1
263 1 25 ALA MB 1 28 ASP HB3 . . 5.500 3.839 3.497 4.030 . 0 0 "[ . 1 . 2]" 1
264 1 28 ASP HB2 1 30 VAL MG1 . . 4.690 4.284 4.093 4.812 0.122 15 0 "[ . 1 . 2]" 1
265 1 10 ALA MB 1 29 ILE HA . . 4.810 4.323 4.172 4.593 . 0 0 "[ . 1 . 2]" 1
266 1 29 ILE HA 1 29 ILE HG12 . . 3.950 2.643 2.363 2.743 . 0 0 "[ . 1 . 2]" 1
267 1 29 ILE HA 1 29 ILE MD . . 3.370 2.605 2.355 3.497 0.127 16 0 "[ . 1 . 2]" 1
268 1 29 ILE HB 1 46 GLU QG . . 3.890 2.451 1.978 3.621 . 0 0 "[ . 1 . 2]" 1
269 1 29 ILE HA 1 29 ILE HG13 . . 4.230 3.710 3.475 3.773 . 0 0 "[ . 1 . 2]" 1
270 1 29 ILE HG12 1 29 ILE MG . . 3.470 3.062 2.683 3.157 . 0 0 "[ . 1 . 2]" 1
271 1 29 ILE HG13 1 29 ILE MG . . 3.300 2.705 2.580 3.121 . 0 0 "[ . 1 . 2]" 1
272 1 29 ILE MG 1 46 GLU QG . . 3.770 3.055 2.307 3.776 0.006 12 0 "[ . 1 . 2]" 1
273 1 7 ARG QD 1 29 ILE MG . . 4.430 4.199 3.737 4.414 . 0 0 "[ . 1 . 2]" 1
274 1 29 ILE HA 1 29 ILE MG . . 3.260 2.348 2.309 2.418 . 0 0 "[ . 1 . 2]" 1
275 1 9 VAL HA 1 29 ILE MG . . 4.410 3.770 3.452 4.193 . 0 0 "[ . 1 . 2]" 1
276 1 29 ILE HB 1 29 ILE MD . . 3.230 3.086 2.711 3.181 . 0 0 "[ . 1 . 2]" 1
277 1 29 ILE MD 1 46 GLU QG . . 4.660 4.419 3.857 4.661 0.001 3 0 "[ . 1 . 2]" 1
278 1 7 ARG QD 1 29 ILE MD . . 4.800 4.652 4.138 4.808 0.008 19 0 "[ . 1 . 2]" 1
279 1 9 VAL HA 1 29 ILE MD . . 3.910 3.182 2.792 3.975 0.065 12 0 "[ . 1 . 2]" 1
280 1 29 ILE MD 1 30 VAL H . . 4.890 3.859 3.546 4.846 . 0 0 "[ . 1 . 2]" 1
281 1 29 ILE MD 1 29 ILE MG . . 2.400 1.849 1.771 1.878 . 0 0 "[ . 1 . 2]" 1
282 1 30 VAL MG1 1 54 VAL HB . . 4.880 4.528 4.341 4.673 . 0 0 "[ . 1 . 2]" 1
283 1 28 ASP HB3 1 30 VAL MG1 . . 4.690 3.659 3.434 3.836 . 0 0 "[ . 1 . 2]" 1
284 1 30 VAL MG1 1 45 ASN HB2 . . 4.480 3.985 3.629 4.466 . 0 0 "[ . 1 . 2]" 1
285 1 30 VAL HA 1 30 VAL MG1 . . 3.080 2.206 2.069 2.261 . 0 0 "[ . 1 . 2]" 1
286 1 30 VAL MG1 1 45 ASN HA . . 3.310 2.240 2.009 2.513 . 0 0 "[ . 1 . 2]" 1
287 1 30 VAL H 1 30 VAL MG1 . . 4.730 3.323 2.975 3.466 . 0 0 "[ . 1 . 2]" 1
288 1 30 VAL MG2 1 43 ALA MB . . 3.390 3.026 2.658 3.159 . 0 0 "[ . 1 . 2]" 1
289 1 29 ILE HG12 1 30 VAL MG2 . . 5.500 5.589 5.543 5.655 0.155 10 0 "[ . 1 . 2]" 1
290 1 24 LEU HB2 1 30 VAL MG2 . . 5.500 5.501 5.449 5.535 0.035 14 0 "[ . 1 . 2]" 1
291 1 30 VAL MG2 1 32 ILE HG12 . . 4.260 3.821 3.368 3.995 . 0 0 "[ . 1 . 2]" 1
292 1 30 VAL MG2 1 59 VAL HB . . 4.730 3.691 3.608 3.878 . 0 0 "[ . 1 . 2]" 1
293 1 30 VAL HA 1 30 VAL MG2 . . 3.690 3.175 3.167 3.194 . 0 0 "[ . 1 . 2]" 1
294 1 29 ILE HA 1 30 VAL MG2 . . 4.400 3.318 3.220 3.579 . 0 0 "[ . 1 . 2]" 1
295 1 41 LEU HB3 1 42 VAL MG2 . . 5.270 5.046 4.979 5.104 . 0 0 "[ . 1 . 2]" 1
296 1 24 LEU HB2 1 30 VAL MG1 . . 5.360 4.959 4.850 5.018 . 0 0 "[ . 1 . 2]" 1
297 1 24 LEU HA 1 30 VAL MG1 . . 4.540 4.049 3.888 4.142 . 0 0 "[ . 1 . 2]" 1
298 1 7 ARG HA 1 31 PHE HA . . 3.350 2.009 1.992 2.077 . 0 0 "[ . 1 . 2]" 1
299 1 30 VAL HB 1 31 PHE HB2 . . 5.300 5.008 4.830 5.130 . 0 0 "[ . 1 . 2]" 1
300 1 30 VAL HB 1 32 ILE HA . . 5.500 4.893 4.841 4.969 . 0 0 "[ . 1 . 2]" 1
301 1 32 ILE MD 1 32 ILE MG . . 3.020 1.988 1.937 2.066 . 0 0 "[ . 1 . 2]" 1
302 1 32 ILE HG13 1 32 ILE MG . . 3.360 2.282 2.239 2.309 . 0 0 "[ . 1 . 2]" 1
303 1 32 ILE MG 1 41 LEU HB3 . . 3.210 2.417 2.352 2.500 . 0 0 "[ . 1 . 2]" 1
304 1 32 ILE HA 1 32 ILE MG . . 3.320 2.215 2.176 2.247 . 0 0 "[ . 1 . 2]" 1
305 1 32 ILE MG 1 35 LYS HA . . 4.260 3.452 3.378 3.603 . 0 0 "[ . 1 . 2]" 1
306 1 32 ILE MG 1 34 TYR HA . . 4.670 3.287 3.245 3.323 . 0 0 "[ . 1 . 2]" 1
307 1 32 ILE MG 1 41 LEU HA . . 4.360 3.990 3.908 4.052 . 0 0 "[ . 1 . 2]" 1
308 1 32 ILE MG 1 42 VAL HA . . 5.000 4.871 4.819 4.922 . 0 0 "[ . 1 . 2]" 1
309 1 32 ILE MG 1 33 SER HB2 . . 5.150 4.556 4.500 4.582 . 0 0 "[ . 1 . 2]" 1
310 1 32 ILE MG 1 34 TYR HB2 . . 5.430 5.130 5.091 5.166 . 0 0 "[ . 1 . 2]" 1
311 1 32 ILE HB 1 61 TYR QE . . 4.370 3.799 3.642 3.906 . 0 0 "[ . 1 . 2]" 1
312 1 32 ILE MD 1 41 LEU HB2 . . 3.980 2.925 2.786 3.085 . 0 0 "[ . 1 . 2]" 1
313 1 30 VAL HB 1 32 ILE MD . . 4.310 3.139 2.985 3.458 . 0 0 "[ . 1 . 2]" 1
314 1 32 ILE HA 1 32 ILE MD . . 3.200 2.197 2.133 2.248 . 0 0 "[ . 1 . 2]" 1
315 1 31 PHE HA 1 32 ILE MD . . 4.590 3.991 3.818 4.251 . 0 0 "[ . 1 . 2]" 1
316 1 32 ILE MD 1 43 ALA HA . . 3.800 3.490 3.357 3.608 . 0 0 "[ . 1 . 2]" 1
317 1 32 ILE MD 1 61 TYR QE . . 4.490 3.465 3.273 3.665 . 0 0 "[ . 1 . 2]" 1
318 1 30 VAL MG1 1 32 ILE MD . . 4.380 4.190 4.098 4.296 . 0 0 "[ . 1 . 2]" 1
319 1 8 ALA MB 1 32 ILE MD . . 2.910 2.573 2.475 2.708 . 0 0 "[ . 1 . 2]" 1
320 1 32 ILE MD 1 59 VAL HB . . 3.980 3.940 3.810 4.002 0.022 7 0 "[ . 1 . 2]" 1
321 1 8 ALA MB 1 32 ILE HG13 . . 3.690 2.704 2.551 2.784 . 0 0 "[ . 1 . 2]" 1
322 1 8 ALA MB 1 32 ILE HG12 . . 3.820 2.098 1.977 2.242 . 0 0 "[ . 1 . 2]" 1
323 1 32 ILE MG 1 41 LEU HB2 . . 3.630 2.704 2.541 2.838 . 0 0 "[ . 1 . 2]" 1
324 1 6 GLN HB3 1 32 ILE MG . . 4.630 4.258 4.130 4.361 . 0 0 "[ . 1 . 2]" 1
325 1 32 ILE MG 1 35 LYS HB2 . . 4.870 3.775 3.671 4.044 . 0 0 "[ . 1 . 2]" 1
326 1 33 SER HB2 1 42 VAL HB . . 4.710 3.101 2.946 3.170 . 0 0 "[ . 1 . 2]" 1
327 1 33 SER HB3 1 42 VAL HB . . 4.660 4.172 4.078 4.373 . 0 0 "[ . 1 . 2]" 1
328 1 3 ILE MG 1 33 SER HB2 . . 5.040 4.060 3.475 4.470 . 0 0 "[ . 1 . 2]" 1
329 1 3 ILE MG 1 33 SER HB3 . . 5.480 2.709 1.974 3.167 . 0 0 "[ . 1 . 2]" 1
330 1 33 SER HB2 1 42 VAL MG2 . . 5.090 4.581 4.481 4.660 . 0 0 "[ . 1 . 2]" 1
331 1 34 TYR HB2 1 42 VAL HB . . 5.440 5.415 5.299 5.465 0.025 16 0 "[ . 1 . 2]" 1
332 1 34 TYR HB2 1 42 VAL MG2 . . 5.500 5.452 5.268 5.524 0.024 14 0 "[ . 1 . 2]" 1
333 1 34 TYR HB3 1 42 VAL HB . . 5.150 4.965 4.884 5.165 0.015 12 0 "[ . 1 . 2]" 1
334 1 34 TYR HB3 1 42 VAL MG2 . . 5.500 5.501 5.464 5.516 0.016 2 0 "[ . 1 . 2]" 1
335 1 3 ILE MG 1 34 TYR HB2 . . 5.500 5.022 4.644 5.332 . 0 0 "[ . 1 . 2]" 1
336 1 35 LYS HA 1 35 LYS HG3 . . 3.960 2.666 2.643 2.692 . 0 0 "[ . 1 . 2]" 1
337 1 35 LYS HA 1 41 LEU MD1 . . 4.110 3.645 3.541 3.722 . 0 0 "[ . 1 . 2]" 1
338 1 34 TYR HB2 1 35 LYS HB3 . . 5.470 4.829 4.579 4.898 . 0 0 "[ . 1 . 2]" 1
339 1 35 LYS HB3 1 41 LEU MD2 . . 4.240 4.003 3.963 4.049 . 0 0 "[ . 1 . 2]" 1
340 1 32 ILE MG 1 35 LYS HB3 . . 5.500 4.820 4.738 5.050 . 0 0 "[ . 1 . 2]" 1
341 1 35 LYS HB3 1 41 LEU MD1 . . 5.500 4.924 4.805 4.996 . 0 0 "[ . 1 . 2]" 1
342 1 35 LYS HG3 1 41 LEU MD2 . . 3.700 1.943 1.887 2.045 . 0 0 "[ . 1 . 2]" 1
343 1 35 LYS HG3 1 41 LEU MD1 . . 4.660 3.689 3.596 3.828 . 0 0 "[ . 1 . 2]" 1
344 1 35 LYS HG2 1 41 LEU MD1 . . 5.380 5.074 4.996 5.190 . 0 0 "[ . 1 . 2]" 1
345 1 35 LYS HG2 1 36 HIS HA . . 5.090 3.613 3.572 3.664 . 0 0 "[ . 1 . 2]" 1
346 1 35 LYS HA 1 35 LYS QD . . 4.590 3.914 3.891 3.940 . 0 0 "[ . 1 . 2]" 1
347 1 35 LYS HB2 1 35 LYS QD . . 3.510 2.340 2.321 2.360 . 0 0 "[ . 1 . 2]" 1
348 1 35 LYS QD 1 41 LEU MD1 . . 4.120 3.331 3.213 3.548 . 0 0 "[ . 1 . 2]" 1
349 1 35 LYS HB2 1 35 LYS QE . . 4.120 4.012 3.991 4.062 . 0 0 "[ . 1 . 2]" 1
350 1 35 LYS QE 1 35 LYS HG3 . . 3.450 2.557 2.434 2.615 . 0 0 "[ . 1 . 2]" 1
351 1 35 LYS QE 1 35 LYS HG2 . . 3.500 2.202 2.160 2.332 . 0 0 "[ . 1 . 2]" 1
352 1 35 LYS QE 1 41 LEU MD2 . . 3.950 3.245 3.100 3.470 . 0 0 "[ . 1 . 2]" 1
353 1 35 LYS QE 1 41 LEU MD1 . . 4.880 4.499 4.295 4.882 0.002 12 0 "[ . 1 . 2]" 1
354 1 35 LYS HA 1 35 LYS QE . . 5.020 4.865 4.834 4.954 . 0 0 "[ . 1 . 2]" 1
355 1 34 TYR QE 1 36 HIS HA . . 4.400 3.794 3.637 4.127 . 0 0 "[ . 1 . 2]" 1
356 1 34 TYR QD 1 36 HIS HB2 . . 4.960 3.478 3.378 3.661 . 0 0 "[ . 1 . 2]" 1
357 1 35 LYS QE 1 37 GLY HA3 . . 5.500 5.527 5.518 5.544 0.044 9 0 "[ . 1 . 2]" 1
358 1 35 LYS QE 1 37 GLY HA2 . . 4.700 4.048 4.022 4.064 . 0 0 "[ . 1 . 2]" 1
359 1 37 GLY HA2 1 38 GLN QB . . 5.500 4.698 4.664 4.720 . 0 0 "[ . 1 . 2]" 1
360 1 37 GLY HA2 1 38 GLN QG . . 5.500 4.301 4.220 4.664 . 0 0 "[ . 1 . 2]" 1
361 1 38 GLN HA 1 38 GLN QG . . 3.240 2.916 2.499 3.097 . 0 0 "[ . 1 . 2]" 1
362 1 37 GLY HA3 1 38 GLN QG . . 4.720 3.233 3.132 3.691 . 0 0 "[ . 1 . 2]" 1
363 1 38 GLN QG 1 40 TRP HD1 . . 4.090 3.668 3.605 3.857 . 0 0 "[ . 1 . 2]" 1
364 1 39 GLY HA2 1 56 GLU HB2 . . 4.950 4.611 4.398 4.866 . 0 0 "[ . 1 . 2]" 1
365 1 39 GLY HA2 1 56 GLU HB3 . . 4.950 4.314 4.050 4.638 . 0 0 "[ . 1 . 2]" 1
366 1 35 LYS HG3 1 39 GLY HA2 . . 5.360 5.372 5.355 5.399 0.039 4 0 "[ . 1 . 2]" 1
367 1 39 GLY HA2 2 9 ALA MB . . 4.390 4.386 4.271 4.417 0.027 19 0 "[ . 1 . 2]" 1
368 1 40 TRP HA 1 55 PRO HA . . 3.630 3.396 3.262 3.506 . 0 0 "[ . 1 . 2]" 1
369 1 40 TRP HA 2 9 ALA MB . . 4.790 4.025 3.899 4.169 . 0 0 "[ . 1 . 2]" 1
370 1 40 TRP HA 1 53 LEU HB3 . . 5.280 4.659 4.528 4.887 . 0 0 "[ . 1 . 2]" 1
371 1 36 HIS HD2 1 40 TRP HB2 . . 5.190 3.799 3.747 3.838 . 0 0 "[ . 1 . 2]" 1
372 1 36 HIS HD2 1 40 TRP HB3 . . 4.920 4.920 4.864 4.934 0.014 1 0 "[ . 1 . 2]" 1
373 1 40 TRP HB3 1 53 LEU HB2 . . 5.500 4.357 4.147 4.631 . 0 0 "[ . 1 . 2]" 1
374 1 35 LYS HA 1 41 LEU HA . . 3.370 2.665 2.613 2.710 . 0 0 "[ . 1 . 2]" 1
375 1 41 LEU HA 1 42 VAL MG2 . . 4.870 3.620 3.572 3.681 . 0 0 "[ . 1 . 2]" 1
376 1 41 LEU HB2 1 41 LEU MD1 . . 3.620 2.354 2.258 2.449 . 0 0 "[ . 1 . 2]" 1
377 1 41 LEU HB3 1 56 GLU HA . . 5.500 5.559 5.522 5.584 0.084 7 0 "[ . 1 . 2]" 1
378 1 41 LEU HB2 1 56 GLU HA . . 5.050 4.632 4.556 4.722 . 0 0 "[ . 1 . 2]" 1
379 1 41 LEU MD1 1 56 GLU HA . . 3.190 2.203 1.990 2.375 . 0 0 "[ . 1 . 2]" 1
380 1 41 LEU HA 1 41 LEU MD1 . . 4.340 3.929 3.879 3.978 . 0 0 "[ . 1 . 2]" 1
381 1 41 LEU MD1 1 56 GLU HG3 . . 4.010 2.081 2.040 2.140 . 0 0 "[ . 1 . 2]" 1
382 1 32 ILE HG13 1 41 LEU MD1 . . 3.890 3.342 3.137 3.500 . 0 0 "[ . 1 . 2]" 1
383 1 32 ILE MD 1 41 LEU MD1 . . 3.450 3.071 2.830 3.249 . 0 0 "[ . 1 . 2]" 1
384 1 41 LEU MD1 1 59 VAL MG2 . . 3.650 2.901 2.790 3.023 . 0 0 "[ . 1 . 2]" 1
385 1 32 ILE MD 1 41 LEU MD2 . . 5.450 4.887 4.760 4.994 . 0 0 "[ . 1 . 2]" 1
386 1 41 LEU MD2 1 59 VAL MG2 . . 5.500 4.936 4.799 5.071 . 0 0 "[ . 1 . 2]" 1
387 1 41 LEU MD2 1 56 GLU HG3 . . 4.090 3.237 2.874 3.596 . 0 0 "[ . 1 . 2]" 1
388 1 35 LYS HB2 1 41 LEU MD2 . . 3.660 3.010 2.948 3.073 . 0 0 "[ . 1 . 2]" 1
389 1 35 LYS QD 1 41 LEU MD2 . . 3.440 2.680 2.581 2.800 . 0 0 "[ . 1 . 2]" 1
390 1 41 LEU MD2 1 56 GLU HB3 . . 4.240 3.524 3.371 3.635 . 0 0 "[ . 1 . 2]" 1
391 1 41 LEU HB3 1 41 LEU MD2 . . 3.130 2.344 2.279 2.399 . 0 0 "[ . 1 . 2]" 1
392 1 35 LYS HG2 1 41 LEU MD2 . . 3.610 3.381 3.340 3.466 . 0 0 "[ . 1 . 2]" 1
393 1 41 LEU MD2 1 56 GLU HA . . 4.320 4.211 4.015 4.353 0.033 2 0 "[ . 1 . 2]" 1
394 1 41 LEU HA 1 41 LEU MD2 . . 3.110 2.284 2.151 2.425 . 0 0 "[ . 1 . 2]" 1
395 1 35 LYS HA 1 41 LEU MD2 . . 3.090 2.263 2.190 2.399 . 0 0 "[ . 1 . 2]" 1
396 1 41 LEU MD2 1 61 TYR QE . . 5.360 4.924 4.797 5.111 . 0 0 "[ . 1 . 2]" 1
397 1 41 LEU HB2 1 41 LEU MD2 . . 3.410 3.179 3.175 3.182 . 0 0 "[ . 1 . 2]" 1
398 1 32 ILE MD 1 41 LEU HG . . 4.820 4.575 4.372 4.728 . 0 0 "[ . 1 . 2]" 1
399 1 41 LEU HA 1 41 LEU HG . . 3.730 3.550 3.539 3.558 . 0 0 "[ . 1 . 2]" 1
400 1 35 LYS HB2 1 41 LEU HA . . 4.880 4.805 4.721 4.880 . 0 0 "[ . 1 . 2]" 1
401 1 41 LEU HG 1 43 ALA MB . . 5.500 5.558 5.531 5.593 0.093 12 0 "[ . 1 . 2]" 1
402 1 41 LEU HB3 1 41 LEU MD1 . . 3.160 2.272 2.188 2.357 . 0 0 "[ . 1 . 2]" 1
403 1 35 LYS HB2 1 41 LEU MD1 . . 4.300 3.459 3.343 3.541 . 0 0 "[ . 1 . 2]" 1
404 1 42 VAL HA 1 43 ALA MB . . 4.560 4.003 3.969 4.031 . 0 0 "[ . 1 . 2]" 1
405 1 42 VAL HA 1 42 VAL MG1 . . 3.330 2.304 2.255 2.363 . 0 0 "[ . 1 . 2]" 1
406 1 42 VAL MG1 1 43 ALA MB . . 4.570 4.327 4.219 4.394 . 0 0 "[ . 1 . 2]" 1
407 1 42 VAL MG1 1 51 THR HB . . 4.530 4.225 4.102 4.524 . 0 0 "[ . 1 . 2]" 1
408 1 33 SER HB3 1 42 VAL MG1 . . 4.030 3.817 3.555 4.033 0.003 8 0 "[ . 1 . 2]" 1
409 1 33 SER HB2 1 42 VAL MG1 . . 3.970 2.679 2.386 2.891 . 0 0 "[ . 1 . 2]" 1
410 1 42 VAL MG1 1 53 LEU HA . . 5.180 3.685 3.547 3.832 . 0 0 "[ . 1 . 2]" 1
411 1 42 VAL MG1 2 3 PHE HB2 . . 4.730 3.800 3.383 3.978 . 0 0 "[ . 1 . 2]" 1
412 1 42 VAL HA 1 42 VAL MG2 . . 3.200 2.344 2.297 2.384 . 0 0 "[ . 1 . 2]" 1
413 1 42 VAL MG2 1 53 LEU HA . . 4.200 3.295 3.204 3.456 . 0 0 "[ . 1 . 2]" 1
414 1 35 LYS HA 1 42 VAL MG2 . . 5.390 4.852 4.769 4.927 . 0 0 "[ . 1 . 2]" 1
415 1 36 HIS HA 1 42 VAL MG2 . . 5.500 5.029 4.826 5.234 . 0 0 "[ . 1 . 2]" 1
416 1 36 HIS HB3 1 42 VAL MG2 . . 3.790 3.661 3.500 3.785 . 0 0 "[ . 1 . 2]" 1
417 1 42 VAL MG2 1 53 LEU MD1 . . 4.570 3.969 3.680 4.100 . 0 0 "[ . 1 . 2]" 1
418 1 32 ILE HA 1 43 ALA HA . . 3.280 2.381 2.319 2.459 . 0 0 "[ . 1 . 2]" 1
419 1 32 ILE MG 1 43 ALA HA . . 4.470 3.847 3.813 3.886 . 0 0 "[ . 1 . 2]" 1
420 1 42 VAL MG1 1 43 ALA HA . . 4.270 3.665 3.553 3.730 . 0 0 "[ . 1 . 2]" 1
421 1 43 ALA HA 1 51 THR MG . . 4.320 3.536 3.334 3.806 . 0 0 "[ . 1 . 2]" 1
422 1 30 VAL HA 1 43 ALA MB . . 4.780 4.322 4.250 4.436 . 0 0 "[ . 1 . 2]" 1
423 1 32 ILE HA 1 43 ALA MB . . 3.650 2.082 1.936 2.275 . 0 0 "[ . 1 . 2]" 1
424 1 30 VAL HB 1 43 ALA MB . . 3.360 2.364 2.294 2.418 . 0 0 "[ . 1 . 2]" 1
425 1 32 ILE MG 1 43 ALA MB . . 3.720 2.969 2.879 3.104 . 0 0 "[ . 1 . 2]" 1
426 1 8 ALA MB 1 43 ALA MB . . 4.630 4.124 4.057 4.196 . 0 0 "[ . 1 . 2]" 1
427 1 30 VAL MG1 1 43 ALA MB . . 3.450 3.136 2.934 3.271 . 0 0 "[ . 1 . 2]" 1
428 1 32 ILE MD 1 43 ALA MB . . 2.800 1.727 1.712 1.758 . 0 0 "[ . 1 . 2]" 1
429 1 32 ILE HG12 1 43 ALA MB . . 3.900 3.492 3.317 3.586 . 0 0 "[ . 1 . 2]" 1
430 1 43 ALA MB 1 54 VAL MG1 . . 3.010 2.435 2.215 2.766 . 0 0 "[ . 1 . 2]" 1
431 1 43 ALA MB 1 54 VAL MG2 . . 3.010 1.993 1.854 2.180 . 0 0 "[ . 1 . 2]" 1
432 1 44 GLU HA 1 51 THR HA . . 2.920 1.975 1.942 1.992 . 0 0 "[ . 1 . 2]" 1
433 1 43 ALA MB 1 44 GLU HA . . 5.040 4.006 3.943 4.057 . 0 0 "[ . 1 . 2]" 1
434 1 30 VAL MG1 1 44 GLU HA . . 5.350 4.228 4.047 4.543 . 0 0 "[ . 1 . 2]" 1
435 1 44 GLU HB2 1 51 THR HA . . 4.620 3.023 2.779 3.141 . 0 0 "[ . 1 . 2]" 1
436 1 31 PHE HB2 1 44 GLU HB2 . . 4.990 4.737 4.688 4.838 . 0 0 "[ . 1 . 2]" 1
437 1 31 PHE HB2 1 44 GLU HB3 . . 4.290 4.239 4.080 4.324 0.034 3 0 "[ . 1 . 2]" 1
438 1 44 GLU HG2 1 46 GLU HA . . 5.500 5.302 5.074 5.436 . 0 0 "[ . 1 . 2]" 1
439 1 44 GLU HG2 1 48 GLY HA2 . . 4.980 3.897 3.737 4.103 . 0 0 "[ . 1 . 2]" 1
440 1 44 GLU HG3 1 46 GLU HA . . 5.500 5.172 5.021 5.360 . 0 0 "[ . 1 . 2]" 1
441 1 44 GLU HG3 1 48 GLY HA2 . . 4.980 2.218 2.057 2.387 . 0 0 "[ . 1 . 2]" 1
442 1 22 LEU MD1 1 45 ASN HB3 . . 4.290 3.197 2.705 3.576 . 0 0 "[ . 1 . 2]" 1
443 1 22 LEU MD2 1 45 ASN HB3 . . 4.290 3.228 2.725 3.577 . 0 0 "[ . 1 . 2]" 1
444 1 22 LEU MD1 1 45 ASN HB2 . . 4.820 4.492 3.862 4.879 0.059 11 0 "[ . 1 . 2]" 1
445 1 22 LEU MD2 1 45 ASN HB2 . . 4.820 4.268 3.490 4.822 0.002 16 0 "[ . 1 . 2]" 1
446 1 45 ASN HB3 1 50 LYS QD . . 4.910 2.934 1.968 4.074 . 0 0 "[ . 1 . 2]" 1
447 1 45 ASN HB3 1 50 LYS HB3 . . 4.700 3.650 2.923 4.205 . 0 0 "[ . 1 . 2]" 1
448 1 45 ASN HB2 1 50 LYS HB3 . . 5.500 4.835 4.043 5.400 . 0 0 "[ . 1 . 2]" 1
449 1 22 LEU MD2 1 45 ASN HA . . 5.100 3.555 3.155 4.582 . 0 0 "[ . 1 . 2]" 1
450 1 30 VAL HA 1 46 GLU HA . . 4.730 4.106 3.636 4.532 . 0 0 "[ . 1 . 2]" 1
451 1 45 ASN HA 1 46 GLU HA . . 5.160 4.318 4.306 4.328 . 0 0 "[ . 1 . 2]" 1
452 1 46 GLU HA 1 46 GLU QG . . 3.020 2.279 2.103 2.494 . 0 0 "[ . 1 . 2]" 1
453 1 29 ILE MG 1 46 GLU HA . . 4.690 3.850 3.028 4.309 . 0 0 "[ . 1 . 2]" 1
454 1 29 ILE MG 1 46 GLU HB2 . . 5.500 4.317 3.429 5.187 . 0 0 "[ . 1 . 2]" 1
455 1 29 ILE MG 1 46 GLU HB3 . . 5.500 5.345 4.562 5.542 0.042 8 0 "[ . 1 . 2]" 1
456 1 29 ILE HB 1 46 GLU HB2 . . 5.010 3.348 2.361 4.411 . 0 0 "[ . 1 . 2]" 1
457 1 29 ILE HB 1 46 GLU HB3 . . 5.010 4.703 3.780 5.019 0.009 14 0 "[ . 1 . 2]" 1
458 1 44 GLU HB3 1 48 GLY HA2 . . 4.610 4.516 4.454 4.600 . 0 0 "[ . 1 . 2]" 1
459 1 44 GLU HB2 1 48 GLY HA2 . . 4.950 3.267 3.071 3.365 . 0 0 "[ . 1 . 2]" 1
460 1 49 SER HA 1 50 LYS HA . . 4.740 4.539 4.513 4.578 . 0 0 "[ . 1 . 2]" 1
461 1 22 LEU MD1 1 50 LYS HB3 . . 5.400 4.365 3.903 5.205 . 0 0 "[ . 1 . 2]" 1
462 1 22 LEU MD1 1 50 LYS HB2 . . 5.500 4.220 3.759 5.124 . 0 0 "[ . 1 . 2]" 1
463 1 50 LYS HB2 1 50 LYS QE . . 4.810 2.704 2.018 3.893 . 0 0 "[ . 1 . 2]" 1
464 1 22 LEU MD2 1 50 LYS HB3 . . 5.400 5.100 4.253 5.488 0.088 8 0 "[ . 1 . 2]" 1
465 1 22 LEU MD2 1 50 LYS HB2 . . 5.500 5.203 4.017 5.552 0.052 19 0 "[ . 1 . 2]" 1
466 1 45 ASN HB3 1 50 LYS HG2 . . 4.430 2.207 1.973 2.603 . 0 0 "[ . 1 . 2]" 1
467 1 50 LYS HA 1 50 LYS QD . . 4.510 4.304 3.964 4.525 0.015 15 0 "[ . 1 . 2]" 1
468 1 50 LYS HB3 1 50 LYS QD . . 3.580 2.600 2.288 2.868 . 0 0 "[ . 1 . 2]" 1
469 1 50 LYS HB3 1 50 LYS QE . . 4.320 2.814 1.965 3.531 . 0 0 "[ . 1 . 2]" 1
470 1 50 LYS QE 1 50 LYS HG3 . . 3.780 2.727 2.217 3.323 . 0 0 "[ . 1 . 2]" 1
471 1 50 LYS HA 1 50 LYS HG3 . . 3.760 3.206 2.938 3.553 . 0 0 "[ . 1 . 2]" 1
472 1 44 GLU HB3 1 51 THR HB . . 4.780 4.224 3.843 4.434 . 0 0 "[ . 1 . 2]" 1
473 1 51 THR HB 2 3 PHE QE . . 4.530 3.207 2.866 3.375 . 0 0 "[ . 1 . 2]" 1
474 1 44 GLU HA 1 51 THR HB . . 4.950 4.756 4.660 4.859 . 0 0 "[ . 1 . 2]" 1
475 1 44 GLU HG2 1 51 THR HA . . 5.220 5.128 4.978 5.231 0.011 5 0 "[ . 1 . 2]" 1
476 1 44 GLU HG3 1 51 THR HA . . 5.220 5.143 4.923 5.259 0.039 5 0 "[ . 1 . 2]" 1
477 1 44 GLU HB3 1 51 THR HA . . 4.700 3.013 2.832 3.210 . 0 0 "[ . 1 . 2]" 1
478 1 43 ALA MB 1 51 THR HA . . 5.310 5.180 5.050 5.253 . 0 0 "[ . 1 . 2]" 1
479 1 42 VAL MG1 1 51 THR HA . . 5.150 4.644 4.453 4.853 . 0 0 "[ . 1 . 2]" 1
480 1 50 LYS HB2 1 51 THR HA . . 5.500 5.337 5.025 5.582 0.082 19 0 "[ . 1 . 2]" 1
481 1 50 LYS QD 1 51 THR HA . . 5.500 5.254 5.105 5.397 . 0 0 "[ . 1 . 2]" 1
482 1 44 GLU HG2 1 51 THR MG . . 4.860 4.454 4.213 4.647 . 0 0 "[ . 1 . 2]" 1
483 1 44 GLU HG3 1 51 THR MG . . 4.860 4.703 4.483 4.861 0.001 15 0 "[ . 1 . 2]" 1
484 1 44 GLU HB3 1 51 THR MG . . 4.360 2.240 2.003 2.414 . 0 0 "[ . 1 . 2]" 1
485 1 44 GLU HB2 1 51 THR MG . . 4.290 3.386 3.199 3.505 . 0 0 "[ . 1 . 2]" 1
486 1 42 VAL MG1 1 51 THR MG . . 3.140 2.261 2.143 2.404 . 0 0 "[ . 1 . 2]" 1
487 1 42 VAL HA 1 51 THR MG . . 4.790 4.282 4.126 4.418 . 0 0 "[ . 1 . 2]" 1
488 1 33 SER HB3 1 51 THR MG . . 4.850 4.610 4.349 4.829 . 0 0 "[ . 1 . 2]" 1
489 1 33 SER HB2 1 51 THR MG . . 4.630 3.737 3.519 3.939 . 0 0 "[ . 1 . 2]" 1
490 1 51 THR HA 1 51 THR MG . . 3.370 2.216 2.126 2.336 . 0 0 "[ . 1 . 2]" 1
491 1 44 GLU HA 1 51 THR MG . . 3.830 2.776 2.619 2.878 . 0 0 "[ . 1 . 2]" 1
492 1 22 LEU HB3 1 52 GLY QA . . 4.020 3.391 2.975 3.675 . 0 0 "[ . 1 . 2]" 1
493 1 22 LEU MD2 1 52 GLY QA . . 4.290 3.749 3.318 4.354 0.064 8 0 "[ . 1 . 2]" 1
494 1 51 THR MG 1 52 GLY QA . . 4.730 3.351 3.157 3.484 . 0 0 "[ . 1 . 2]" 1
495 1 21 GLU HA 1 52 GLY QA . . 4.750 3.618 3.437 3.764 . 0 0 "[ . 1 . 2]" 1
496 1 40 TRP HE3 1 53 LEU HA . . 5.240 4.456 4.329 4.566 . 0 0 "[ . 1 . 2]" 1
497 1 42 VAL HA 1 53 LEU HA . . 3.530 2.322 2.252 2.429 . 0 0 "[ . 1 . 2]" 1
498 1 21 GLU HB3 1 53 LEU HB2 . . 5.100 3.593 3.317 4.016 . 0 0 "[ . 1 . 2]" 1
499 1 53 LEU HB3 1 54 VAL HA . . 5.220 4.494 4.393 4.568 . 0 0 "[ . 1 . 2]" 1
500 1 20 ASN HD21 1 53 LEU HB2 . . 4.860 4.645 4.366 4.862 0.002 5 0 "[ . 1 . 2]" 1
501 1 53 LEU HA 1 53 LEU HG . . 4.120 2.844 2.655 2.956 . 0 0 "[ . 1 . 2]" 1
502 1 20 ASN HD21 1 53 LEU HG . . 5.140 4.327 4.007 4.848 . 0 0 "[ . 1 . 2]" 1
503 1 53 LEU MD1 2 5 PRO HB3 . . 5.120 2.172 1.965 2.976 . 0 0 "[ . 1 . 2]" 1
504 1 53 LEU HA 1 53 LEU MD1 . . 4.440 3.927 3.862 3.962 . 0 0 "[ . 1 . 2]" 1
505 1 42 VAL MG2 1 53 LEU MD2 . . 4.570 1.860 1.827 1.900 . 0 0 "[ . 1 . 2]" 1
506 1 53 LEU MD2 2 5 PRO HB3 . . 5.120 3.268 2.964 3.623 . 0 0 "[ . 1 . 2]" 1
507 1 53 LEU MD2 2 5 PRO HG3 . . 4.580 2.303 2.052 3.279 . 0 0 "[ . 1 . 2]" 1
508 1 53 LEU MD2 2 5 PRO HB2 . . 5.120 4.371 4.159 4.960 . 0 0 "[ . 1 . 2]" 1
509 1 53 LEU MD2 2 5 PRO HD2 . . 4.710 3.277 3.107 3.807 . 0 0 "[ . 1 . 2]" 1
510 1 53 LEU HA 1 53 LEU MD2 . . 4.440 2.384 2.265 2.508 . 0 0 "[ . 1 . 2]" 1
511 1 20 ASN HD21 1 53 LEU MD2 . . 5.000 4.423 4.113 4.890 . 0 0 "[ . 1 . 2]" 1
512 1 53 LEU MD2 1 54 VAL H . . 5.500 3.618 3.345 3.744 . 0 0 "[ . 1 . 2]" 1
513 1 53 LEU MD1 2 4 ILE MG . . 5.430 4.470 3.855 4.827 . 0 0 "[ . 1 . 2]" 1
514 1 54 VAL HB 1 55 PRO HA . . 5.500 4.990 4.929 5.026 . 0 0 "[ . 1 . 2]" 1
515 1 55 PRO QB 1 58 PHE HB2 . . 4.550 1.976 1.955 2.008 . 0 0 "[ . 1 . 2]" 1
516 1 14 PHE QD 1 55 PRO QB . . 5.220 4.163 3.956 4.354 . 0 0 "[ . 1 . 2]" 1
517 1 55 PRO HG3 2 10 PRO HG2 . . 4.730 3.737 3.342 3.987 . 0 0 "[ . 1 . 2]" 1
518 1 54 VAL HB 1 55 PRO HG2 . . 5.500 3.792 3.756 3.822 . 0 0 "[ . 1 . 2]" 1
519 1 55 PRO HG2 2 10 PRO HG2 . . 5.500 4.931 4.354 5.200 . 0 0 "[ . 1 . 2]" 1
520 1 54 VAL HA 1 55 PRO HG3 . . 5.100 4.467 4.461 4.476 . 0 0 "[ . 1 . 2]" 1
521 1 54 VAL HA 1 55 PRO HG2 . . 4.910 4.507 4.498 4.518 . 0 0 "[ . 1 . 2]" 1
522 1 55 PRO HG2 1 58 PHE HB2 . . 5.020 1.937 1.921 1.958 . 0 0 "[ . 1 . 2]" 1
523 1 55 PRO HG3 2 10 PRO HD2 . . 4.680 4.380 4.217 4.471 . 0 0 "[ . 1 . 2]" 1
524 1 55 PRO HG2 2 10 PRO HD2 . . 5.500 5.497 5.175 5.538 0.038 3 0 "[ . 1 . 2]" 1
525 1 14 PHE QD 1 55 PRO HG3 . . 4.600 3.141 2.908 3.313 . 0 0 "[ . 1 . 2]" 1
526 1 55 PRO HG2 1 59 VAL H . . 5.420 4.495 4.307 4.712 . 0 0 "[ . 1 . 2]" 1
527 1 55 PRO HG3 1 58 PHE QD . . 5.210 3.292 3.198 3.378 . 0 0 "[ . 1 . 2]" 1
528 1 55 PRO HG2 1 58 PHE QD . . 4.830 3.483 3.436 3.566 . 0 0 "[ . 1 . 2]" 1
529 1 14 PHE QD 1 55 PRO HD3 . . 4.940 2.741 2.422 2.877 . 0 0 "[ . 1 . 2]" 1
530 1 14 PHE HB2 1 55 PRO HD3 . . 5.500 4.515 4.290 4.766 . 0 0 "[ . 1 . 2]" 1
531 1 54 VAL HA 1 55 PRO HD2 . . 3.770 2.393 2.382 2.407 . 0 0 "[ . 1 . 2]" 1
532 1 54 VAL HA 1 55 PRO HD3 . . 4.010 2.296 2.292 2.303 . 0 0 "[ . 1 . 2]" 1
533 1 4 VAL HB 1 34 TYR HA . . 4.990 4.028 3.476 4.847 . 0 0 "[ . 1 . 2]" 1
534 1 14 PHE QD 1 54 VAL HB . . 5.500 4.479 4.312 4.665 . 0 0 "[ . 1 . 2]" 1
535 1 40 TRP HE3 1 54 VAL HB . . 5.500 5.334 5.177 5.432 . 0 0 "[ . 1 . 2]" 1
536 1 54 VAL MG1 1 55 PRO HD2 . . 4.810 3.310 3.190 3.373 . 0 0 "[ . 1 . 2]" 1
537 1 56 GLU HA 1 57 GLU HB2 . . 5.500 5.511 5.494 5.527 0.027 9 0 "[ . 1 . 2]" 1
538 1 41 LEU HG 1 56 GLU HA . . 3.570 3.267 3.198 3.311 . 0 0 "[ . 1 . 2]" 1
539 1 56 GLU HA 1 59 VAL MG1 . . 4.930 4.070 3.936 4.136 . 0 0 "[ . 1 . 2]" 1
540 1 16 PRO HD3 1 23 ARG HB3 . . 3.930 3.041 2.845 3.168 . 0 0 "[ . 1 . 2]" 1
541 1 41 LEU MD2 1 56 GLU HB2 . . 4.240 2.406 2.222 2.535 . 0 0 "[ . 1 . 2]" 1
542 1 41 LEU HG 1 56 GLU HB2 . . 3.940 2.126 2.052 2.247 . 0 0 "[ . 1 . 2]" 1
543 1 16 PRO HG2 1 23 ARG HB3 . . 5.210 5.256 5.171 5.320 0.110 16 0 "[ . 1 . 2]" 1
544 1 56 GLU HA 1 56 GLU HG2 . . 3.860 2.891 2.404 3.384 . 0 0 "[ . 1 . 2]" 1
545 1 56 GLU HA 1 56 GLU HG3 . . 3.860 3.023 2.421 3.624 . 0 0 "[ . 1 . 2]" 1
546 1 41 LEU MD2 1 56 GLU HG2 . . 4.090 3.956 3.790 4.104 0.014 11 0 "[ . 1 . 2]" 1
547 1 41 LEU MD1 1 56 GLU HG2 . . 4.010 2.736 2.090 3.381 . 0 0 "[ . 1 . 2]" 1
548 1 6 GLN HB3 1 32 ILE HB . . 4.210 2.997 2.887 3.082 . 0 0 "[ . 1 . 2]" 1
549 1 57 GLU HA 1 57 GLU HG3 . . 3.820 2.715 2.078 3.581 . 0 0 "[ . 1 . 2]" 1
550 1 55 PRO QB 1 57 GLU HB2 . . 4.490 4.243 4.130 4.323 . 0 0 "[ . 1 . 2]" 1
551 1 57 GLU HB3 2 12 PRO HG3 . . 4.320 3.811 3.141 4.239 . 0 0 "[ . 1 . 2]" 1
552 1 57 GLU HB2 2 12 PRO HD3 . . 4.640 3.975 3.573 4.313 . 0 0 "[ . 1 . 2]" 1
553 1 57 GLU HB3 2 12 PRO HD3 . . 4.640 2.434 1.998 2.787 . 0 0 "[ . 1 . 2]" 1
554 1 57 GLU HA 1 57 GLU HG2 . . 3.820 2.972 2.129 3.571 . 0 0 "[ . 1 . 2]" 1
555 1 10 ALA MB 1 58 PHE HB3 . . 5.370 4.699 4.460 4.807 . 0 0 "[ . 1 . 2]" 1
556 1 55 PRO HD2 1 58 PHE HB2 . . 4.770 4.239 4.224 4.260 . 0 0 "[ . 1 . 2]" 1
557 1 55 PRO HD3 1 58 PHE HB2 . . 5.300 4.658 4.632 4.680 . 0 0 "[ . 1 . 2]" 1
558 1 55 PRO QB 1 58 PHE HB3 . . 4.710 3.577 3.552 3.604 . 0 0 "[ . 1 . 2]" 1
559 1 12 TYR QD 1 58 PHE HB2 . . 4.820 4.329 4.239 4.403 . 0 0 "[ . 1 . 2]" 1
560 1 10 ALA HA 1 59 VAL HA . . 3.220 2.579 2.413 2.699 . 0 0 "[ . 1 . 2]" 1
561 1 59 VAL HA 1 60 SER QB . . 4.880 3.926 3.899 3.954 . 0 0 "[ . 1 . 2]" 1
562 1 11 LEU HG 1 59 VAL HA . . 3.840 2.137 2.022 2.236 . 0 0 "[ . 1 . 2]" 1
563 1 9 VAL MG1 1 59 VAL HA . . 4.280 3.884 3.775 4.003 . 0 0 "[ . 1 . 2]" 1
564 1 8 ALA MB 1 59 VAL HB . . 3.240 2.439 2.332 2.541 . 0 0 "[ . 1 . 2]" 1
565 1 11 LEU HG 1 59 VAL HB . . 5.100 4.408 4.293 4.521 . 0 0 "[ . 1 . 2]" 1
566 1 32 ILE HG13 1 59 VAL HB . . 5.500 5.213 5.059 5.362 . 0 0 "[ . 1 . 2]" 1
567 1 10 ALA HA 1 59 VAL HB . . 4.590 3.821 3.581 3.928 . 0 0 "[ . 1 . 2]" 1
568 1 59 VAL HB 1 60 SER HA . . 5.060 4.279 4.189 4.333 . 0 0 "[ . 1 . 2]" 1
569 1 8 ALA MB 1 59 VAL MG2 . . 3.460 3.013 2.890 3.142 . 0 0 "[ . 1 . 2]" 1
570 1 32 ILE HG13 1 59 VAL MG2 . . 4.130 3.873 3.740 4.035 . 0 0 "[ . 1 . 2]" 1
571 1 32 ILE HG12 1 59 VAL MG2 . . 4.960 4.684 4.523 4.870 . 0 0 "[ . 1 . 2]" 1
572 1 41 LEU HG 1 59 VAL MG2 . . 5.270 4.283 4.148 4.383 . 0 0 "[ . 1 . 2]" 1
573 1 55 PRO QB 1 59 VAL MG2 . . 4.560 4.328 4.221 4.454 . 0 0 "[ . 1 . 2]" 1
574 1 41 LEU HB2 1 59 VAL MG2 . . 4.540 4.380 4.325 4.473 . 0 0 "[ . 1 . 2]" 1
575 1 56 GLU HA 1 59 VAL MG2 . . 3.710 2.175 2.089 2.262 . 0 0 "[ . 1 . 2]" 1
576 1 56 GLU HG3 1 59 VAL MG2 . . 4.910 3.980 3.164 4.728 . 0 0 "[ . 1 . 2]" 1
577 1 56 GLU HG2 1 59 VAL MG2 . . 4.910 3.788 3.220 4.385 . 0 0 "[ . 1 . 2]" 1
578 1 59 VAL MG2 1 60 SER HA . . 4.410 3.823 3.693 3.922 . 0 0 "[ . 1 . 2]" 1
579 1 11 LEU MD1 1 59 VAL MG2 . . 4.470 4.276 3.979 4.457 . 0 0 "[ . 1 . 2]" 1
580 1 24 LEU MD1 1 59 VAL MG1 . . 3.840 3.154 3.094 3.213 . 0 0 "[ . 1 . 2]" 1
581 1 11 LEU HG 1 59 VAL MG1 . . 4.390 3.935 3.838 4.038 . 0 0 "[ . 1 . 2]" 1
582 1 43 ALA MB 1 59 VAL MG1 . . 4.860 4.403 4.297 4.554 . 0 0 "[ . 1 . 2]" 1
583 1 30 VAL MG1 1 59 VAL MG1 . . 3.930 3.958 3.935 3.987 0.057 16 0 "[ . 1 . 2]" 1
584 1 24 LEU HB2 1 59 VAL MG1 . . 5.190 4.637 4.604 4.774 . 0 0 "[ . 1 . 2]" 1
585 1 55 PRO QB 1 59 VAL MG1 . . 5.500 4.443 4.378 4.509 . 0 0 "[ . 1 . 2]" 1
586 1 24 LEU HB3 1 59 VAL MG1 . . 5.340 4.459 4.415 4.588 . 0 0 "[ . 1 . 2]" 1
587 1 24 LEU HG 1 59 VAL MG1 . . 5.500 3.348 3.284 3.445 . 0 0 "[ . 1 . 2]" 1
588 1 30 VAL HB 1 59 VAL MG1 . . 5.270 4.692 4.551 5.003 . 0 0 "[ . 1 . 2]" 1
589 1 55 PRO HD2 1 59 VAL MG1 . . 5.430 3.733 3.668 3.816 . 0 0 "[ . 1 . 2]" 1
590 1 58 PHE HB2 1 59 VAL MG1 . . 4.490 3.874 3.799 3.958 . 0 0 "[ . 1 . 2]" 1
591 1 58 PHE HB3 1 59 VAL MG1 . . 4.650 3.327 3.262 3.448 . 0 0 "[ . 1 . 2]" 1
592 1 10 ALA HA 1 59 VAL MG1 . . 3.200 2.157 1.974 2.356 . 0 0 "[ . 1 . 2]" 1
593 1 58 PHE HA 1 59 VAL MG1 . . 4.790 4.610 4.454 4.668 . 0 0 "[ . 1 . 2]" 1
594 1 9 VAL HA 1 59 VAL MG1 . . 4.980 4.694 4.571 4.822 . 0 0 "[ . 1 . 2]" 1
595 1 59 VAL HA 1 59 VAL MG1 . . 3.130 2.167 2.129 2.191 . 0 0 "[ . 1 . 2]" 1
596 1 11 LEU MD2 1 59 VAL HA . . 4.250 3.390 3.096 3.598 . 0 0 "[ . 1 . 2]" 1
597 1 11 LEU MD1 1 59 VAL HA . . 4.480 3.348 3.097 3.552 . 0 0 "[ . 1 . 2]" 1
598 1 11 LEU MD2 1 59 VAL HB . . 5.500 4.808 4.576 5.007 . 0 0 "[ . 1 . 2]" 1
599 1 11 LEU MD1 1 59 VAL HB . . 5.500 4.894 4.721 5.093 . 0 0 "[ . 1 . 2]" 1
600 1 24 LEU MD2 1 59 VAL MG1 . . 3.840 1.819 1.787 1.880 . 0 0 "[ . 1 . 2]" 1
601 1 11 LEU HG 1 60 SER QB . . 3.970 3.100 2.963 3.285 . 0 0 "[ . 1 . 2]" 1
602 1 9 VAL HB 1 60 SER QB . . 5.020 4.438 4.348 4.636 . 0 0 "[ . 1 . 2]" 1
603 1 59 VAL MG2 1 60 SER QB . . 4.980 4.744 4.662 4.833 . 0 0 "[ . 1 . 2]" 1
604 1 11 LEU HB3 1 60 SER QB . . 5.500 4.607 4.544 4.770 . 0 0 "[ . 1 . 2]" 1
605 1 8 ALA MB 1 60 SER HA . . 4.600 4.269 4.135 4.416 . 0 0 "[ . 1 . 2]" 1
606 1 9 VAL MG1 1 60 SER HA . . 4.930 4.035 3.976 4.136 . 0 0 "[ . 1 . 2]" 1
607 1 11 LEU MD2 1 60 SER HA . . 4.960 3.898 3.813 3.978 . 0 0 "[ . 1 . 2]" 1
608 1 8 ALA MB 1 61 TYR HA . . 3.280 2.262 2.100 2.535 . 0 0 "[ . 1 . 2]" 1
609 1 61 TYR HB3 1 62 ILE HA . . 4.690 4.535 4.460 4.668 . 0 0 "[ . 1 . 2]" 1
610 1 62 ILE HA 1 62 ILE HG12 . . 3.960 2.635 2.625 2.646 . 0 0 "[ . 1 . 2]" 1
611 1 62 ILE HA 1 62 ILE HG13 . . 3.690 3.085 3.038 3.164 . 0 0 "[ . 1 . 2]" 1
612 1 7 ARG HG3 1 62 ILE HB . . 3.790 2.011 1.988 2.044 . 0 0 "[ . 1 . 2]" 1
613 1 8 ALA HA 1 62 ILE HB . . 4.910 3.661 3.534 3.874 . 0 0 "[ . 1 . 2]" 1
614 1 62 ILE MG 1 63 GLN QG . . 4.920 4.453 3.214 4.784 . 0 0 "[ . 1 . 2]" 1
615 1 62 ILE MG 1 63 GLN HB2 . . 5.060 4.393 4.168 4.997 . 0 0 "[ . 1 . 2]" 1
616 1 3 ILE MG 1 34 TYR HB3 . . 5.320 3.570 3.145 3.949 . 0 0 "[ . 1 . 2]" 1
617 1 62 ILE MG 1 64 PRO HD2 . . 5.500 5.434 5.381 5.504 0.004 11 0 "[ . 1 . 2]" 1
618 1 62 ILE MG 1 64 PRO HD3 . . 5.500 5.057 4.944 5.362 . 0 0 "[ . 1 . 2]" 1
619 1 62 ILE HA 1 62 ILE MG . . 3.120 2.268 2.208 2.346 . 0 0 "[ . 1 . 2]" 1
620 1 3 ILE MG 1 33 SER HA . . 4.810 2.579 2.097 3.127 . 0 0 "[ . 1 . 2]" 1
621 1 8 ALA HA 1 62 ILE MG . . 5.030 4.699 4.635 4.785 . 0 0 "[ . 1 . 2]" 1
622 1 62 ILE MD 1 62 ILE MG . . 2.560 2.071 1.917 2.139 . 0 0 "[ . 1 . 2]" 1
623 1 30 VAL MG2 1 62 ILE MD . . 4.950 4.779 4.655 4.962 0.012 12 0 "[ . 1 . 2]" 1
624 1 7 ARG HG3 1 62 ILE MD . . 3.450 2.180 2.078 2.364 . 0 0 "[ . 1 . 2]" 1
625 1 7 ARG HG2 1 62 ILE MD . . 3.880 3.617 3.566 3.709 . 0 0 "[ . 1 . 2]" 1
626 1 9 VAL HB 1 62 ILE MD . . 3.230 2.043 1.944 2.187 . 0 0 "[ . 1 . 2]" 1
627 1 62 ILE HB 1 62 ILE MD . . 3.270 2.310 2.278 2.376 . 0 0 "[ . 1 . 2]" 1
628 1 62 ILE HA 1 62 ILE MD . . 3.950 3.879 3.870 3.884 . 0 0 "[ . 1 . 2]" 1
629 1 62 ILE HG13 1 62 ILE MG . . 3.330 3.198 3.189 3.203 . 0 0 "[ . 1 . 2]" 1
630 1 62 ILE HG12 1 62 ILE MG . . 3.400 2.383 2.345 2.412 . 0 0 "[ . 1 . 2]" 1
631 1 61 TYR HA 1 62 ILE HG13 . . 4.850 3.529 3.456 3.584 . 0 0 "[ . 1 . 2]" 1
632 1 8 ALA HA 1 62 ILE HG12 . . 3.990 3.718 3.624 3.818 . 0 0 "[ . 1 . 2]" 1
633 1 61 TYR HA 1 62 ILE HG12 . . 4.960 4.852 4.670 4.938 . 0 0 "[ . 1 . 2]" 1
634 1 9 VAL HB 1 62 ILE HG12 . . 4.380 2.864 2.680 2.946 . 0 0 "[ . 1 . 2]" 1
635 1 64 PRO HA 1 65 GLU HA . . 4.720 4.613 4.541 4.651 . 0 0 "[ . 1 . 2]" 1
636 1 62 ILE MG 1 64 PRO HA . . 4.620 4.501 4.345 4.562 . 0 0 "[ . 1 . 2]" 1
637 1 64 PRO HB2 1 66 LEU HG . . 5.500 4.666 4.065 4.882 . 0 0 "[ . 1 . 2]" 1
638 1 64 PRO HB3 1 66 LEU HG . . 5.500 5.392 4.926 5.510 0.010 9 0 "[ . 1 . 2]" 1
639 1 64 PRO QG 1 66 LEU MD2 . . 5.210 3.182 1.970 3.559 . 0 0 "[ . 1 . 2]" 1
640 1 63 GLN HB2 1 64 PRO HD3 . . 4.760 4.431 3.379 4.699 . 0 0 "[ . 1 . 2]" 1
641 1 63 GLN HB2 1 64 PRO HD2 . . 4.760 3.288 1.931 3.637 . 0 0 "[ . 1 . 2]" 1
642 1 63 GLN HB3 1 64 PRO HD3 . . 4.760 3.709 3.544 4.290 . 0 0 "[ . 1 . 2]" 1
643 1 63 GLN QG 1 64 PRO HD2 . . 4.530 2.435 2.053 3.615 . 0 0 "[ . 1 . 2]" 1
644 1 15 GLU HA 1 16 PRO HD3 . . 3.150 2.254 2.250 2.260 . 0 0 "[ . 1 . 2]" 1
645 1 63 GLN QG 1 64 PRO QG . . 4.790 3.901 3.711 4.537 . 0 0 "[ . 1 . 2]" 1
646 1 63 GLN QG 1 64 PRO HA . . 5.500 5.347 4.602 5.548 0.048 3 0 "[ . 1 . 2]" 1
647 1 63 GLN HA 1 64 PRO HD3 . . 3.140 2.341 2.304 2.352 . 0 0 "[ . 1 . 2]" 1
648 1 63 GLN HA 1 64 PRO HD2 . . 3.140 2.495 2.415 2.518 . 0 0 "[ . 1 . 2]" 1
649 1 63 GLN HA 1 64 PRO QG . . 4.240 4.063 4.011 4.078 . 0 0 "[ . 1 . 2]" 1
650 1 63 GLN HB2 1 66 LEU HG . . 5.500 4.154 2.275 5.472 . 0 0 "[ . 1 . 2]" 1
651 1 62 ILE MG 1 63 GLN HB3 . . 5.060 4.795 4.400 4.952 . 0 0 "[ . 1 . 2]" 1
652 1 63 GLN HB3 1 64 PRO HD2 . . 4.760 2.380 2.123 3.315 . 0 0 "[ . 1 . 2]" 1
653 1 62 ILE HB 1 63 GLN QG . . 5.500 5.523 5.503 5.545 0.045 3 0 "[ . 1 . 2]" 1
654 1 63 GLN QG 1 66 LEU HG . . 5.500 3.185 2.735 4.351 . 0 0 "[ . 1 . 2]" 1
655 1 63 GLN HA 1 63 GLN QG . . 3.570 2.398 2.084 3.407 . 0 0 "[ . 1 . 2]" 1
656 1 63 GLN QG 1 64 PRO HD3 . . 4.530 3.473 3.118 4.643 0.113 11 0 "[ . 1 . 2]" 1
657 1 62 ILE HA 1 63 GLN QG . . 4.990 4.616 3.851 4.821 . 0 0 "[ . 1 . 2]" 1
658 1 65 GLU HA 1 66 LEU HG . . 4.840 4.767 4.606 4.879 0.039 13 0 "[ . 1 . 2]" 1
659 1 65 GLU HA 1 65 GLU HG3 . . 4.070 2.799 2.147 3.777 . 0 0 "[ . 1 . 2]" 1
660 1 65 GLU HB2 1 66 LEU HG . . 5.500 4.766 4.159 5.510 0.010 13 0 "[ . 1 . 2]" 1
661 1 65 GLU HA 1 65 GLU HG2 . . 4.070 2.942 2.324 3.727 . 0 0 "[ . 1 . 2]" 1
662 1 66 LEU HA 1 66 LEU HG . . 3.930 3.403 2.914 3.645 . 0 0 "[ . 1 . 2]" 1
663 1 66 LEU HA 1 66 LEU MD1 . . 4.030 3.903 3.617 4.048 0.018 13 0 "[ . 1 . 2]" 1
664 1 66 LEU HA 1 66 LEU MD2 . . 4.030 2.518 2.137 4.036 0.006 17 0 "[ . 1 . 2]" 1
665 1 8 ALA MB 1 30 VAL HB . . 5.500 4.451 4.237 4.747 . 0 0 "[ . 1 . 2]" 1
666 1 63 GLN HB3 1 66 LEU HG . . 5.500 3.208 2.372 5.021 . 0 0 "[ . 1 . 2]" 1
667 1 65 GLU HB3 1 66 LEU HG . . 5.500 4.939 4.083 5.521 0.021 17 0 "[ . 1 . 2]" 1
668 1 3 ILE HA 1 34 TYR HB3 . . 4.390 2.625 2.414 2.861 . 0 0 "[ . 1 . 2]" 1
669 1 3 ILE HA 1 34 TYR HB2 . . 4.410 3.861 3.514 4.267 . 0 0 "[ . 1 . 2]" 1
670 1 3 ILE HA 1 3 ILE MG . . 3.380 2.390 2.331 2.430 . 0 0 "[ . 1 . 2]" 1
671 1 3 ILE HB 1 3 ILE MD . . 3.620 2.254 2.100 3.214 . 0 0 "[ . 1 . 2]" 1
672 1 3 ILE HA 1 3 ILE MD . . 3.970 3.573 1.957 3.881 . 0 0 "[ . 1 . 2]" 1
673 1 12 TYR HB3 1 58 PHE QD . . 4.430 4.295 4.278 4.323 . 0 0 "[ . 1 . 2]" 1
674 1 12 TYR HB3 1 58 PHE QE . . 4.860 3.623 3.591 3.659 . 0 0 "[ . 1 . 2]" 1
675 1 18 ASN HB2 1 21 GLU HB2 . . 4.230 3.495 3.293 3.667 . 0 0 "[ . 1 . 2]" 1
676 1 18 ASN HB3 1 21 GLU HB2 . . 4.870 4.729 4.550 4.872 0.002 14 0 "[ . 1 . 2]" 1
677 1 40 TRP HB3 1 53 LEU HB3 . . 5.020 2.717 2.523 2.961 . 0 0 "[ . 1 . 2]" 1
678 1 55 PRO HD2 1 58 PHE HB3 . . 4.630 4.512 4.461 4.573 . 0 0 "[ . 1 . 2]" 1
679 1 54 VAL HB 1 55 PRO HD2 . . 4.030 1.921 1.890 1.941 . 0 0 "[ . 1 . 2]" 1
680 1 30 VAL MG1 1 45 ASN HB3 . . 4.320 4.094 3.852 4.335 0.015 10 0 "[ . 1 . 2]" 1
681 1 42 VAL MG2 1 51 THR MG . . 4.470 4.371 4.233 4.478 0.008 10 0 "[ . 1 . 2]" 1
682 1 50 LYS HG3 1 51 THR MG . . 5.500 5.278 5.191 5.350 . 0 0 "[ . 1 . 2]" 1
683 1 42 VAL HB 1 51 THR MG . . 4.580 4.469 4.333 4.612 0.032 18 0 "[ . 1 . 2]" 1
684 1 22 LEU HB2 1 52 GLY QA . . 4.020 1.982 1.953 2.052 . 0 0 "[ . 1 . 2]" 1
685 1 52 GLY QA 1 53 LEU HG . . 4.910 3.490 3.368 3.723 . 0 0 "[ . 1 . 2]" 1
686 1 55 PRO QB 2 10 PRO HG2 . . 4.430 2.930 2.392 3.239 . 0 0 "[ . 1 . 2]" 1
687 1 36 HIS HB2 1 42 VAL MG2 . . 3.770 2.802 2.621 2.992 . 0 0 "[ . 1 . 2]" 1
688 1 14 PHE QE 1 16 PRO HG3 . . 5.500 5.312 4.960 5.517 0.017 11 0 "[ . 1 . 2]" 1
689 1 53 LEU MD1 2 3 PHE HB2 . . 4.060 2.979 2.587 3.198 . 0 0 "[ . 1 . 2]" 1
690 1 53 LEU MD1 2 5 PRO HD3 . . 4.710 1.993 1.904 2.406 . 0 0 "[ . 1 . 2]" 1
691 1 53 LEU MD2 2 5 PRO HD3 . . 4.710 2.067 1.918 2.435 . 0 0 "[ . 1 . 2]" 1
692 1 40 TRP HE1 2 7 ARG H . . 4.700 3.325 3.073 3.551 . 0 0 "[ . 1 . 2]" 1
693 1 40 TRP HE1 2 9 ALA HA . . 4.340 3.708 3.560 3.826 . 0 0 "[ . 1 . 2]" 1
694 1 40 TRP HB2 1 40 TRP HE1 . . 4.930 4.766 4.762 4.774 . 0 0 "[ . 1 . 2]" 1
695 1 38 GLN QB 1 40 TRP HE1 . . 4.240 3.467 3.421 3.531 . 0 0 "[ . 1 . 2]" 1
696 1 40 TRP HE1 2 5 PRO HB2 . . 4.380 3.214 2.960 3.332 . 0 0 "[ . 1 . 2]" 1
697 1 40 TRP HE1 2 5 PRO HB3 . . 4.380 4.282 3.706 4.418 0.038 5 0 "[ . 1 . 2]" 1
698 1 40 TRP HE1 2 9 ALA MB . . 4.220 3.553 3.490 3.651 . 0 0 "[ . 1 . 2]" 1
699 1 40 TRP H 1 41 LEU H . . 4.560 4.406 4.395 4.436 . 0 0 "[ . 1 . 2]" 1
700 1 40 TRP HE3 1 41 LEU H . . 3.700 3.244 3.207 3.307 . 0 0 "[ . 1 . 2]" 1
701 1 40 TRP HA 1 41 LEU H . . 2.810 2.189 2.179 2.213 . 0 0 "[ . 1 . 2]" 1
702 1 41 LEU H 1 55 PRO HA . . 4.110 3.978 3.863 4.059 . 0 0 "[ . 1 . 2]" 1
703 1 5 ASN H 1 6 GLN HA . . 5.310 5.125 4.918 5.301 . 0 0 "[ . 1 . 2]" 1
704 1 5 ASN HD21 1 6 GLN H . . 5.180 4.943 4.452 5.184 0.004 9 0 "[ . 1 . 2]" 1
705 1 6 GLN H 1 31 PHE QD . . 5.500 5.415 5.227 5.505 0.005 18 0 "[ . 1 . 2]" 1
706 1 6 GLN H 1 32 ILE H . . 4.390 4.226 4.038 4.418 0.028 15 0 "[ . 1 . 2]" 1
707 1 5 ASN HA 1 6 GLN H . . 3.050 2.599 2.544 2.738 . 0 0 "[ . 1 . 2]" 1
708 1 7 ARG H 1 8 ALA H . . 4.640 4.599 4.572 4.621 . 0 0 "[ . 1 . 2]" 1
709 1 6 GLN H 1 7 ARG H . . 4.520 4.433 4.348 4.492 . 0 0 "[ . 1 . 2]" 1
710 1 7 ARG H 1 62 ILE H . . 4.900 4.779 4.574 4.912 0.012 12 0 "[ . 1 . 2]" 1
711 1 7 ARG H 1 31 PHE QD . . 4.490 3.719 3.476 3.864 . 0 0 "[ . 1 . 2]" 1
712 1 7 ARG H 1 31 PHE QE . . 4.940 4.791 4.537 4.932 . 0 0 "[ . 1 . 2]" 1
713 1 6 GLN HA 1 7 ARG H . . 2.720 2.157 2.143 2.178 . 0 0 "[ . 1 . 2]" 1
714 1 7 ARG H 1 31 PHE HA . . 4.730 4.602 4.510 4.707 . 0 0 "[ . 1 . 2]" 1
715 1 8 ALA H 1 9 VAL H . . 4.470 4.345 4.328 4.360 . 0 0 "[ . 1 . 2]" 1
716 1 8 ALA H 1 30 VAL H . . 3.340 3.093 2.949 3.345 0.005 12 0 "[ . 1 . 2]" 1
717 1 8 ALA H 1 31 PHE QD . . 4.580 3.974 3.868 4.122 . 0 0 "[ . 1 . 2]" 1
718 1 7 ARG HA 1 8 ALA H . . 3.040 2.393 2.354 2.415 . 0 0 "[ . 1 . 2]" 1
719 1 8 ALA H 1 31 PHE HA . . 3.910 3.330 3.190 3.404 . 0 0 "[ . 1 . 2]" 1
720 1 8 ALA H 1 30 VAL HA . . 4.950 4.875 4.814 4.927 . 0 0 "[ . 1 . 2]" 1
721 1 8 ALA H 1 61 TYR HA . . 5.040 5.016 4.949 5.053 0.013 15 0 "[ . 1 . 2]" 1
722 1 9 VAL H 1 10 ALA H . . 5.370 4.535 4.493 4.546 . 0 0 "[ . 1 . 2]" 1
723 1 9 VAL H 1 60 SER H . . 3.180 2.698 2.602 2.811 . 0 0 "[ . 1 . 2]" 1
724 1 9 VAL H 1 62 ILE H . . 4.570 4.099 3.926 4.272 . 0 0 "[ . 1 . 2]" 1
725 1 11 LEU H 1 60 SER H . . 4.340 4.109 3.840 4.360 0.020 14 0 "[ . 1 . 2]" 1
726 1 5 ASN H 1 6 GLN H . . 3.460 3.079 2.690 3.526 0.066 15 0 "[ . 1 . 2]" 1
727 1 5 ASN H 1 5 ASN HD21 . . 4.770 3.567 2.198 4.222 . 0 0 "[ . 1 . 2]" 1
728 1 7 ARG H 1 32 ILE H . . 4.920 4.834 4.725 4.879 . 0 0 "[ . 1 . 2]" 1
729 1 61 TYR H 1 62 ILE H . . 4.670 4.568 4.523 4.597 . 0 0 "[ . 1 . 2]" 1
730 1 8 ALA H 1 62 ILE H . . 4.880 4.564 4.468 4.702 . 0 0 "[ . 1 . 2]" 1
731 1 8 ALA H 1 32 ILE H . . 4.300 4.032 3.920 4.103 . 0 0 "[ . 1 . 2]" 1
732 1 9 VAL H 1 59 VAL HA . . 4.790 4.768 4.709 4.826 0.036 10 0 "[ . 1 . 2]" 1
733 1 8 ALA HA 1 9 VAL H . . 2.920 2.304 2.273 2.322 . 0 0 "[ . 1 . 2]" 1
734 1 9 VAL H 1 61 TYR HA . . 4.130 3.864 3.799 3.936 . 0 0 "[ . 1 . 2]" 1
735 1 10 ALA H 1 29 ILE H . . 5.500 5.054 4.976 5.102 . 0 0 "[ . 1 . 2]" 1
736 1 10 ALA H 1 60 SER H . . 5.500 4.997 4.892 5.061 . 0 0 "[ . 1 . 2]" 1
737 1 10 ALA H 1 27 GLY H . . 3.780 3.592 3.512 3.727 . 0 0 "[ . 1 . 2]" 1
738 1 9 VAL HA 1 10 ALA H . . 2.540 2.266 2.192 2.299 . 0 0 "[ . 1 . 2]" 1
739 1 10 ALA H 1 29 ILE HA . . 3.860 3.608 3.522 3.788 . 0 0 "[ . 1 . 2]" 1
740 1 10 ALA H 1 11 LEU H . . 4.630 4.369 4.279 4.529 . 0 0 "[ . 1 . 2]" 1
741 1 11 LEU H 1 27 GLY H . . 5.010 4.846 4.612 4.959 . 0 0 "[ . 1 . 2]" 1
742 1 11 LEU H 1 12 TYR QD . . 4.710 4.652 4.411 4.728 0.018 6 0 "[ . 1 . 2]" 1
743 1 11 LEU H 1 59 VAL HA . . 3.190 2.254 2.129 2.413 . 0 0 "[ . 1 . 2]" 1
744 1 10 ALA HA 1 11 LEU H . . 2.830 2.153 2.142 2.169 . 0 0 "[ . 1 . 2]" 1
745 1 11 LEU H 1 58 PHE HA . . 4.550 4.364 4.096 4.529 . 0 0 "[ . 1 . 2]" 1
746 1 12 TYR H 1 12 TYR QD . . 3.390 3.256 3.179 3.354 . 0 0 "[ . 1 . 2]" 1
747 1 12 TYR H 1 58 PHE QD . . 4.010 3.885 3.820 3.938 . 0 0 "[ . 1 . 2]" 1
748 1 12 TYR H 1 13 ASP H . . 4.480 4.358 4.280 4.409 . 0 0 "[ . 1 . 2]" 1
749 1 12 TYR H 1 27 GLY H . . 5.450 5.120 4.897 5.320 . 0 0 "[ . 1 . 2]" 1
750 1 11 LEU H 1 12 TYR H . . 2.780 2.432 2.212 2.577 . 0 0 "[ . 1 . 2]" 1
751 1 10 ALA HA 1 12 TYR H . . 3.770 3.733 3.662 3.786 0.016 15 0 "[ . 1 . 2]" 1
752 1 12 TYR H 1 59 VAL HA . . 4.710 4.292 4.212 4.388 . 0 0 "[ . 1 . 2]" 1
753 1 13 ASP H 1 26 GLU H . . 3.800 3.008 2.858 3.083 . 0 0 "[ . 1 . 2]" 1
754 1 12 TYR QD 1 13 ASP H . . 4.640 4.364 4.282 4.457 . 0 0 "[ . 1 . 2]" 1
755 1 13 ASP H 1 58 PHE QD . . 5.000 4.751 4.590 4.892 . 0 0 "[ . 1 . 2]" 1
756 1 13 ASP H 1 58 PHE QE . . 5.110 4.405 4.194 4.681 . 0 0 "[ . 1 . 2]" 1
757 1 13 ASP H 1 25 ALA HA . . 4.120 3.996 3.900 4.072 . 0 0 "[ . 1 . 2]" 1
758 1 12 TYR HA 1 13 ASP H . . 2.740 2.252 2.181 2.340 . 0 0 "[ . 1 . 2]" 1
759 1 14 PHE H 1 58 PHE QD . . 4.780 4.003 3.793 4.354 . 0 0 "[ . 1 . 2]" 1
760 1 14 PHE H 1 24 LEU H . . 3.290 2.927 2.850 2.975 . 0 0 "[ . 1 . 2]" 1
761 1 13 ASP H 1 14 PHE H . . 4.780 4.589 4.561 4.637 . 0 0 "[ . 1 . 2]" 1
762 1 14 PHE H 1 15 GLU H . . 4.530 4.381 4.337 4.426 . 0 0 "[ . 1 . 2]" 1
763 1 14 PHE H 1 24 LEU HA . . 4.440 4.220 4.146 4.320 . 0 0 "[ . 1 . 2]" 1
764 1 13 ASP HA 1 14 PHE H . . 2.630 2.192 2.163 2.272 . 0 0 "[ . 1 . 2]" 1
765 1 14 PHE H 1 23 ARG HA . . 5.160 4.998 4.935 5.059 . 0 0 "[ . 1 . 2]" 1
766 1 14 PHE QD 1 15 GLU H . . 3.460 2.876 2.622 3.087 . 0 0 "[ . 1 . 2]" 1
767 1 14 PHE HA 1 15 GLU H . . 2.480 2.244 2.235 2.254 . 0 0 "[ . 1 . 2]" 1
768 1 14 PHE QE 1 17 GLU H . . 4.690 4.372 4.088 4.606 . 0 0 "[ . 1 . 2]" 1
769 1 17 GLU H 1 40 TRP HH2 . . 5.500 5.035 4.529 5.476 . 0 0 "[ . 1 . 2]" 1
770 1 16 PRO HA 1 17 GLU H . . 2.640 2.214 2.161 2.261 . 0 0 "[ . 1 . 2]" 1
771 1 18 ASN H 1 18 ASN HD21 . . 4.080 3.284 2.289 3.619 . 0 0 "[ . 1 . 2]" 1
772 1 18 ASN H 1 21 GLU H . . 4.010 4.014 3.924 4.049 0.039 10 0 "[ . 1 . 2]" 1
773 1 17 GLU H 1 18 ASN H . . 2.550 2.041 1.891 2.191 . 0 0 "[ . 1 . 2]" 1
774 1 16 PRO HA 1 18 ASN H . . 3.800 3.714 3.589 3.812 0.012 9 0 "[ . 1 . 2]" 1
775 1 18 ASN HB3 1 19 ASP H . . 4.240 2.148 2.126 2.172 . 0 0 "[ . 1 . 2]" 1
776 1 19 ASP H 1 20 ASN HA . . 5.230 5.073 5.039 5.108 . 0 0 "[ . 1 . 2]" 1
777 1 19 ASP H 1 20 ASN H . . 3.870 2.664 2.515 2.761 . 0 0 "[ . 1 . 2]" 1
778 1 20 ASN H 1 21 GLU H . . 2.750 2.038 1.894 2.366 . 0 0 "[ . 1 . 2]" 1
779 1 20 ASN H 1 20 ASN HD21 . . 4.230 3.949 3.728 4.049 . 0 0 "[ . 1 . 2]" 1
780 1 18 ASN H 1 20 ASN H . . 4.300 4.109 4.046 4.200 . 0 0 "[ . 1 . 2]" 1
781 1 19 ASP HA 1 20 ASN H . . 3.430 3.085 2.995 3.268 . 0 0 "[ . 1 . 2]" 1
782 1 19 ASP H 1 21 GLU H . . 4.850 4.422 4.337 4.497 . 0 0 "[ . 1 . 2]" 1
783 1 17 GLU H 1 21 GLU H . . 5.440 5.271 5.102 5.416 . 0 0 "[ . 1 . 2]" 1
784 1 21 GLU H 1 53 LEU H . . 4.960 4.674 4.563 4.846 . 0 0 "[ . 1 . 2]" 1
785 1 19 ASP HA 1 21 GLU H . . 3.850 3.726 3.576 3.793 . 0 0 "[ . 1 . 2]" 1
786 1 20 ASN HA 1 21 GLU H . . 3.520 3.099 3.008 3.166 . 0 0 "[ . 1 . 2]" 1
787 1 16 PRO HA 1 21 GLU H . . 5.500 5.397 5.178 5.506 0.006 4 0 "[ . 1 . 2]" 1
788 1 22 LEU H 1 53 LEU H . . 3.460 2.394 2.313 2.532 . 0 0 "[ . 1 . 2]" 1
789 1 21 GLU H 1 22 LEU H . . 4.560 4.536 4.524 4.554 . 0 0 "[ . 1 . 2]" 1
790 1 22 LEU H 1 54 VAL H . . 4.950 4.790 4.727 4.889 . 0 0 "[ . 1 . 2]" 1
791 1 41 LEU H 1 54 VAL H . . 3.500 3.049 2.903 3.277 . 0 0 "[ . 1 . 2]" 1
792 1 40 TRP HE3 1 54 VAL H . . 3.540 3.365 3.203 3.553 0.013 7 0 "[ . 1 . 2]" 1
793 1 21 GLU HA 1 22 LEU H . . 3.060 2.368 2.303 2.449 . 0 0 "[ . 1 . 2]" 1
794 1 22 LEU H 1 52 GLY QA . . 3.680 3.456 3.284 3.609 . 0 0 "[ . 1 . 2]" 1
795 1 22 LEU H 1 53 LEU HA . . 4.700 4.277 4.200 4.422 . 0 0 "[ . 1 . 2]" 1
796 1 22 LEU H 1 23 ARG H . . 4.630 4.512 4.467 4.545 . 0 0 "[ . 1 . 2]" 1
797 1 22 LEU HA 1 23 ARG H . . 2.540 2.269 2.214 2.378 . 0 0 "[ . 1 . 2]" 1
798 1 23 ARG H 1 24 LEU H . . 4.760 4.599 4.568 4.621 . 0 0 "[ . 1 . 2]" 1
799 1 14 PHE QD 1 24 LEU H . . 3.690 3.422 3.151 3.692 0.002 10 0 "[ . 1 . 2]" 1
800 1 14 PHE HA 1 24 LEU H . . 5.270 4.804 4.752 4.858 . 0 0 "[ . 1 . 2]" 1
801 1 24 LEU H 1 25 ALA HA . . 5.500 4.835 4.807 4.869 . 0 0 "[ . 1 . 2]" 1
802 1 23 ARG HA 1 24 LEU H . . 2.670 2.322 2.284 2.375 . 0 0 "[ . 1 . 2]" 1
803 1 24 LEU HA 1 25 ALA H . . 2.600 2.266 2.257 2.277 . 0 0 "[ . 1 . 2]" 1
804 1 14 PHE H 1 26 GLU H . . 5.200 4.942 4.876 5.014 . 0 0 "[ . 1 . 2]" 1
805 1 14 PHE H 1 25 ALA H . . 4.570 4.322 4.268 4.439 . 0 0 "[ . 1 . 2]" 1
806 1 25 ALA HA 1 26 GLU H . . 2.560 2.195 2.177 2.208 . 0 0 "[ . 1 . 2]" 1
807 1 13 ASP HA 1 26 GLU H . . 3.160 2.839 2.783 2.907 . 0 0 "[ . 1 . 2]" 1
808 1 27 GLY H 1 27 GLY HA2 . . 2.920 2.371 2.359 2.378 . 0 0 "[ . 1 . 2]" 1
809 1 26 GLU HA 1 27 GLY H . . 2.530 2.144 2.142 2.145 . 0 0 "[ . 1 . 2]" 1
810 1 11 LEU HA 1 27 GLY H . . 4.650 4.038 3.733 4.202 . 0 0 "[ . 1 . 2]" 1
811 1 27 GLY H 1 28 ASP H . . 3.010 2.428 2.375 2.558 . 0 0 "[ . 1 . 2]" 1
812 1 10 ALA H 1 28 ASP H . . 3.840 3.534 3.431 3.623 . 0 0 "[ . 1 . 2]" 1
813 1 27 GLY HA3 1 28 ASP H . . 3.460 3.232 3.139 3.284 . 0 0 "[ . 1 . 2]" 1
814 1 28 ASP H 1 29 ILE H . . 4.670 4.602 4.587 4.624 . 0 0 "[ . 1 . 2]" 1
815 1 28 ASP HA 1 29 ILE H . . 2.540 2.272 2.244 2.369 . 0 0 "[ . 1 . 2]" 1
816 1 29 ILE H 1 30 VAL H . . 4.520 4.458 4.187 4.537 0.017 13 0 "[ . 1 . 2]" 1
817 1 30 VAL H 1 31 PHE H . . 4.530 4.428 4.399 4.493 . 0 0 "[ . 1 . 2]" 1
818 1 9 VAL HA 1 30 VAL H . . 3.670 3.542 3.435 3.626 . 0 0 "[ . 1 . 2]" 1
819 1 29 ILE HA 1 30 VAL H . . 2.810 2.191 2.140 2.234 . 0 0 "[ . 1 . 2]" 1
820 1 31 PHE H 1 31 PHE QD . . 3.860 3.345 3.144 3.521 . 0 0 "[ . 1 . 2]" 1
821 1 31 PHE H 1 43 ALA HA . . 4.570 4.357 4.275 4.451 . 0 0 "[ . 1 . 2]" 1
822 1 30 VAL HA 1 31 PHE H . . 3.030 2.360 2.298 2.436 . 0 0 "[ . 1 . 2]" 1
823 1 31 PHE H 1 44 GLU H . . 3.180 2.475 2.415 2.525 . 0 0 "[ . 1 . 2]" 1
824 1 32 ILE H 1 33 SER H . . 4.390 4.304 4.294 4.311 . 0 0 "[ . 1 . 2]" 1
825 1 31 PHE H 1 32 ILE H . . 4.360 4.158 4.119 4.193 . 0 0 "[ . 1 . 2]" 1
826 1 31 PHE QD 1 32 ILE H . . 4.320 4.110 3.952 4.233 . 0 0 "[ . 1 . 2]" 1
827 1 32 ILE H 1 61 TYR QE . . 5.500 5.384 5.278 5.456 . 0 0 "[ . 1 . 2]" 1
828 1 31 PHE HA 1 32 ILE H . . 2.840 2.154 2.148 2.162 . 0 0 "[ . 1 . 2]" 1
829 1 7 ARG HA 1 32 ILE H . . 3.920 2.933 2.783 3.050 . 0 0 "[ . 1 . 2]" 1
830 1 6 GLN HA 1 32 ILE H . . 5.340 5.230 5.135 5.290 . 0 0 "[ . 1 . 2]" 1
831 1 33 SER H 1 33 SER HB3 . . 3.620 3.537 3.511 3.578 . 0 0 "[ . 1 . 2]" 1
832 1 33 SER H 1 33 SER HB2 . . 3.560 2.257 2.207 2.374 . 0 0 "[ . 1 . 2]" 1
833 1 32 ILE HA 1 33 SER H . . 2.870 2.175 2.172 2.179 . 0 0 "[ . 1 . 2]" 1
834 1 33 SER H 1 43 ALA HA . . 3.340 2.170 2.086 2.277 . 0 0 "[ . 1 . 2]" 1
835 1 33 SER H 1 44 GLU H . . 4.150 3.988 3.951 4.048 . 0 0 "[ . 1 . 2]" 1
836 1 33 SER H 1 42 VAL H . . 5.150 5.107 5.051 5.146 . 0 0 "[ . 1 . 2]" 1
837 1 31 PHE H 1 33 SER H . . 5.500 5.584 5.553 5.612 0.112 10 0 "[ . 1 . 2]" 1
838 1 32 ILE HA 1 34 TYR H . . 4.000 3.701 3.687 3.720 . 0 0 "[ . 1 . 2]" 1
839 1 3 ILE HA 1 34 TYR H . . 5.500 5.334 5.091 5.540 0.040 18 0 "[ . 1 . 2]" 1
840 1 34 TYR H 1 42 VAL HA . . 5.500 5.181 5.141 5.210 . 0 0 "[ . 1 . 2]" 1
841 1 34 TYR H 1 43 ALA HA . . 4.610 4.363 4.301 4.432 . 0 0 "[ . 1 . 2]" 1
842 1 34 TYR H 1 34 TYR QD . . 3.670 3.329 3.223 3.413 . 0 0 "[ . 1 . 2]" 1
843 1 34 TYR H 1 42 VAL H . . 3.810 3.718 3.662 3.769 . 0 0 "[ . 1 . 2]" 1
844 1 33 SER H 1 34 TYR H . . 2.900 2.639 2.633 2.646 . 0 0 "[ . 1 . 2]" 1
845 1 34 TYR H 1 35 LYS H . . 4.340 4.237 4.210 4.316 . 0 0 "[ . 1 . 2]" 1
846 1 35 LYS H 1 36 HIS H . . 4.710 4.597 4.585 4.605 . 0 0 "[ . 1 . 2]" 1
847 1 34 TYR QD 1 35 LYS H . . 3.820 3.410 3.359 3.487 . 0 0 "[ . 1 . 2]" 1
848 1 34 TYR QE 1 35 LYS H . . 5.500 5.545 5.529 5.570 0.070 15 0 "[ . 1 . 2]" 1
849 1 34 TYR HA 1 35 LYS H . . 3.050 2.265 2.242 2.375 . 0 0 "[ . 1 . 2]" 1
850 1 15 GLU HA 1 24 LEU H . . 3.690 3.581 3.406 3.721 0.031 15 0 "[ . 1 . 2]" 1
851 1 36 HIS H 1 41 LEU HA . . 3.280 2.448 2.345 2.509 . 0 0 "[ . 1 . 2]" 1
852 1 35 LYS HA 1 36 HIS H . . 2.900 2.240 2.225 2.254 . 0 0 "[ . 1 . 2]" 1
853 1 36 HIS H 1 42 VAL H . . 4.230 3.974 3.810 4.086 . 0 0 "[ . 1 . 2]" 1
854 1 36 HIS H 1 36 HIS HD2 . . 5.500 5.531 5.495 5.555 0.055 14 0 "[ . 1 . 2]" 1
855 1 37 GLY H 1 38 GLN H . . 4.980 4.540 4.531 4.550 . 0 0 "[ . 1 . 2]" 1
856 1 37 GLY H 1 39 GLY H . . 5.260 5.134 5.117 5.142 . 0 0 "[ . 1 . 2]" 1
857 1 36 HIS HD2 1 37 GLY H . . 4.640 3.797 3.535 3.962 . 0 0 "[ . 1 . 2]" 1
858 1 39 GLY H 1 40 TRP H . . 3.270 2.591 2.573 2.603 . 0 0 "[ . 1 . 2]" 1
859 1 40 TRP H 1 40 TRP HE1 . . 5.500 5.608 5.580 5.619 0.119 17 0 "[ . 1 . 2]" 1
860 1 40 TRP H 1 40 TRP HD1 . . 3.480 3.473 3.377 3.516 0.036 3 0 "[ . 1 . 2]" 1
861 1 36 HIS HD2 1 40 TRP H . . 5.300 5.052 4.894 5.141 . 0 0 "[ . 1 . 2]" 1
862 1 36 HIS HA 1 40 TRP H . . 5.500 5.542 5.519 5.554 0.054 6 0 "[ . 1 . 2]" 1
863 1 37 GLY HA3 1 40 TRP H . . 5.040 4.971 4.940 4.994 . 0 0 "[ . 1 . 2]" 1
864 1 38 GLN H 1 39 GLY H . . 4.420 2.616 2.608 2.625 . 0 0 "[ . 1 . 2]" 1
865 1 41 LEU H 1 56 GLU H . . 4.620 4.514 4.451 4.590 . 0 0 "[ . 1 . 2]" 1
866 1 35 LYS HA 1 41 LEU H . . 5.500 5.264 5.221 5.308 . 0 0 "[ . 1 . 2]" 1
867 1 41 LEU H 1 42 VAL H . . 4.700 4.373 4.340 4.398 . 0 0 "[ . 1 . 2]" 1
868 1 34 TYR QD 1 42 VAL H . . 4.690 4.327 4.260 4.393 . 0 0 "[ . 1 . 2]" 1
869 1 41 LEU HA 1 42 VAL H . . 2.930 2.165 2.159 2.182 . 0 0 "[ . 1 . 2]" 1
870 1 35 LYS HA 1 42 VAL H . . 3.660 3.554 3.438 3.658 . 0 0 "[ . 1 . 2]" 1
871 1 42 VAL H 1 43 ALA H . . 4.520 4.393 4.353 4.441 . 0 0 "[ . 1 . 2]" 1
872 1 43 ALA H 1 53 LEU HA . . 3.870 3.167 3.057 3.326 . 0 0 "[ . 1 . 2]" 1
873 1 42 VAL HA 1 43 ALA H . . 2.650 2.147 2.141 2.154 . 0 0 "[ . 1 . 2]" 1
874 1 43 ALA H 1 52 GLY QA . . 4.590 4.410 4.356 4.471 . 0 0 "[ . 1 . 2]" 1
875 1 32 ILE HA 1 43 ALA H . . 4.790 4.461 4.412 4.502 . 0 0 "[ . 1 . 2]" 1
876 1 43 ALA HA 1 44 GLU H . . 2.790 2.396 2.346 2.457 . 0 0 "[ . 1 . 2]" 1
877 1 30 VAL HA 1 44 GLU H . . 4.710 4.481 4.391 4.640 . 0 0 "[ . 1 . 2]" 1
878 1 32 ILE HA 1 44 GLU H . . 4.150 3.962 3.938 3.993 . 0 0 "[ . 1 . 2]" 1
879 1 45 ASN H 1 50 LYS H . . 3.900 3.658 3.387 3.800 . 0 0 "[ . 1 . 2]" 1
880 1 45 ASN H 1 45 ASN HD21 . . 4.620 2.390 1.881 4.367 . 0 0 "[ . 1 . 2]" 1
881 1 45 ASN H 1 46 GLU H . . 4.620 4.528 4.514 4.555 . 0 0 "[ . 1 . 2]" 1
882 1 44 GLU H 1 45 ASN H . . 4.580 4.495 4.459 4.515 . 0 0 "[ . 1 . 2]" 1
883 1 45 ASN H 1 50 LYS HA . . 5.250 5.004 4.802 5.131 . 0 0 "[ . 1 . 2]" 1
884 1 44 GLU HA 1 45 ASN H . . 2.660 2.338 2.306 2.371 . 0 0 "[ . 1 . 2]" 1
885 1 45 ASN H 1 51 THR HA . . 3.570 3.448 3.291 3.542 . 0 0 "[ . 1 . 2]" 1
886 1 45 ASN H 1 48 GLY H . . 4.170 4.141 4.087 4.189 0.019 18 0 "[ . 1 . 2]" 1
887 1 45 ASN HD21 1 46 GLU H . . 4.860 4.122 4.092 4.202 . 0 0 "[ . 1 . 2]" 1
888 1 45 ASN HA 1 46 GLU H . . 3.060 2.645 2.583 2.656 . 0 0 "[ . 1 . 2]" 1
889 1 45 ASN HD22 1 46 GLU H . . 4.860 4.526 4.380 4.935 0.075 16 0 "[ . 1 . 2]" 1
890 1 46 GLU H 1 47 SER H . . 3.420 2.550 2.436 2.655 . 0 0 "[ . 1 . 2]" 1
891 1 45 ASN HD21 1 47 SER H . . 4.660 3.674 3.546 3.749 . 0 0 "[ . 1 . 2]" 1
892 1 45 ASN HD22 1 47 SER H . . 4.660 3.098 2.901 3.793 . 0 0 "[ . 1 . 2]" 1
893 1 45 ASN HD22 1 48 GLY H . . 4.180 2.358 2.045 3.385 . 0 0 "[ . 1 . 2]" 1
894 1 45 ASN HD22 1 50 LYS H . . 3.230 2.071 1.937 2.180 . 0 0 "[ . 1 . 2]" 1
895 1 45 ASN HD21 1 50 LYS H . . 3.230 2.570 2.299 3.334 0.104 10 0 "[ . 1 . 2]" 1
896 1 45 ASN H 1 45 ASN HD22 . . 4.620 3.750 3.571 4.397 . 0 0 "[ . 1 . 2]" 1
897 1 47 SER H 1 50 LYS H . . 5.280 5.023 4.863 5.246 . 0 0 "[ . 1 . 2]" 1
898 1 45 ASN HD21 1 48 GLY H . . 4.180 2.852 2.505 4.187 0.007 11 0 "[ . 1 . 2]" 1
899 1 45 ASN HA 1 48 GLY H . . 4.900 4.775 4.708 4.808 . 0 0 "[ . 1 . 2]" 1
900 1 48 GLY H 1 48 GLY HA3 . . 2.950 2.843 2.828 2.873 . 0 0 "[ . 1 . 2]" 1
901 1 48 GLY H 1 48 GLY HA2 . . 2.750 2.301 2.297 2.312 . 0 0 "[ . 1 . 2]" 1
902 1 45 ASN HB2 1 48 GLY H . . 4.710 4.540 3.815 4.732 0.022 1 0 "[ . 1 . 2]" 1
903 1 48 GLY H 1 49 SER H . . 2.810 2.609 2.477 2.653 . 0 0 "[ . 1 . 2]" 1
904 1 45 ASN HD21 1 49 SER H . . 3.640 3.186 3.051 3.657 0.017 11 0 "[ . 1 . 2]" 1
905 1 45 ASN HD22 1 49 SER H . . 3.640 1.893 1.858 2.061 . 0 0 "[ . 1 . 2]" 1
906 1 49 SER H 1 50 LYS H . . 2.600 2.006 1.946 2.056 . 0 0 "[ . 1 . 2]" 1
907 1 48 GLY H 1 50 LYS H . . 3.690 3.651 3.574 3.753 0.063 16 0 "[ . 1 . 2]" 1
908 1 44 GLU HA 1 50 LYS H . . 5.330 5.165 5.085 5.259 . 0 0 "[ . 1 . 2]" 1
909 1 51 THR H 1 52 GLY H . . 4.520 4.399 4.264 4.475 . 0 0 "[ . 1 . 2]" 1
910 1 44 GLU HA 1 51 THR H . . 4.910 4.674 4.628 4.711 . 0 0 "[ . 1 . 2]" 1
911 1 50 LYS HA 1 51 THR H . . 2.670 2.162 2.142 2.198 . 0 0 "[ . 1 . 2]" 1
912 1 50 LYS H 1 51 THR H . . 4.380 4.383 4.319 4.426 0.046 18 0 "[ . 1 . 2]" 1
913 1 52 GLY H 1 53 LEU H . . 4.560 4.274 4.189 4.333 . 0 0 "[ . 1 . 2]" 1
914 1 45 ASN H 1 52 GLY H . . 5.400 5.052 4.858 5.229 . 0 0 "[ . 1 . 2]" 1
915 1 22 LEU H 1 52 GLY H . . 5.500 5.504 5.352 5.556 0.056 10 0 "[ . 1 . 2]" 1
916 1 51 THR HA 1 52 GLY H . . 2.950 2.239 2.155 2.301 . 0 0 "[ . 1 . 2]" 1
917 1 44 GLU HA 1 52 GLY H . . 3.830 3.132 2.981 3.227 . 0 0 "[ . 1 . 2]" 1
918 1 53 LEU H 2 3 PHE QD . . 4.710 4.627 4.488 4.724 0.014 12 0 "[ . 1 . 2]" 1
919 1 21 GLU HA 1 53 LEU H . . 3.280 2.083 1.967 2.255 . 0 0 "[ . 1 . 2]" 1
920 1 52 GLY QA 1 53 LEU H . . 2.900 2.221 2.192 2.243 . 0 0 "[ . 1 . 2]" 1
921 1 42 VAL HA 1 53 LEU H . . 5.050 4.719 4.637 4.795 . 0 0 "[ . 1 . 2]" 1
922 1 40 TRP HZ3 1 54 VAL H . . 4.960 4.750 4.590 4.872 . 0 0 "[ . 1 . 2]" 1
923 1 53 LEU HA 1 54 VAL H . . 2.780 2.178 2.151 2.214 . 0 0 "[ . 1 . 2]" 1
924 1 42 VAL HA 1 54 VAL H . . 3.690 3.373 3.240 3.497 . 0 0 "[ . 1 . 2]" 1
925 1 52 GLY QA 1 54 VAL H . . 5.500 5.423 5.322 5.514 0.014 18 0 "[ . 1 . 2]" 1
926 1 40 TRP HE3 1 56 GLU H . . 5.500 5.142 4.954 5.317 . 0 0 "[ . 1 . 2]" 1
927 1 56 GLU H 1 59 VAL H . . 5.500 5.132 5.037 5.273 . 0 0 "[ . 1 . 2]" 1
928 1 40 TRP HA 1 56 GLU H . . 3.970 3.946 3.768 4.006 0.036 8 0 "[ . 1 . 2]" 1
929 1 55 PRO HA 1 56 GLU H . . 2.700 2.218 2.196 2.259 . 0 0 "[ . 1 . 2]" 1
930 1 56 GLU H 1 57 GLU H . . 3.350 2.224 2.170 2.258 . 0 0 "[ . 1 . 2]" 1
931 1 57 GLU H 1 58 PHE QD . . 4.500 4.484 4.395 4.524 0.024 3 0 "[ . 1 . 2]" 1
932 1 55 PRO HA 1 57 GLU H . . 4.100 3.885 3.828 3.989 . 0 0 "[ . 1 . 2]" 1
933 1 58 PHE H 1 58 PHE QD . . 3.760 3.493 3.447 3.524 . 0 0 "[ . 1 . 2]" 1
934 1 12 TYR QD 1 58 PHE H . . 5.100 4.980 4.947 5.026 . 0 0 "[ . 1 . 2]" 1
935 1 57 GLU H 1 58 PHE H . . 3.230 2.600 2.574 2.620 . 0 0 "[ . 1 . 2]" 1
936 1 56 GLU H 1 58 PHE H . . 4.310 3.829 3.729 3.898 . 0 0 "[ . 1 . 2]" 1
937 1 58 PHE H 1 59 VAL HA . . 4.660 4.639 4.615 4.697 0.037 15 0 "[ . 1 . 2]" 1
938 1 58 PHE H 1 59 VAL H . . 2.770 1.918 1.854 2.064 . 0 0 "[ . 1 . 2]" 1
939 1 12 TYR H 1 59 VAL H . . 5.500 5.487 5.443 5.525 0.025 11 0 "[ . 1 . 2]" 1
940 1 58 PHE QD 1 59 VAL H . . 4.800 4.660 4.617 4.678 . 0 0 "[ . 1 . 2]" 1
941 1 12 TYR QD 1 59 VAL H . . 5.360 5.278 5.149 5.372 0.012 16 0 "[ . 1 . 2]" 1
942 1 59 VAL H 1 60 SER H . . 4.700 4.473 4.442 4.499 . 0 0 "[ . 1 . 2]" 1
943 1 57 GLU H 1 59 VAL H . . 4.270 4.194 4.155 4.258 . 0 0 "[ . 1 . 2]" 1
944 1 11 LEU H 1 59 VAL H . . 4.770 4.492 4.376 4.572 . 0 0 "[ . 1 . 2]" 1
945 1 57 GLU HA 1 59 VAL H . . 3.960 3.853 3.683 3.982 0.022 11 0 "[ . 1 . 2]" 1
946 1 56 GLU HA 1 59 VAL H . . 4.340 3.571 3.452 3.772 . 0 0 "[ . 1 . 2]" 1
947 1 59 VAL HA 1 60 SER H . . 2.790 2.456 2.377 2.503 . 0 0 "[ . 1 . 2]" 1
948 1 8 ALA HA 1 60 SER H . . 4.470 4.376 4.263 4.478 0.008 10 0 "[ . 1 . 2]" 1
949 1 61 TYR H 1 61 TYR QE . . 4.660 4.613 4.545 4.661 0.001 14 0 "[ . 1 . 2]" 1
950 1 60 SER HA 1 61 TYR H . . 2.770 2.139 2.138 2.142 . 0 0 "[ . 1 . 2]" 1
951 1 6 GLN HE22 1 62 ILE H . . 4.980 4.758 3.552 4.987 0.007 9 0 "[ . 1 . 2]" 1
952 1 61 TYR QD 1 62 ILE H . . 4.540 4.258 4.169 4.336 . 0 0 "[ . 1 . 2]" 1
953 1 8 ALA HA 1 62 ILE H . . 3.290 2.393 2.255 2.580 . 0 0 "[ . 1 . 2]" 1
954 1 61 TYR HA 1 62 ILE H . . 2.840 2.165 2.143 2.187 . 0 0 "[ . 1 . 2]" 1
955 1 65 GLU H 1 66 LEU H . . 3.550 2.131 1.921 2.759 . 0 0 "[ . 1 . 2]" 1
956 1 65 GLU HA 1 66 LEU H . . 3.210 2.937 2.715 3.029 . 0 0 "[ . 1 . 2]" 1
957 1 66 LEU HA 1 67 GLU H . . 2.890 2.453 2.146 2.961 0.071 9 0 "[ . 1 . 2]" 1
958 1 4 VAL H 1 35 LYS H . . 5.500 5.388 5.190 5.516 0.016 12 0 "[ . 1 . 2]" 1
959 1 4 VAL H 1 34 TYR HA . . 3.640 3.431 3.221 3.617 . 0 0 "[ . 1 . 2]" 1
960 1 3 ILE HA 1 4 VAL H . . 2.580 2.150 2.140 2.185 . 0 0 "[ . 1 . 2]" 1
961 1 2 ALA HA 1 3 ILE H . . 3.510 2.722 2.142 3.503 . 0 0 "[ . 1 . 2]" 1
962 1 61 TYR H 1 61 TYR QD . . 3.390 2.310 2.233 2.367 . 0 0 "[ . 1 . 2]" 1
963 1 60 SER QB 1 61 TYR H . . 4.010 3.852 3.799 3.887 . 0 0 "[ . 1 . 2]" 1
964 1 61 TYR H 1 61 TYR HB3 . . 3.690 3.514 3.502 3.527 . 0 0 "[ . 1 . 2]" 1
965 1 61 TYR H 1 61 TYR HB2 . . 3.000 2.217 2.197 2.238 . 0 0 "[ . 1 . 2]" 1
966 1 8 ALA MB 1 61 TYR H . . 3.920 3.650 3.510 3.812 . 0 0 "[ . 1 . 2]" 1
967 1 11 LEU MD2 1 61 TYR H . . 5.500 5.455 5.373 5.512 0.012 15 0 "[ . 1 . 2]" 1
968 1 11 LEU MD1 1 61 TYR H . . 5.500 5.287 5.174 5.440 . 0 0 "[ . 1 . 2]" 1
969 1 59 VAL MG2 1 61 TYR H . . 4.770 4.289 4.171 4.394 . 0 0 "[ . 1 . 2]" 1
970 1 2 ALA MB 1 3 ILE H . . 4.590 3.400 2.597 3.720 . 0 0 "[ . 1 . 2]" 1
971 1 3 ILE H 1 3 ILE HG13 . . 4.680 3.025 2.068 3.971 . 0 0 "[ . 1 . 2]" 1
972 1 3 ILE H 1 3 ILE MD . . 4.530 3.250 1.970 4.133 . 0 0 "[ . 1 . 2]" 1
973 1 3 ILE H 1 3 ILE HG12 . . 4.680 3.985 2.531 4.517 . 0 0 "[ . 1 . 2]" 1
974 1 4 VAL H 1 4 VAL HB . . 3.050 2.679 2.532 2.988 . 0 0 "[ . 1 . 2]" 1
975 1 3 ILE MG 1 4 VAL H . . 3.400 2.647 2.385 2.959 . 0 0 "[ . 1 . 2]" 1
976 1 4 VAL H 1 34 TYR HB3 . . 4.590 3.362 3.031 3.767 . 0 0 "[ . 1 . 2]" 1
977 1 4 VAL H 1 34 TYR HB2 . . 4.820 4.314 3.971 4.673 . 0 0 "[ . 1 . 2]" 1
978 1 5 ASN H 1 5 ASN HB3 . . 4.010 3.806 3.577 4.022 0.012 20 0 "[ . 1 . 2]" 1
979 1 5 ASN H 1 5 ASN HB2 . . 4.010 3.069 2.310 3.711 . 0 0 "[ . 1 . 2]" 1
980 1 67 GLU H 1 67 GLU QB . . 3.010 2.625 2.296 2.939 . 0 0 "[ . 1 . 2]" 1
981 1 3 ILE MG 1 5 ASN H . . 4.100 2.882 1.914 4.137 0.037 18 0 "[ . 1 . 2]" 1
982 1 6 GLN H 1 6 GLN HB3 . . 3.320 2.629 2.519 2.701 . 0 0 "[ . 1 . 2]" 1
983 1 6 GLN H 1 6 GLN HB2 . . 3.470 2.808 2.682 2.962 . 0 0 "[ . 1 . 2]" 1
984 1 5 ASN HB2 1 6 GLN H . . 4.730 4.445 4.264 4.642 . 0 0 "[ . 1 . 2]" 1
985 1 5 ASN HB3 1 6 GLN H . . 4.730 4.377 4.249 4.503 . 0 0 "[ . 1 . 2]" 1
986 1 6 GLN H 1 32 ILE HB . . 3.890 3.740 3.458 3.936 0.046 18 0 "[ . 1 . 2]" 1
987 1 7 ARG H 1 7 ARG QD . . 4.360 3.603 3.003 3.802 . 0 0 "[ . 1 . 2]" 1
988 1 6 GLN HG3 1 7 ARG H . . 3.960 2.989 2.680 3.431 . 0 0 "[ . 1 . 2]" 1
989 1 6 GLN HB2 1 7 ARG H . . 4.460 4.274 4.169 4.357 . 0 0 "[ . 1 . 2]" 1
990 1 7 ARG H 1 7 ARG HB3 . . 3.140 2.511 2.421 2.617 . 0 0 "[ . 1 . 2]" 1
991 1 7 ARG H 1 7 ARG HG2 . . 3.680 2.387 2.295 2.489 . 0 0 "[ . 1 . 2]" 1
992 1 7 ARG H 1 7 ARG HG3 . . 4.110 3.826 3.745 3.897 . 0 0 "[ . 1 . 2]" 1
993 1 7 ARG H 1 7 ARG HB2 . . 3.750 3.620 3.596 3.655 . 0 0 "[ . 1 . 2]" 1
994 1 7 ARG H 1 8 ALA MB . . 5.310 5.080 4.985 5.147 . 0 0 "[ . 1 . 2]" 1
995 1 7 ARG H 1 62 ILE MD . . 5.500 5.465 5.327 5.519 0.019 3 0 "[ . 1 . 2]" 1
996 1 7 ARG QD 1 8 ALA H . . 5.170 4.830 4.614 4.960 . 0 0 "[ . 1 . 2]" 1
997 1 7 ARG HB2 1 8 ALA H . . 3.580 2.537 2.475 2.622 . 0 0 "[ . 1 . 2]" 1
998 1 7 ARG HG2 1 8 ALA H . . 4.750 4.069 3.999 4.229 . 0 0 "[ . 1 . 2]" 1
999 1 8 ALA H 1 32 ILE HG12 . . 5.040 4.040 3.880 4.084 . 0 0 "[ . 1 . 2]" 1
1000 1 7 ARG HG3 1 8 ALA H . . 3.860 3.474 3.195 3.617 . 0 0 "[ . 1 . 2]" 1
1001 1 8 ALA H 1 32 ILE HG13 . . 5.500 5.479 5.293 5.514 0.014 9 0 "[ . 1 . 2]" 1
1002 1 8 ALA H 1 43 ALA MB . . 5.500 5.398 5.311 5.456 . 0 0 "[ . 1 . 2]" 1
1003 1 7 ARG HB3 1 8 ALA H . . 4.180 3.907 3.864 3.958 . 0 0 "[ . 1 . 2]" 1
1004 1 8 ALA H 1 62 ILE HG13 . . 4.630 4.144 3.973 4.251 . 0 0 "[ . 1 . 2]" 1
1005 1 8 ALA H 1 8 ALA MB . . 3.170 2.723 2.680 2.775 . 0 0 "[ . 1 . 2]" 1
1006 1 8 ALA H 1 29 ILE MG . . 3.850 3.331 3.070 3.692 . 0 0 "[ . 1 . 2]" 1
1007 1 8 ALA H 1 62 ILE MD . . 4.180 3.483 3.279 3.633 . 0 0 "[ . 1 . 2]" 1
1008 1 8 ALA H 1 30 VAL MG2 . . 3.500 3.335 3.198 3.509 0.009 12 0 "[ . 1 . 2]" 1
1009 1 9 VAL H 1 60 SER QB . . 4.010 3.558 3.438 3.715 . 0 0 "[ . 1 . 2]" 1
1010 1 9 VAL H 1 9 VAL HB . . 3.500 2.836 2.819 2.874 . 0 0 "[ . 1 . 2]" 1
1011 1 9 VAL H 1 59 VAL HB . . 3.840 3.800 3.709 3.850 0.010 12 0 "[ . 1 . 2]" 1
1012 1 9 VAL H 1 62 ILE HG12 . . 4.140 3.432 3.285 3.576 . 0 0 "[ . 1 . 2]" 1
1013 1 9 VAL H 1 9 VAL MG1 . . 2.730 2.080 1.980 2.157 . 0 0 "[ . 1 . 2]" 1
1014 1 9 VAL H 1 30 VAL MG2 . . 4.780 4.440 4.292 4.729 . 0 0 "[ . 1 . 2]" 1
1015 1 9 VAL H 1 59 VAL MG1 . . 5.250 4.654 4.512 4.733 . 0 0 "[ . 1 . 2]" 1
1016 1 10 ALA H 1 27 GLY HA2 . . 4.670 4.263 4.066 4.534 . 0 0 "[ . 1 . 2]" 1
1017 1 10 ALA H 1 26 GLU HA . . 5.240 4.969 4.830 5.093 . 0 0 "[ . 1 . 2]" 1
1018 1 9 VAL HB 1 10 ALA H . . 4.300 4.016 3.968 4.166 . 0 0 "[ . 1 . 2]" 1
1019 1 10 ALA H 1 10 ALA MB . . 2.730 2.168 2.139 2.207 . 0 0 "[ . 1 . 2]" 1
1020 1 9 VAL MG2 1 10 ALA H . . 2.850 2.142 2.053 2.361 . 0 0 "[ . 1 . 2]" 1
1021 1 10 ALA H 1 30 VAL MG2 . . 4.560 4.012 3.662 4.497 . 0 0 "[ . 1 . 2]" 1
1022 1 10 ALA H 1 59 VAL MG1 . . 5.060 4.253 3.955 4.409 . 0 0 "[ . 1 . 2]" 1
1023 1 11 LEU H 1 26 GLU HA . . 4.800 4.608 4.371 4.773 . 0 0 "[ . 1 . 2]" 1
1024 1 10 ALA MB 1 11 LEU H . . 3.540 3.323 3.104 3.435 . 0 0 "[ . 1 . 2]" 1
1025 1 11 LEU H 1 11 LEU HG . . 3.110 2.009 1.940 2.154 . 0 0 "[ . 1 . 2]" 1
1026 1 11 LEU H 1 11 LEU HB2 . . 3.230 2.705 2.670 2.764 . 0 0 "[ . 1 . 2]" 1
1027 1 9 VAL MG1 1 11 LEU H . . 4.620 4.066 3.792 4.502 . 0 0 "[ . 1 . 2]" 1
1028 1 11 LEU H 1 11 LEU MD2 . . 3.250 3.082 2.976 3.220 . 0 0 "[ . 1 . 2]" 1
1029 1 11 LEU H 1 11 LEU HB3 . . 3.780 3.607 3.582 3.658 . 0 0 "[ . 1 . 2]" 1
1030 1 12 TYR H 1 58 PHE HB3 . . 4.060 3.434 3.360 3.493 . 0 0 "[ . 1 . 2]" 1
1031 1 12 TYR H 1 26 GLU HA . . 4.620 3.839 3.663 4.022 . 0 0 "[ . 1 . 2]" 1
1032 1 12 TYR H 1 12 TYR HB2 . . 3.490 3.030 2.983 3.065 . 0 0 "[ . 1 . 2]" 1
1033 1 12 TYR H 1 24 LEU HB3 . . 5.460 5.269 5.065 5.353 . 0 0 "[ . 1 . 2]" 1
1034 1 12 TYR H 1 24 LEU HG . . 5.500 5.337 5.104 5.503 0.003 18 0 "[ . 1 . 2]" 1
1035 1 12 TYR H 1 26 GLU HG3 . . 5.010 4.935 4.803 5.019 0.009 12 0 "[ . 1 . 2]" 1
1036 1 12 TYR H 1 26 GLU HG2 . . 5.500 5.377 5.222 5.512 0.012 8 0 "[ . 1 . 2]" 1
1037 1 12 TYR H 1 26 GLU HB2 . . 4.840 4.618 4.444 4.827 . 0 0 "[ . 1 . 2]" 1
1038 1 10 ALA MB 1 12 TYR H . . 3.520 3.470 3.299 3.534 0.014 3 0 "[ . 1 . 2]" 1
1039 1 11 LEU HG 1 12 TYR H . . 3.960 3.918 3.802 3.971 0.011 14 0 "[ . 1 . 2]" 1
1040 1 11 LEU HB2 1 12 TYR H . . 3.510 2.702 2.620 2.839 . 0 0 "[ . 1 . 2]" 1
1041 1 11 LEU MD2 1 12 TYR H . . 4.900 4.568 4.483 4.655 . 0 0 "[ . 1 . 2]" 1
1042 1 11 LEU MD1 1 12 TYR H . . 5.210 4.391 4.304 4.548 . 0 0 "[ . 1 . 2]" 1
1043 1 11 LEU HB3 1 12 TYR H . . 4.280 3.936 3.864 4.055 . 0 0 "[ . 1 . 2]" 1
1044 1 12 TYR HB3 1 13 ASP H . . 3.170 2.940 2.718 3.174 0.004 15 0 "[ . 1 . 2]" 1
1045 1 12 TYR HB2 1 13 ASP H . . 4.020 3.652 3.408 3.858 . 0 0 "[ . 1 . 2]" 1
1046 1 13 ASP H 1 26 GLU HG3 . . 4.580 4.554 4.411 4.631 0.051 14 0 "[ . 1 . 2]" 1
1047 1 13 ASP H 1 24 LEU HB3 . . 5.500 5.618 5.579 5.655 0.155 9 0 "[ . 1 . 2]" 1
1048 1 13 ASP H 1 26 GLU HB2 . . 3.780 2.718 2.498 2.822 . 0 0 "[ . 1 . 2]" 1
1049 1 13 ASP H 1 26 GLU HB3 . . 4.140 4.092 3.762 4.178 0.038 14 0 "[ . 1 . 2]" 1
1050 1 10 ALA MB 1 13 ASP H . . 5.270 5.028 4.900 5.158 . 0 0 "[ . 1 . 2]" 1
1051 1 13 ASP H 1 25 ALA MB . . 5.430 5.155 5.043 5.235 . 0 0 "[ . 1 . 2]" 1
1052 1 14 PHE H 1 14 PHE HB2 . . 3.550 3.509 3.456 3.575 0.025 11 0 "[ . 1 . 2]" 1
1053 1 14 PHE H 1 14 PHE HB3 . . 3.560 2.651 2.539 2.782 . 0 0 "[ . 1 . 2]" 1
1054 1 14 PHE H 1 24 LEU HB3 . . 3.190 2.479 2.298 2.683 . 0 0 "[ . 1 . 2]" 1
1055 1 14 PHE H 1 15 GLU QB . . 5.430 5.216 5.044 5.374 . 0 0 "[ . 1 . 2]" 1
1056 1 10 ALA MB 1 14 PHE H . . 5.300 5.019 4.816 5.202 . 0 0 "[ . 1 . 2]" 1
1057 1 14 PHE H 1 24 LEU HB2 . . 3.700 3.444 3.286 3.677 . 0 0 "[ . 1 . 2]" 1
1058 1 14 PHE H 1 24 LEU MD2 . . 5.060 4.374 4.204 4.586 . 0 0 "[ . 1 . 2]" 1
1059 1 14 PHE H 1 24 LEU MD1 . . 5.060 4.924 4.823 5.066 0.006 15 0 "[ . 1 . 2]" 1
1060 1 15 GLU H 1 16 PRO HD3 . . 5.120 4.840 4.774 4.932 . 0 0 "[ . 1 . 2]" 1
1061 1 15 GLU H 1 16 PRO HD2 . . 5.030 4.835 4.830 4.840 . 0 0 "[ . 1 . 2]" 1
1062 1 14 PHE HB2 1 15 GLU H . . 3.970 3.764 3.691 3.810 . 0 0 "[ . 1 . 2]" 1
1063 1 14 PHE HB3 1 15 GLU H . . 4.230 4.134 4.073 4.167 . 0 0 "[ . 1 . 2]" 1
1064 1 15 GLU H 1 15 GLU QB . . 2.690 2.420 2.347 2.494 . 0 0 "[ . 1 . 2]" 1
1065 1 17 GLU H 1 17 GLU HB2 . . 3.520 2.433 2.230 3.108 . 0 0 "[ . 1 . 2]" 1
1066 1 17 GLU H 1 21 GLU HB2 . . 3.820 3.149 2.925 3.322 . 0 0 "[ . 1 . 2]" 1
1067 1 16 PRO HB2 1 17 GLU H . . 3.690 3.197 3.012 3.476 . 0 0 "[ . 1 . 2]" 1
1068 1 17 GLU H 1 17 GLU HB3 . . 3.520 3.286 2.490 3.536 0.016 15 0 "[ . 1 . 2]" 1
1069 1 18 ASN H 1 18 ASN HB2 . . 3.290 2.444 2.382 2.549 . 0 0 "[ . 1 . 2]" 1
1070 1 18 ASN H 1 21 GLU HB2 . . 2.940 2.685 2.457 2.808 . 0 0 "[ . 1 . 2]" 1
1071 1 18 ASN H 1 18 ASN HB3 . . 3.920 3.641 3.597 3.716 . 0 0 "[ . 1 . 2]" 1
1072 1 16 PRO HB2 1 18 ASN H . . 3.360 3.115 2.884 3.292 . 0 0 "[ . 1 . 2]" 1
1073 1 20 ASN H 1 20 ASN HB2 . . 3.940 3.694 3.593 3.744 . 0 0 "[ . 1 . 2]" 1
1074 1 18 ASN HB3 1 20 ASN H . . 2.950 2.521 2.311 2.795 . 0 0 "[ . 1 . 2]" 1
1075 1 18 ASN HB2 1 20 ASN H . . 3.480 2.976 2.790 3.083 . 0 0 "[ . 1 . 2]" 1
1076 1 20 ASN H 1 20 ASN HB3 . . 3.630 3.509 3.312 3.589 . 0 0 "[ . 1 . 2]" 1
1077 1 21 GLU H 1 52 GLY QA . . 5.320 5.078 4.944 5.286 . 0 0 "[ . 1 . 2]" 1
1078 1 20 ASN HB2 1 21 GLU H . . 4.570 4.244 4.204 4.306 . 0 0 "[ . 1 . 2]" 1
1079 1 18 ASN HB3 1 21 GLU H . . 4.220 4.137 3.993 4.262 0.042 9 0 "[ . 1 . 2]" 1
1080 1 18 ASN HB2 1 21 GLU H . . 3.850 3.739 3.461 3.863 0.013 17 0 "[ . 1 . 2]" 1
1081 1 21 GLU H 1 21 GLU HG2 . . 3.910 3.724 3.275 3.939 0.029 18 0 "[ . 1 . 2]" 1
1082 1 21 GLU H 1 21 GLU HG3 . . 3.910 3.330 3.036 3.924 0.014 16 0 "[ . 1 . 2]" 1
1083 1 16 PRO HB2 1 21 GLU H . . 4.060 3.609 3.464 3.755 . 0 0 "[ . 1 . 2]" 1
1084 1 16 PRO HG3 1 21 GLU H . . 5.480 5.168 5.024 5.314 . 0 0 "[ . 1 . 2]" 1
1085 1 21 GLU H 1 53 LEU HB2 . . 5.300 4.957 4.795 5.128 . 0 0 "[ . 1 . 2]" 1
1086 1 21 GLU H 1 21 GLU HB2 . . 2.990 2.389 2.316 2.436 . 0 0 "[ . 1 . 2]" 1
1087 1 20 ASN HB3 1 21 GLU H . . 4.690 4.611 4.573 4.642 . 0 0 "[ . 1 . 2]" 1
1088 1 20 ASN HD21 2 4 ILE H . . 4.020 2.420 2.052 3.181 . 0 0 "[ . 1 . 2]" 1
1089 1 20 ASN HD22 2 4 ILE H . . 4.570 3.342 2.874 4.000 . 0 0 "[ . 1 . 2]" 1
1090 1 20 ASN HB2 1 20 ASN HD21 . . 3.370 2.146 2.135 2.216 . 0 0 "[ . 1 . 2]" 1
1091 1 20 ASN HD21 2 3 PHE HB3 . . 4.110 3.306 3.014 3.737 . 0 0 "[ . 1 . 2]" 1
1092 1 20 ASN HD21 2 3 PHE HA . . 3.810 3.546 3.208 3.816 0.006 9 0 "[ . 1 . 2]" 1
1093 1 20 ASN HA 1 20 ASN HD21 . . 4.540 4.363 4.230 4.389 . 0 0 "[ . 1 . 2]" 1
1094 1 20 ASN HD21 2 5 PRO HA . . 4.200 3.560 3.253 3.732 . 0 0 "[ . 1 . 2]" 1
1095 1 20 ASN HD22 2 3 PHE HA . . 5.260 4.860 4.595 5.077 . 0 0 "[ . 1 . 2]" 1
1096 1 20 ASN HD22 2 5 PRO HA . . 4.450 3.078 2.673 3.378 . 0 0 "[ . 1 . 2]" 1
1097 1 20 ASN HB2 1 20 ASN HD22 . . 3.990 3.446 3.441 3.473 . 0 0 "[ . 1 . 2]" 1
1098 1 20 ASN HB3 1 20 ASN HD22 . . 4.040 3.999 3.990 4.043 0.003 11 0 "[ . 1 . 2]" 1
1099 1 20 ASN HD22 2 4 ILE HA . . 5.460 5.199 4.702 5.468 0.008 16 0 "[ . 1 . 2]" 1
1100 1 20 ASN HD21 1 53 LEU MD1 . . 5.000 2.106 1.911 2.377 . 0 0 "[ . 1 . 2]" 1
1101 1 20 ASN HD21 2 6 SER H . . 5.500 5.402 4.809 5.524 0.024 6 0 "[ . 1 . 2]" 1
1102 1 18 ASN HD22 2 7 ARG HE . . 4.780 3.889 2.084 4.812 0.032 9 0 "[ . 1 . 2]" 1
1103 1 18 ASN HD21 2 7 ARG HE . . 5.260 4.280 2.303 5.264 0.004 9 0 "[ . 1 . 2]" 1
1104 1 18 ASN HD22 2 6 SER H . . 5.210 3.349 2.924 4.672 . 0 0 "[ . 1 . 2]" 1
1105 1 17 GLU H 1 18 ASN HD21 . . 4.620 4.163 3.088 4.624 0.004 8 0 "[ . 1 . 2]" 1
1106 1 18 ASN HD22 2 6 SER QB . . 3.870 3.826 3.416 3.943 0.073 12 0 "[ . 1 . 2]" 1
1107 1 18 ASN HD21 2 6 SER QB . . 4.940 4.894 4.696 5.008 0.068 9 0 "[ . 1 . 2]" 1
1108 1 18 ASN HD22 2 7 ARG HD2 . . 4.640 3.045 1.951 4.226 . 0 0 "[ . 1 . 2]" 1
1109 1 18 ASN HD22 2 7 ARG HD3 . . 4.640 3.308 1.956 4.674 0.034 12 0 "[ . 1 . 2]" 1
1110 1 18 ASN HB2 1 18 ASN HD22 . . 3.550 3.453 3.434 3.540 . 0 0 "[ . 1 . 2]" 1
1111 1 17 GLU HB2 1 18 ASN HD22 . . 4.900 4.782 4.299 4.953 0.053 9 0 "[ . 1 . 2]" 1
1112 1 18 ASN HD21 2 7 ARG HD2 . . 4.920 3.456 2.477 4.760 . 0 0 "[ . 1 . 2]" 1
1113 1 18 ASN HD21 2 7 ARG HD3 . . 4.920 3.407 2.473 4.878 . 0 0 "[ . 1 . 2]" 1
1114 1 18 ASN HB3 1 18 ASN HD21 . . 3.550 3.340 3.262 3.530 . 0 0 "[ . 1 . 2]" 1
1115 1 18 ASN HB2 1 18 ASN HD21 . . 3.170 2.165 2.114 2.383 . 0 0 "[ . 1 . 2]" 1
1116 1 18 ASN HD21 1 21 GLU HG2 . . 4.650 4.299 3.922 4.657 0.007 14 0 "[ . 1 . 2]" 1
1117 1 18 ASN HD21 1 21 GLU HB2 . . 5.500 4.829 4.153 5.119 . 0 0 "[ . 1 . 2]" 1
1118 1 18 ASN HD21 1 21 GLU HG3 . . 4.650 3.087 2.671 3.340 . 0 0 "[ . 1 . 2]" 1
1119 1 18 ASN HA 1 18 ASN HD21 . . 4.450 3.952 3.522 4.120 . 0 0 "[ . 1 . 2]" 1
1120 1 18 ASN HD21 1 20 ASN H . . 5.110 5.079 4.897 5.138 0.028 17 0 "[ . 1 . 2]" 1
1121 1 18 ASN HA 1 18 ASN HD22 . . 5.030 4.296 4.131 4.424 . 0 0 "[ . 1 . 2]" 1
1122 1 3 ILE MG 1 5 ASN HD21 . . 4.010 2.744 2.227 3.998 . 0 0 "[ . 1 . 2]" 1
1123 1 5 ASN HA 1 5 ASN HD21 . . 4.580 2.539 1.948 4.055 . 0 0 "[ . 1 . 2]" 1
1124 1 5 ASN HA 1 5 ASN HD22 . . 4.850 3.735 3.326 4.578 . 0 0 "[ . 1 . 2]" 1
1125 1 3 ILE MG 1 5 ASN HD22 . . 3.820 2.900 1.904 3.815 . 0 0 "[ . 1 . 2]" 1
1126 1 38 GLN QB 1 38 GLN HE22 . . 4.930 4.106 3.367 4.429 . 0 0 "[ . 1 . 2]" 1
1127 1 6 GLN HE22 1 7 ARG H . . 4.880 3.841 2.587 4.223 . 0 0 "[ . 1 . 2]" 1
1128 1 6 GLN HE21 1 7 ARG H . . 4.340 3.432 2.518 4.050 . 0 0 "[ . 1 . 2]" 1
1129 1 6 GLN HE21 1 62 ILE H . . 4.460 3.302 2.532 3.704 . 0 0 "[ . 1 . 2]" 1
1130 1 6 GLN HA 1 6 GLN HE21 . . 4.600 3.952 3.582 4.398 . 0 0 "[ . 1 . 2]" 1
1131 1 6 GLN HE21 1 61 TYR HA . . 5.040 4.388 3.731 4.585 . 0 0 "[ . 1 . 2]" 1
1132 1 6 GLN HA 1 6 GLN HE22 . . 4.660 3.990 3.597 4.281 . 0 0 "[ . 1 . 2]" 1
1133 1 6 GLN HE21 1 6 GLN HG3 . . 3.460 2.238 2.119 2.482 . 0 0 "[ . 1 . 2]" 1
1134 1 6 GLN HE22 1 61 TYR HB3 . . 5.220 5.032 4.641 5.206 . 0 0 "[ . 1 . 2]" 1
1135 1 6 GLN HE21 1 61 TYR HB3 . . 4.770 3.668 3.057 4.005 . 0 0 "[ . 1 . 2]" 1
1136 1 6 GLN HE21 1 61 TYR HB2 . . 5.500 5.376 4.809 5.507 0.007 14 0 "[ . 1 . 2]" 1
1137 1 6 GLN HE21 1 8 ALA MB . . 5.460 5.229 4.235 5.471 0.011 19 0 "[ . 1 . 2]" 1
1138 1 6 GLN HE21 1 62 ILE MG . . 5.500 4.984 4.815 5.332 . 0 0 "[ . 1 . 2]" 1
1139 1 6 GLN HE22 1 62 ILE MG . . 5.440 5.240 4.410 5.435 . 0 0 "[ . 1 . 2]" 1
1140 1 6 GLN HB3 1 6 GLN HE21 . . 4.700 4.499 4.177 4.604 . 0 0 "[ . 1 . 2]" 1
1141 1 40 TRP H 1 40 TRP HB2 . . 3.090 2.570 2.557 2.581 . 0 0 "[ . 1 . 2]" 1
1142 1 36 HIS HB3 1 40 TRP H . . 4.200 3.911 3.838 3.938 . 0 0 "[ . 1 . 2]" 1
1143 1 37 GLY HA2 1 40 TRP H . . 4.450 4.167 4.116 4.191 . 0 0 "[ . 1 . 2]" 1
1144 1 40 TRP H 2 9 ALA MB . . 5.020 4.830 4.762 4.866 . 0 0 "[ . 1 . 2]" 1
1145 1 40 TRP H 1 41 LEU MD2 . . 5.060 3.247 3.172 3.334 . 0 0 "[ . 1 . 2]" 1
1146 1 40 TRP H 2 5 PRO HG3 . . 5.450 4.631 4.208 4.861 . 0 0 "[ . 1 . 2]" 1
1147 1 35 LYS HG3 1 40 TRP H . . 5.140 5.118 5.084 5.156 0.016 18 0 "[ . 1 . 2]" 1
1148 1 40 TRP H 2 5 PRO HG2 . . 5.450 5.059 4.767 5.454 0.004 14 0 "[ . 1 . 2]" 1
1149 1 38 GLN QB 1 40 TRP H . . 4.040 3.313 3.279 3.365 . 0 0 "[ . 1 . 2]" 1
1150 1 35 LYS QE 1 40 TRP H . . 5.500 5.387 5.305 5.507 0.007 11 0 "[ . 1 . 2]" 1
1151 1 36 HIS HB2 1 40 TRP H . . 5.500 5.514 5.423 5.546 0.046 3 0 "[ . 1 . 2]" 1
1152 1 36 HIS H 1 36 HIS HB3 . . 3.290 2.932 2.909 2.956 . 0 0 "[ . 1 . 2]" 1
1153 1 36 HIS H 1 36 HIS HB2 . . 3.380 2.987 2.898 3.019 . 0 0 "[ . 1 . 2]" 1
1154 1 35 LYS HB2 1 36 HIS H . . 4.220 3.864 3.841 3.895 . 0 0 "[ . 1 . 2]" 1
1155 1 35 LYS HB3 1 36 HIS H . . 4.570 4.086 4.052 4.133 . 0 0 "[ . 1 . 2]" 1
1156 1 35 LYS QD 1 36 HIS H . . 4.980 4.301 4.256 4.356 . 0 0 "[ . 1 . 2]" 1
1157 1 36 HIS H 1 41 LEU HB3 . . 4.380 3.639 3.492 3.764 . 0 0 "[ . 1 . 2]" 1
1158 1 35 LYS HG3 1 36 HIS H . . 4.030 2.304 2.247 2.365 . 0 0 "[ . 1 . 2]" 1
1159 1 35 LYS HG2 1 36 HIS H . . 4.210 3.055 2.991 3.150 . 0 0 "[ . 1 . 2]" 1
1160 1 36 HIS H 1 41 LEU MD2 . . 3.570 1.984 1.923 2.050 . 0 0 "[ . 1 . 2]" 1
1161 1 36 HIS H 1 42 VAL MG2 . . 4.820 4.643 4.478 4.780 . 0 0 "[ . 1 . 2]" 1
1162 1 36 HIS H 1 41 LEU MD1 . . 4.830 4.483 4.437 4.542 . 0 0 "[ . 1 . 2]" 1
1163 1 34 TYR H 1 42 VAL MG1 . . 4.390 4.164 3.921 4.355 . 0 0 "[ . 1 . 2]" 1
1164 1 34 TYR H 1 42 VAL MG2 . . 4.470 4.466 4.413 4.498 0.028 15 0 "[ . 1 . 2]" 1
1165 1 32 ILE MG 1 34 TYR H . . 3.170 2.657 2.601 2.715 . 0 0 "[ . 1 . 2]" 1
1166 1 34 TYR H 1 42 VAL HB . . 3.230 3.186 3.074 3.253 0.023 6 0 "[ . 1 . 2]" 1
1167 1 33 SER HB3 1 34 TYR H . . 3.640 3.433 3.369 3.582 . 0 0 "[ . 1 . 2]" 1
1168 1 33 SER HB2 1 34 TYR H . . 3.350 2.786 2.708 2.842 . 0 0 "[ . 1 . 2]" 1
1169 1 34 TYR H 1 34 TYR HB3 . . 3.780 3.442 3.417 3.526 . 0 0 "[ . 1 . 2]" 1
1170 1 33 SER H 1 42 VAL HA . . 5.200 5.182 5.162 5.206 0.006 17 0 "[ . 1 . 2]" 1
1171 1 57 GLU H 1 58 PHE HB2 . . 4.660 4.079 4.054 4.113 . 0 0 "[ . 1 . 2]" 1
1172 1 57 GLU H 1 57 GLU HB3 . . 3.350 3.213 3.131 3.302 . 0 0 "[ . 1 . 2]" 1
1173 1 57 GLU H 1 57 GLU HB2 . . 3.030 2.162 2.141 2.190 . 0 0 "[ . 1 . 2]" 1
1174 1 55 PRO QB 1 57 GLU H . . 3.730 3.008 2.984 3.027 . 0 0 "[ . 1 . 2]" 1
1175 1 41 LEU MD1 1 57 GLU H . . 5.390 5.012 4.883 5.100 . 0 0 "[ . 1 . 2]" 1
1176 1 57 GLU H 1 59 VAL MG2 . . 5.170 4.275 4.130 4.370 . 0 0 "[ . 1 . 2]" 1
1177 1 57 GLU H 2 9 ALA MB . . 5.170 4.103 3.967 4.222 . 0 0 "[ . 1 . 2]" 1
1178 1 56 GLU H 2 9 ALA MB . . 4.190 3.696 3.554 3.829 . 0 0 "[ . 1 . 2]" 1
1179 1 41 LEU MD2 1 56 GLU H . . 4.560 4.197 4.078 4.303 . 0 0 "[ . 1 . 2]" 1
1180 1 41 LEU MD1 1 56 GLU H . . 4.310 4.010 3.885 4.108 . 0 0 "[ . 1 . 2]" 1
1181 1 56 GLU H 1 59 VAL MG1 . . 5.500 5.473 5.345 5.512 0.012 16 0 "[ . 1 . 2]" 1
1182 1 56 GLU H 1 59 VAL MG2 . . 4.850 4.236 4.123 4.319 . 0 0 "[ . 1 . 2]" 1
1183 1 56 GLU H 1 56 GLU HG2 . . 4.750 4.482 4.442 4.528 . 0 0 "[ . 1 . 2]" 1
1184 1 56 GLU H 1 56 GLU HG3 . . 4.750 4.608 4.501 4.734 . 0 0 "[ . 1 . 2]" 1
1185 1 56 GLU H 1 57 GLU HB2 . . 4.230 4.079 4.040 4.116 . 0 0 "[ . 1 . 2]" 1
1186 1 56 GLU H 1 56 GLU HB2 . . 3.070 2.740 2.706 2.783 . 0 0 "[ . 1 . 2]" 1
1187 1 56 GLU H 1 56 GLU HB3 . . 3.070 2.509 2.485 2.525 . 0 0 "[ . 1 . 2]" 1
1188 1 55 PRO QB 1 56 GLU H . . 3.450 3.013 2.883 3.088 . 0 0 "[ . 1 . 2]" 1
1189 1 41 LEU HG 1 56 GLU H . . 4.010 3.600 3.544 3.665 . 0 0 "[ . 1 . 2]" 1
1190 1 56 GLU H 1 58 PHE HB2 . . 4.950 4.753 4.672 4.797 . 0 0 "[ . 1 . 2]" 1
1191 1 22 LEU H 1 22 LEU HB3 . . 3.420 2.652 2.394 3.079 . 0 0 "[ . 1 . 2]" 1
1192 1 16 PRO HB3 1 22 LEU H . . 3.690 3.507 3.411 3.603 . 0 0 "[ . 1 . 2]" 1
1193 1 16 PRO HB2 1 22 LEU H . . 5.090 4.965 4.892 5.042 . 0 0 "[ . 1 . 2]" 1
1194 1 22 LEU H 1 22 LEU HB2 . . 3.420 2.839 2.425 3.178 . 0 0 "[ . 1 . 2]" 1
1195 1 22 LEU H 1 22 LEU HG . . 4.690 4.380 4.213 4.516 . 0 0 "[ . 1 . 2]" 1
1196 1 22 LEU H 1 53 LEU HB3 . . 5.140 4.487 4.277 4.634 . 0 0 "[ . 1 . 2]" 1
1197 1 22 LEU H 1 53 LEU HG . . 5.500 4.864 4.598 5.277 . 0 0 "[ . 1 . 2]" 1
1198 1 22 LEU H 1 53 LEU HB2 . . 3.880 3.246 3.081 3.394 . 0 0 "[ . 1 . 2]" 1
1199 1 21 GLU HB3 1 22 LEU H . . 3.580 2.532 2.326 2.693 . 0 0 "[ . 1 . 2]" 1
1200 1 16 PRO HD3 1 23 ARG H . . 3.850 3.830 3.701 3.894 0.044 19 0 "[ . 1 . 2]" 1
1201 1 16 PRO HD2 1 23 ARG H . . 5.260 5.202 5.079 5.301 0.041 18 0 "[ . 1 . 2]" 1
1202 1 23 ARG H 1 23 ARG HD2 . . 4.920 4.238 2.193 4.725 . 0 0 "[ . 1 . 2]" 1
1203 1 23 ARG H 1 23 ARG HD3 . . 4.920 4.233 3.048 4.721 . 0 0 "[ . 1 . 2]" 1
1204 1 16 PRO HB3 1 23 ARG H . . 4.820 4.553 4.388 4.754 . 0 0 "[ . 1 . 2]" 1
1205 1 23 ARG H 1 23 ARG HG2 . . 3.800 3.098 2.369 3.834 0.034 14 0 "[ . 1 . 2]" 1
1206 1 23 ARG H 1 23 ARG HB2 . . 3.110 2.718 2.592 2.822 . 0 0 "[ . 1 . 2]" 1
1207 1 23 ARG H 1 23 ARG HG3 . . 3.800 2.207 1.948 2.569 . 0 0 "[ . 1 . 2]" 1
1208 1 16 PRO HD3 1 24 LEU H . . 4.040 3.848 3.755 3.975 . 0 0 "[ . 1 . 2]" 1
1209 1 14 PHE HB3 1 24 LEU H . . 3.850 3.804 3.649 3.883 0.033 6 0 "[ . 1 . 2]" 1
1210 1 24 LEU H 1 24 LEU HB3 . . 3.570 3.262 3.231 3.290 . 0 0 "[ . 1 . 2]" 1
1211 1 35 LYS H 1 35 LYS HB2 . . 3.200 2.885 2.856 2.941 . 0 0 "[ . 1 . 2]" 1
1212 1 35 LYS H 1 35 LYS HB3 . . 3.260 2.296 2.277 2.311 . 0 0 "[ . 1 . 2]" 1
1213 1 24 LEU H 1 24 LEU HB2 . . 3.280 2.758 2.692 2.812 . 0 0 "[ . 1 . 2]" 1
1214 1 32 ILE MG 1 35 LYS H . . 4.770 3.844 3.755 4.087 . 0 0 "[ . 1 . 2]" 1
1215 1 25 ALA H 1 28 ASP HB2 . . 4.000 2.411 2.302 2.715 . 0 0 "[ . 1 . 2]" 1
1216 1 25 ALA H 1 28 ASP HB3 . . 4.000 3.431 2.628 3.664 . 0 0 "[ . 1 . 2]" 1
1217 1 24 LEU HB3 1 25 ALA H . . 3.820 3.292 3.244 3.337 . 0 0 "[ . 1 . 2]" 1
1218 1 24 LEU HG 1 25 ALA H . . 4.170 2.747 2.686 2.814 . 0 0 "[ . 1 . 2]" 1
1219 1 24 LEU MD2 1 25 ALA H . . 4.550 4.270 4.224 4.304 . 0 0 "[ . 1 . 2]" 1
1220 1 24 LEU MD1 1 25 ALA H . . 4.550 3.151 3.051 3.260 . 0 0 "[ . 1 . 2]" 1
1221 1 25 ALA H 1 25 ALA MB . . 2.660 2.568 2.541 2.635 . 0 0 "[ . 1 . 2]" 1
1222 1 10 ALA MB 1 25 ALA H . . 3.580 2.864 2.800 2.945 . 0 0 "[ . 1 . 2]" 1
1223 1 13 ASP HB2 1 26 GLU H . . 4.500 3.359 2.174 4.134 . 0 0 "[ . 1 . 2]" 1
1224 1 13 ASP HB3 1 26 GLU H . . 4.500 2.232 2.002 3.412 . 0 0 "[ . 1 . 2]" 1
1225 1 26 GLU H 1 26 GLU HG3 . . 4.630 4.506 4.467 4.565 . 0 0 "[ . 1 . 2]" 1
1226 1 26 GLU H 1 26 GLU HB2 . . 2.850 2.469 2.422 2.558 . 0 0 "[ . 1 . 2]" 1
1227 1 26 GLU H 1 26 GLU HB3 . . 2.870 2.586 2.490 2.637 . 0 0 "[ . 1 . 2]" 1
1228 1 10 ALA MB 1 26 GLU H . . 3.990 3.906 3.854 3.994 0.004 10 0 "[ . 1 . 2]" 1
1229 1 25 ALA MB 1 26 GLU H . . 3.170 2.971 2.866 3.030 . 0 0 "[ . 1 . 2]" 1
1230 1 9 VAL MG2 1 27 GLY H . . 3.510 3.389 3.316 3.466 . 0 0 "[ . 1 . 2]" 1
1231 1 26 GLU HG3 1 27 GLY H . . 4.210 4.176 4.081 4.227 0.017 14 0 "[ . 1 . 2]" 1
1232 1 26 GLU HG2 1 27 GLY H . . 3.610 2.737 2.672 2.781 . 0 0 "[ . 1 . 2]" 1
1233 1 26 GLU HB3 1 27 GLY H . . 4.380 4.276 4.243 4.337 . 0 0 "[ . 1 . 2]" 1
1234 1 10 ALA MB 1 27 GLY H . . 3.110 2.675 2.606 2.724 . 0 0 "[ . 1 . 2]" 1
1235 1 9 VAL MG2 1 28 ASP H . . 4.350 4.103 3.991 4.182 . 0 0 "[ . 1 . 2]" 1
1236 1 25 ALA MB 1 28 ASP H . . 3.950 3.769 3.617 3.875 . 0 0 "[ . 1 . 2]" 1
1237 1 26 GLU HB3 1 28 ASP H . . 5.310 5.237 5.141 5.291 . 0 0 "[ . 1 . 2]" 1
1238 1 26 GLU HB2 1 28 ASP H . . 5.500 5.575 5.541 5.600 0.100 19 0 "[ . 1 . 2]" 1
1239 1 10 ALA MB 1 28 ASP H . . 2.830 2.062 1.954 2.193 . 0 0 "[ . 1 . 2]" 1
1240 1 26 GLU HA 1 28 ASP H . . 3.550 3.437 3.415 3.463 . 0 0 "[ . 1 . 2]" 1
1241 1 28 ASP HB2 1 29 ILE H . . 3.900 3.972 3.915 3.996 0.096 19 0 "[ . 1 . 2]" 1
1242 1 28 ASP HB3 1 29 ILE H . . 3.900 2.924 2.701 3.494 . 0 0 "[ . 1 . 2]" 1
1243 1 29 ILE H 1 29 ILE HB . . 2.820 2.573 2.536 2.696 . 0 0 "[ . 1 . 2]" 1
1244 1 29 ILE H 1 29 ILE HG13 . . 3.530 3.503 2.951 3.642 0.112 15 0 "[ . 1 . 2]" 1
1245 1 29 ILE H 1 29 ILE HG12 . . 3.330 2.774 2.583 3.352 0.022 12 0 "[ . 1 . 2]" 1
1246 1 29 ILE H 1 29 ILE MG . . 3.940 3.821 3.806 3.873 . 0 0 "[ . 1 . 2]" 1
1247 1 30 VAL H 1 30 VAL HB . . 4.180 3.774 3.720 3.807 . 0 0 "[ . 1 . 2]" 1
1248 1 29 ILE HB 1 30 VAL H . . 4.260 4.059 3.911 4.304 0.044 12 0 "[ . 1 . 2]" 1
1249 1 10 ALA MB 1 30 VAL H . . 5.500 5.019 4.642 5.229 . 0 0 "[ . 1 . 2]" 1
1250 1 29 ILE HG13 1 30 VAL H . . 5.500 5.359 5.251 5.579 0.079 10 0 "[ . 1 . 2]" 1
1251 1 29 ILE HG12 1 30 VAL H . . 4.730 4.690 4.436 4.754 0.024 5 0 "[ . 1 . 2]" 1
1252 1 8 ALA MB 1 30 VAL H . . 4.230 3.984 3.789 4.074 . 0 0 "[ . 1 . 2]" 1
1253 1 29 ILE MG 1 30 VAL H . . 2.990 2.412 2.172 2.932 . 0 0 "[ . 1 . 2]" 1
1254 1 30 VAL H 1 30 VAL MG2 . . 2.940 2.167 1.912 2.278 . 0 0 "[ . 1 . 2]" 1
1255 1 31 PHE H 1 31 PHE HB2 . . 3.160 2.584 2.539 2.605 . 0 0 "[ . 1 . 2]" 1
1256 1 31 PHE H 1 44 GLU HB3 . . 4.920 4.813 4.670 4.923 0.003 11 0 "[ . 1 . 2]" 1
1257 1 30 VAL HB 1 31 PHE H . . 2.970 2.506 2.299 2.664 . 0 0 "[ . 1 . 2]" 1
1258 1 31 PHE H 1 43 ALA MB . . 3.850 3.145 3.075 3.200 . 0 0 "[ . 1 . 2]" 1
1259 1 30 VAL MG1 1 31 PHE H . . 3.470 3.384 3.301 3.484 0.014 15 0 "[ . 1 . 2]" 1
1260 1 30 VAL MG2 1 31 PHE H . . 3.820 3.774 3.508 3.836 0.016 15 0 "[ . 1 . 2]" 1
1261 1 31 PHE HB3 1 32 ILE H . . 3.800 3.702 3.655 3.744 . 0 0 "[ . 1 . 2]" 1
1262 1 32 ILE H 1 32 ILE HB . . 3.120 2.700 2.671 2.726 . 0 0 "[ . 1 . 2]" 1
1263 1 30 VAL HB 1 32 ILE H . . 4.820 4.731 4.638 4.845 0.025 8 0 "[ . 1 . 2]" 1
1264 1 6 GLN HB3 1 32 ILE H . . 4.560 4.295 4.227 4.469 . 0 0 "[ . 1 . 2]" 1
1265 1 7 ARG HB2 1 32 ILE H . . 5.440 5.217 5.046 5.335 . 0 0 "[ . 1 . 2]" 1
1266 1 32 ILE H 1 32 ILE HG12 . . 3.300 1.917 1.905 1.936 . 0 0 "[ . 1 . 2]" 1
1267 1 32 ILE H 1 32 ILE HG13 . . 3.900 3.496 3.478 3.512 . 0 0 "[ . 1 . 2]" 1
1268 1 32 ILE H 1 43 ALA MB . . 4.140 3.300 3.195 3.435 . 0 0 "[ . 1 . 2]" 1
1269 1 8 ALA MB 1 32 ILE H . . 3.620 3.381 3.217 3.559 . 0 0 "[ . 1 . 2]" 1
1270 1 32 ILE H 1 32 ILE MD . . 3.540 2.845 2.700 3.039 . 0 0 "[ . 1 . 2]" 1
1271 1 32 ILE MD 1 33 SER H . . 4.360 3.994 3.942 4.023 . 0 0 "[ . 1 . 2]" 1
1272 1 33 SER H 1 42 VAL MG1 . . 4.690 3.882 3.734 4.105 . 0 0 "[ . 1 . 2]" 1
1273 1 32 ILE MG 1 33 SER H . . 3.450 3.218 3.131 3.250 . 0 0 "[ . 1 . 2]" 1
1274 1 33 SER H 1 42 VAL HB . . 4.360 4.189 4.124 4.243 . 0 0 "[ . 1 . 2]" 1
1275 1 33 SER H 1 43 ALA MB . . 4.020 3.351 3.189 3.532 . 0 0 "[ . 1 . 2]" 1
1276 1 32 ILE HG12 1 33 SER H . . 5.300 5.248 5.191 5.286 . 0 0 "[ . 1 . 2]" 1
1277 1 32 ILE HB 1 33 SER H . . 4.710 4.313 4.298 4.329 . 0 0 "[ . 1 . 2]" 1
1278 1 35 LYS H 1 35 LYS HG2 . . 4.280 4.235 4.208 4.260 . 0 0 "[ . 1 . 2]" 1
1279 1 34 TYR HB2 1 35 LYS H . . 3.320 2.824 2.508 2.900 . 0 0 "[ . 1 . 2]" 1
1280 1 34 TYR HB3 1 35 LYS H . . 4.190 4.053 3.829 4.105 . 0 0 "[ . 1 . 2]" 1
1281 1 36 HIS HB2 1 37 GLY H . . 4.260 4.063 4.028 4.092 . 0 0 "[ . 1 . 2]" 1
1282 1 35 LYS HG3 1 37 GLY H . . 5.500 5.513 5.505 5.526 0.026 1 0 "[ . 1 . 2]" 1
1283 1 35 LYS HG2 1 37 GLY H . . 5.140 4.915 4.838 4.999 . 0 0 "[ . 1 . 2]" 1
1284 1 36 HIS HB3 1 37 GLY H . . 3.910 3.545 3.436 3.592 . 0 0 "[ . 1 . 2]" 1
1285 1 38 GLN H 1 38 GLN QG . . 4.540 2.792 2.640 2.956 . 0 0 "[ . 1 . 2]" 1
1286 1 40 TRP HB2 1 41 LEU H . . 4.360 4.160 4.103 4.192 . 0 0 "[ . 1 . 2]" 1
1287 1 40 TRP HB3 1 41 LEU H . . 3.580 3.090 2.990 3.137 . 0 0 "[ . 1 . 2]" 1
1288 1 41 LEU H 1 56 GLU HA . . 5.190 5.177 5.087 5.232 0.042 1 0 "[ . 1 . 2]" 1
1289 1 41 LEU H 1 41 LEU HB2 . . 3.420 2.971 2.906 3.042 . 0 0 "[ . 1 . 2]" 1
1290 1 41 LEU H 1 41 LEU HG . . 3.370 2.425 2.343 2.505 . 0 0 "[ . 1 . 2]" 1
1291 1 41 LEU H 1 41 LEU MD2 . . 3.990 3.005 2.959 3.047 . 0 0 "[ . 1 . 2]" 1
1292 1 41 LEU H 1 41 LEU MD1 . . 4.150 3.963 3.915 4.012 . 0 0 "[ . 1 . 2]" 1
1293 1 36 HIS HB3 1 42 VAL H . . 4.480 4.295 4.160 4.439 . 0 0 "[ . 1 . 2]" 1
1294 1 33 SER HB2 1 42 VAL H . . 5.050 5.047 4.991 5.075 0.025 10 0 "[ . 1 . 2]" 1
1295 1 41 LEU HB2 1 42 VAL H . . 3.950 3.807 3.686 3.864 . 0 0 "[ . 1 . 2]" 1
1296 1 41 LEU HB3 1 42 VAL H . . 3.340 3.289 3.230 3.346 0.006 16 0 "[ . 1 . 2]" 1
1297 1 42 VAL H 1 42 VAL HB . . 3.120 2.556 2.493 2.620 . 0 0 "[ . 1 . 2]" 1
1298 1 42 VAL H 1 43 ALA MB . . 5.120 4.816 4.761 4.868 . 0 0 "[ . 1 . 2]" 1
1299 1 42 VAL H 1 42 VAL MG2 . . 3.200 2.265 2.208 2.379 . 0 0 "[ . 1 . 2]" 1
1300 1 42 VAL H 1 42 VAL MG1 . . 4.080 3.780 3.771 3.793 . 0 0 "[ . 1 . 2]" 1
1301 1 41 LEU MD2 1 42 VAL H . . 4.200 4.098 3.979 4.211 0.011 15 0 "[ . 1 . 2]" 1
1302 1 32 ILE MG 1 42 VAL H . . 3.910 3.752 3.678 3.831 . 0 0 "[ . 1 . 2]" 1
1303 1 42 VAL HB 1 43 ALA H . . 4.500 4.310 4.237 4.374 . 0 0 "[ . 1 . 2]" 1
1304 1 43 ALA H 1 43 ALA MB . . 3.100 2.572 2.541 2.615 . 0 0 "[ . 1 . 2]" 1
1305 1 43 ALA H 1 51 THR MG . . 4.060 3.659 3.389 3.856 . 0 0 "[ . 1 . 2]" 1
1306 1 43 ALA H 1 54 VAL MG1 . . 4.650 2.902 2.722 3.093 . 0 0 "[ . 1 . 2]" 1
1307 1 42 VAL MG2 1 43 ALA H . . 4.400 4.158 4.114 4.215 . 0 0 "[ . 1 . 2]" 1
1308 1 43 ALA H 1 54 VAL MG2 . . 4.650 3.066 2.877 3.259 . 0 0 "[ . 1 . 2]" 1
1309 1 42 VAL MG1 1 43 ALA H . . 3.130 2.932 2.645 3.086 . 0 0 "[ . 1 . 2]" 1
1310 1 32 ILE MG 1 43 ALA H . . 4.870 4.658 4.590 4.746 . 0 0 "[ . 1 . 2]" 1
1311 1 31 PHE HB2 1 44 GLU H . . 3.760 3.084 3.020 3.163 . 0 0 "[ . 1 . 2]" 1
1312 1 44 GLU H 1 44 GLU HG2 . . 4.100 2.379 2.295 2.473 . 0 0 "[ . 1 . 2]" 1
1313 1 44 GLU H 1 44 GLU HG3 . . 4.100 3.907 3.846 3.999 . 0 0 "[ . 1 . 2]" 1
1314 1 44 GLU H 1 44 GLU HB3 . . 3.590 2.940 2.843 3.027 . 0 0 "[ . 1 . 2]" 1
1315 1 30 VAL HB 1 44 GLU H . . 4.020 3.579 3.308 3.701 . 0 0 "[ . 1 . 2]" 1
1316 1 43 ALA MB 1 44 GLU H . . 3.020 2.558 2.441 2.635 . 0 0 "[ . 1 . 2]" 1
1317 1 44 GLU H 1 51 THR MG . . 4.180 3.557 3.345 3.833 . 0 0 "[ . 1 . 2]" 1
1318 1 32 ILE MG 1 44 GLU H . . 5.500 5.542 5.519 5.567 0.067 15 0 "[ . 1 . 2]" 1
1319 1 30 VAL MG1 1 44 GLU H . . 4.550 4.178 4.035 4.464 . 0 0 "[ . 1 . 2]" 1
1320 1 32 ILE MD 1 44 GLU H . . 4.490 4.298 4.207 4.455 . 0 0 "[ . 1 . 2]" 1
1321 1 45 ASN H 1 48 GLY HA2 . . 4.700 4.466 4.156 4.609 . 0 0 "[ . 1 . 2]" 1
1322 1 45 ASN H 1 45 ASN HB2 . . 3.570 3.564 3.539 3.591 0.021 11 0 "[ . 1 . 2]" 1
1323 1 45 ASN H 1 45 ASN HB3 . . 3.290 2.353 2.262 2.572 . 0 0 "[ . 1 . 2]" 1
1324 1 44 GLU HG2 1 45 ASN H . . 4.090 4.011 3.909 4.096 0.006 8 0 "[ . 1 . 2]" 1
1325 1 44 GLU HG3 1 45 ASN H . . 4.090 3.866 3.643 3.982 . 0 0 "[ . 1 . 2]" 1
1326 1 44 GLU HB3 1 45 ASN H . . 4.160 3.951 3.879 4.011 . 0 0 "[ . 1 . 2]" 1
1327 1 44 GLU HB2 1 45 ASN H . . 3.600 2.637 2.542 2.721 . 0 0 "[ . 1 . 2]" 1
1328 1 45 ASN H 1 50 LYS QD . . 4.920 4.259 3.678 4.900 . 0 0 "[ . 1 . 2]" 1
1329 1 45 ASN H 1 50 LYS HB3 . . 4.590 4.190 3.741 4.648 0.058 5 0 "[ . 1 . 2]" 1
1330 1 45 ASN H 1 51 THR MG . . 4.760 4.676 4.560 4.761 0.001 4 0 "[ . 1 . 2]" 1
1331 1 22 LEU MD1 1 45 ASN H . . 4.190 3.287 2.553 3.994 . 0 0 "[ . 1 . 2]" 1
1332 1 30 VAL MG1 1 45 ASN H . . 4.650 4.001 3.788 4.262 . 0 0 "[ . 1 . 2]" 1
1333 1 22 LEU MD2 1 45 ASN H . . 4.190 3.239 2.745 3.865 . 0 0 "[ . 1 . 2]" 1
1334 1 45 ASN HB2 1 46 GLU H . . 2.990 2.205 1.965 2.331 . 0 0 "[ . 1 . 2]" 1
1335 1 45 ASN HB3 1 46 GLU H . . 3.950 3.649 3.496 3.751 . 0 0 "[ . 1 . 2]" 1
1336 1 46 GLU H 1 46 GLU HB2 . . 3.670 2.290 2.124 2.544 . 0 0 "[ . 1 . 2]" 1
1337 1 46 GLU H 1 46 GLU QG . . 4.130 3.797 3.068 4.013 . 0 0 "[ . 1 . 2]" 1
1338 1 46 GLU H 1 46 GLU HB3 . . 3.670 2.871 2.527 3.441 . 0 0 "[ . 1 . 2]" 1
1339 1 29 ILE H 1 30 VAL MG1 . . 5.170 4.206 3.954 4.371 . 0 0 "[ . 1 . 2]" 1
1340 1 30 VAL MG1 1 46 GLU H . . 5.040 3.986 3.452 4.317 . 0 0 "[ . 1 . 2]" 1
1341 1 47 SER H 1 47 SER HB2 . . 3.710 2.394 2.212 2.697 . 0 0 "[ . 1 . 2]" 1
1342 1 47 SER H 1 47 SER HB3 . . 3.710 3.062 2.439 3.595 . 0 0 "[ . 1 . 2]" 1
1343 1 47 SER H 1 48 GLY HA2 . . 5.210 4.960 4.818 5.001 . 0 0 "[ . 1 . 2]" 1
1344 1 45 ASN HB2 1 47 SER H . . 4.460 3.376 2.908 3.521 . 0 0 "[ . 1 . 2]" 1
1345 1 45 ASN HB3 1 47 SER H . . 5.070 4.403 4.371 4.478 . 0 0 "[ . 1 . 2]" 1
1346 1 46 GLU HB2 1 47 SER H . . 3.890 3.594 2.943 3.893 0.003 12 0 "[ . 1 . 2]" 1
1347 1 46 GLU HB3 1 47 SER H . . 3.890 2.767 2.628 3.267 . 0 0 "[ . 1 . 2]" 1
1348 1 45 ASN HB3 1 48 GLY H . . 4.800 4.720 4.560 4.788 . 0 0 "[ . 1 . 2]" 1
1349 1 44 GLU HB2 1 48 GLY H . . 4.650 4.380 4.286 4.542 . 0 0 "[ . 1 . 2]" 1
1350 1 49 SER H 1 49 SER HB2 . . 3.870 2.879 2.342 3.683 . 0 0 "[ . 1 . 2]" 1
1351 1 49 SER H 1 49 SER HB3 . . 3.870 3.055 2.346 3.755 . 0 0 "[ . 1 . 2]" 1
1352 1 49 SER H 1 50 LYS HB3 . . 4.870 4.035 3.913 4.252 . 0 0 "[ . 1 . 2]" 1
1353 1 49 SER H 1 50 LYS HG2 . . 5.500 5.049 4.350 5.552 0.052 6 0 "[ . 1 . 2]" 1
1354 1 49 SER H 1 50 LYS HB2 . . 5.500 5.362 5.124 5.669 0.169 16 0 "[ . 1 . 2]" 1
1355 1 48 GLY HA2 1 50 LYS H . . 4.130 3.910 3.753 4.096 . 0 0 "[ . 1 . 2]" 1
1356 1 45 ASN HB3 1 50 LYS H . . 4.770 4.274 3.866 4.417 . 0 0 "[ . 1 . 2]" 1
1357 1 50 LYS H 1 50 LYS QE . . 5.290 4.619 3.397 5.321 0.031 14 0 "[ . 1 . 2]" 1
1358 1 50 LYS H 1 50 LYS HB2 . . 3.880 3.591 3.387 3.798 . 0 0 "[ . 1 . 2]" 1
1359 1 50 LYS H 1 50 LYS HB3 . . 3.190 2.478 2.284 2.684 . 0 0 "[ . 1 . 2]" 1
1360 1 50 LYS H 1 50 LYS HG2 . . 3.840 3.366 2.802 3.812 . 0 0 "[ . 1 . 2]" 1
1361 1 44 GLU HB3 1 50 LYS H . . 5.470 5.482 5.409 5.540 0.070 10 0 "[ . 1 . 2]" 1
1362 1 44 GLU HB2 1 50 LYS H . . 5.040 3.844 3.779 3.921 . 0 0 "[ . 1 . 2]" 1
1363 1 51 THR H 1 51 THR HB . . 3.110 2.870 2.817 2.942 . 0 0 "[ . 1 . 2]" 1
1364 1 50 LYS HB2 1 51 THR H . . 3.930 3.631 3.272 3.914 . 0 0 "[ . 1 . 2]" 1
1365 1 50 LYS HB3 1 51 THR H . . 4.860 4.423 4.341 4.487 . 0 0 "[ . 1 . 2]" 1
1366 1 50 LYS HG3 1 51 THR H . . 3.930 3.170 2.771 3.525 . 0 0 "[ . 1 . 2]" 1
1367 1 51 THR H 1 51 THR MG . . 4.170 3.949 3.931 3.978 . 0 0 "[ . 1 . 2]" 1
1368 1 51 THR HB 1 52 GLY H . . 4.130 3.799 3.584 4.092 . 0 0 "[ . 1 . 2]" 1
1369 1 43 ALA MB 1 52 GLY H . . 4.730 4.496 4.402 4.584 . 0 0 "[ . 1 . 2]" 1
1370 1 51 THR MG 1 52 GLY H . . 3.390 2.276 1.981 2.697 . 0 0 "[ . 1 . 2]" 1
1371 1 22 LEU MD1 1 52 GLY H . . 4.570 3.191 1.985 4.222 . 0 0 "[ . 1 . 2]" 1
1372 1 22 LEU MD2 1 52 GLY H . . 4.570 3.364 2.393 4.487 . 0 0 "[ . 1 . 2]" 1
1373 1 42 VAL MG1 1 52 GLY H . . 3.920 3.413 3.170 3.682 . 0 0 "[ . 1 . 2]" 1
1374 1 53 LEU H 1 53 LEU MD1 . . 4.180 3.368 3.203 3.598 . 0 0 "[ . 1 . 2]" 1
1375 1 53 LEU H 1 53 LEU MD2 . . 4.180 4.012 3.860 4.225 0.045 16 0 "[ . 1 . 2]" 1
1376 1 22 LEU HB3 1 53 LEU H . . 4.960 3.625 3.153 4.163 . 0 0 "[ . 1 . 2]" 1
1377 1 53 LEU H 1 53 LEU HG . . 3.150 2.742 2.512 3.116 . 0 0 "[ . 1 . 2]" 1
1378 1 53 LEU H 1 53 LEU HB2 . . 3.190 2.511 2.396 2.583 . 0 0 "[ . 1 . 2]" 1
1379 1 22 LEU HB2 1 53 LEU H . . 4.960 3.010 2.535 3.329 . 0 0 "[ . 1 . 2]" 1
1380 1 22 LEU HG 1 53 LEU H . . 5.500 5.383 4.254 5.604 0.104 3 0 "[ . 1 . 2]" 1
1381 1 21 GLU HB3 1 53 LEU H . . 4.630 4.132 3.981 4.357 . 0 0 "[ . 1 . 2]" 1
1382 1 16 PRO HB3 1 53 LEU H . . 5.500 5.487 5.396 5.534 0.034 12 0 "[ . 1 . 2]" 1
1383 1 21 GLU HB2 1 53 LEU H . . 5.500 4.960 4.875 5.122 . 0 0 "[ . 1 . 2]" 1
1384 1 20 ASN HB2 1 53 LEU H . . 5.480 5.209 5.036 5.436 . 0 0 "[ . 1 . 2]" 1
1385 1 53 LEU H 2 3 PHE HB2 . . 5.500 5.434 5.111 5.527 0.027 3 0 "[ . 1 . 2]" 1
1386 1 53 LEU H 2 3 PHE HB3 . . 5.500 4.440 4.103 4.689 . 0 0 "[ . 1 . 2]" 1
1387 1 54 VAL H 1 55 PRO HD3 . . 5.100 4.939 4.911 4.982 . 0 0 "[ . 1 . 2]" 1
1388 1 41 LEU HG 1 54 VAL H . . 5.200 4.906 4.757 5.144 . 0 0 "[ . 1 . 2]" 1
1389 1 54 VAL H 1 54 VAL HB . . 3.960 3.872 3.827 3.904 . 0 0 "[ . 1 . 2]" 1
1390 1 53 LEU HB3 1 54 VAL H . . 3.480 3.120 2.957 3.291 . 0 0 "[ . 1 . 2]" 1
1391 1 43 ALA MB 1 54 VAL H . . 4.340 4.048 3.812 4.227 . 0 0 "[ . 1 . 2]" 1
1392 1 53 LEU HB2 1 54 VAL H . . 4.750 4.085 3.923 4.286 . 0 0 "[ . 1 . 2]" 1
1393 1 54 VAL H 1 54 VAL MG1 . . 3.750 2.892 2.745 2.990 . 0 0 "[ . 1 . 2]" 1
1394 1 32 ILE MG 1 54 VAL H . . 5.500 5.532 5.515 5.554 0.054 4 0 "[ . 1 . 2]" 1
1395 1 42 VAL MG2 1 54 VAL H . . 4.760 4.579 4.515 4.638 . 0 0 "[ . 1 . 2]" 1
1396 1 54 VAL H 1 54 VAL MG2 . . 3.750 2.309 2.238 2.366 . 0 0 "[ . 1 . 2]" 1
1397 1 53 LEU MD1 1 54 VAL H . . 5.500 5.139 5.056 5.234 . 0 0 "[ . 1 . 2]" 1
1398 1 56 GLU HA 1 58 PHE H . . 4.020 3.484 3.467 3.510 . 0 0 "[ . 1 . 2]" 1
1399 1 55 PRO HA 1 58 PHE H . . 4.890 4.758 4.726 4.809 . 0 0 "[ . 1 . 2]" 1
1400 1 58 PHE H 1 58 PHE HB3 . . 3.490 3.468 3.458 3.483 . 0 0 "[ . 1 . 2]" 1
1401 1 58 PHE H 1 58 PHE HB2 . . 3.070 2.438 2.423 2.452 . 0 0 "[ . 1 . 2]" 1
1402 1 57 GLU HB3 1 58 PHE H . . 4.250 3.941 3.874 4.021 . 0 0 "[ . 1 . 2]" 1
1403 1 57 GLU HB2 1 58 PHE H . . 4.230 4.025 3.967 4.092 . 0 0 "[ . 1 . 2]" 1
1404 1 56 GLU HB2 1 58 PHE H . . 5.500 5.350 5.336 5.370 . 0 0 "[ . 1 . 2]" 1
1405 1 56 GLU HB3 1 58 PHE H . . 5.500 4.812 4.782 4.843 . 0 0 "[ . 1 . 2]" 1
1406 1 58 PHE H 1 59 VAL HB . . 5.500 5.448 5.417 5.474 . 0 0 "[ . 1 . 2]" 1
1407 1 55 PRO QB 1 58 PHE H . . 3.290 2.853 2.777 2.914 . 0 0 "[ . 1 . 2]" 1
1408 1 58 PHE H 1 59 VAL MG1 . . 4.240 3.882 3.793 3.944 . 0 0 "[ . 1 . 2]" 1
1409 1 58 PHE H 1 59 VAL MG2 . . 3.870 2.926 2.783 3.115 . 0 0 "[ . 1 . 2]" 1
1410 1 11 LEU MD1 1 58 PHE H . . 4.930 4.456 4.135 4.702 . 0 0 "[ . 1 . 2]" 1
1411 1 55 PRO HG2 1 58 PHE H . . 4.870 3.672 3.601 3.726 . 0 0 "[ . 1 . 2]" 1
1412 1 58 PHE HB3 1 59 VAL H . . 4.380 3.821 3.694 4.004 . 0 0 "[ . 1 . 2]" 1
1413 1 58 PHE HB2 1 59 VAL H . . 4.110 3.626 3.479 3.818 . 0 0 "[ . 1 . 2]" 1
1414 1 57 GLU HB3 1 59 VAL H . . 5.500 5.442 5.323 5.507 0.007 18 0 "[ . 1 . 2]" 1
1415 1 59 VAL H 1 59 VAL HB . . 4.090 3.760 3.733 3.831 . 0 0 "[ . 1 . 2]" 1
1416 1 55 PRO QB 1 59 VAL H . . 4.650 4.419 4.282 4.571 . 0 0 "[ . 1 . 2]" 1
1417 1 11 LEU HG 1 59 VAL H . . 4.930 3.935 3.640 4.107 . 0 0 "[ . 1 . 2]" 1
1418 1 11 LEU HB2 1 59 VAL H . . 5.430 4.862 4.632 5.151 . 0 0 "[ . 1 . 2]" 1
1419 1 11 LEU MD1 1 59 VAL H . . 4.060 3.491 3.084 3.732 . 0 0 "[ . 1 . 2]" 1
1420 1 59 VAL H 1 59 VAL MG2 . . 2.870 1.965 1.915 2.096 . 0 0 "[ . 1 . 2]" 1
1421 1 59 VAL H 1 59 VAL MG1 . . 3.330 3.076 2.963 3.212 . 0 0 "[ . 1 . 2]" 1
1422 1 60 SER H 1 60 SER QB . . 3.030 2.627 2.546 2.694 . 0 0 "[ . 1 . 2]" 1
1423 1 9 VAL HB 1 60 SER H . . 5.030 4.838 4.766 4.924 . 0 0 "[ . 1 . 2]" 1
1424 1 59 VAL HB 1 60 SER H . . 3.060 2.257 2.153 2.437 . 0 0 "[ . 1 . 2]" 1
1425 1 11 LEU HG 1 60 SER H . . 3.770 3.266 3.062 3.502 . 0 0 "[ . 1 . 2]" 1
1426 1 9 VAL MG1 1 60 SER H . . 3.230 2.434 2.294 2.727 . 0 0 "[ . 1 . 2]" 1
1427 1 11 LEU MD2 1 60 SER H . . 3.720 3.083 2.796 3.306 . 0 0 "[ . 1 . 2]" 1
1428 1 59 VAL MG1 1 60 SER H . . 3.720 3.537 3.445 3.600 . 0 0 "[ . 1 . 2]" 1
1429 1 59 VAL MG2 1 60 SER H . . 3.780 3.442 3.317 3.584 . 0 0 "[ . 1 . 2]" 1
1430 1 61 TYR HB3 1 62 ILE H . . 3.730 3.297 3.189 3.463 . 0 0 "[ . 1 . 2]" 1
1431 1 61 TYR HB2 1 62 ILE H . . 4.550 4.355 4.303 4.436 . 0 0 "[ . 1 . 2]" 1
1432 1 6 GLN HG3 1 62 ILE H . . 4.800 3.869 3.731 4.073 . 0 0 "[ . 1 . 2]" 1
1433 1 62 ILE H 1 62 ILE HB . . 3.290 2.626 2.596 2.675 . 0 0 "[ . 1 . 2]" 1
1434 1 7 ARG HG3 1 62 ILE H . . 4.170 3.709 3.413 3.879 . 0 0 "[ . 1 . 2]" 1
1435 1 62 ILE H 1 62 ILE HG12 . . 4.480 3.607 3.353 3.725 . 0 0 "[ . 1 . 2]" 1
1436 1 62 ILE H 1 62 ILE HG13 . . 3.580 2.353 2.121 2.465 . 0 0 "[ . 1 . 2]" 1
1437 1 8 ALA MB 1 62 ILE H . . 4.070 3.458 3.328 3.661 . 0 0 "[ . 1 . 2]" 1
1438 1 62 ILE H 1 62 ILE MG . . 4.440 3.831 3.805 3.851 . 0 0 "[ . 1 . 2]" 1
1439 1 62 ILE H 1 62 ILE MD . . 4.020 3.734 3.637 3.808 . 0 0 "[ . 1 . 2]" 1
1440 1 62 ILE H 1 63 GLN H . . 4.740 4.551 4.525 4.592 . 0 0 "[ . 1 . 2]" 1
1441 1 63 GLN H 1 64 PRO HA . . 5.470 5.225 5.175 5.511 0.041 11 0 "[ . 1 . 2]" 1
1442 1 63 GLN H 1 64 PRO HD2 . . 5.500 4.786 4.781 4.806 . 0 0 "[ . 1 . 2]" 1
1443 1 63 GLN H 1 64 PRO HD3 . . 5.500 5.017 5.010 5.060 . 0 0 "[ . 1 . 2]" 1
1444 1 62 ILE HA 1 63 GLN H . . 2.920 2.262 2.216 2.306 . 0 0 "[ . 1 . 2]" 1
1445 1 63 GLN H 1 63 GLN QG . . 3.800 3.473 1.968 3.823 0.023 3 0 "[ . 1 . 2]" 1
1446 1 63 GLN H 1 63 GLN HB2 . . 3.840 2.775 2.542 3.745 . 0 0 "[ . 1 . 2]" 1
1447 1 63 GLN H 1 63 GLN HB3 . . 3.840 3.425 2.823 3.567 . 0 0 "[ . 1 . 2]" 1
1448 1 62 ILE HB 1 63 GLN H . . 3.860 3.774 3.633 3.877 0.017 4 0 "[ . 1 . 2]" 1
1449 1 7 ARG HG2 1 63 GLN H . . 5.500 5.517 5.504 5.549 0.049 17 0 "[ . 1 . 2]" 1
1450 1 62 ILE MG 1 63 GLN H . . 3.690 2.084 1.911 2.248 . 0 0 "[ . 1 . 2]" 1
1451 1 62 ILE HG12 1 63 GLN H . . 4.960 4.354 4.325 4.426 . 0 0 "[ . 1 . 2]" 1
1452 1 64 PRO QG 1 65 GLU H . . 3.160 1.887 1.720 1.957 . 0 0 "[ . 1 . 2]" 1
1453 1 63 GLN HB2 1 66 LEU H . . 4.950 3.316 2.536 4.241 . 0 0 "[ . 1 . 2]" 1
1454 1 64 PRO QG 1 66 LEU H . . 3.850 3.441 2.805 3.813 . 0 0 "[ . 1 . 2]" 1
1455 1 63 GLN HB3 1 66 LEU H . . 4.950 2.571 1.960 4.754 . 0 0 "[ . 1 . 2]" 1
1456 1 66 LEU H 1 66 LEU HG . . 3.350 2.406 2.037 2.694 . 0 0 "[ . 1 . 2]" 1
1457 1 66 LEU H 1 66 LEU MD1 . . 4.750 3.745 2.635 3.999 . 0 0 "[ . 1 . 2]" 1
1458 1 66 LEU H 1 66 LEU MD2 . . 4.750 3.317 2.879 3.908 . 0 0 "[ . 1 . 2]" 1
1459 1 5 ASN H 1 6 GLN HB2 . . 5.270 4.717 4.576 4.885 . 0 0 "[ . 1 . 2]" 1
1460 1 20 ASN HD22 2 6 SER QB . . 5.100 4.994 4.387 5.135 0.035 4 0 "[ . 1 . 2]" 1
1461 1 52 GLY H 2 3 PHE QE . . 4.720 3.979 3.666 4.727 0.007 14 0 "[ . 1 . 2]" 1
1462 1 52 GLY H 2 3 PHE QD . . 5.090 5.073 4.875 5.116 0.026 4 0 "[ . 1 . 2]" 1
1463 1 14 PHE H 1 14 PHE QD . . 4.740 4.008 3.836 4.232 . 0 0 "[ . 1 . 2]" 1
1464 1 14 PHE H 1 58 PHE QE . . 4.850 4.568 4.449 4.863 0.013 15 0 "[ . 1 . 2]" 1
1465 1 17 GLU HB3 1 18 ASN HD22 . . 4.900 4.084 3.227 4.565 . 0 0 "[ . 1 . 2]" 1
1466 1 39 GLY HA3 1 40 TRP HE1 . . 5.500 5.516 5.450 5.568 0.068 18 0 "[ . 1 . 2]" 1
1467 1 40 TRP HE1 2 5 PRO HA . . 5.500 5.426 5.229 5.527 0.027 4 0 "[ . 1 . 2]" 1
1468 1 58 PHE HA 1 58 PHE QD . . 3.650 2.246 2.195 2.320 . 0 0 "[ . 1 . 2]" 1
1469 1 14 PHE HA 1 58 PHE QD . . 4.290 3.936 3.687 4.173 . 0 0 "[ . 1 . 2]" 1
1470 1 12 TYR QD 1 58 PHE QD . . 3.830 2.808 2.719 2.954 . 0 0 "[ . 1 . 2]" 1
1471 1 58 PHE QE 2 10 PRO HB2 . . 4.360 3.759 3.343 3.953 . 0 0 "[ . 1 . 2]" 1
1472 1 58 PHE QE 2 13 PRO HD3 . . 4.660 3.739 3.570 3.825 . 0 0 "[ . 1 . 2]" 1
1473 1 12 TYR HB2 1 58 PHE QE . . 4.070 2.891 2.821 2.936 . 0 0 "[ . 1 . 2]" 1
1474 1 58 PHE QE 2 10 PRO HG2 . . 4.110 4.075 3.990 4.142 0.032 17 0 "[ . 1 . 2]" 1
1475 1 40 TRP HZ2 2 7 ARG HG3 . . 4.080 2.754 2.549 3.172 . 0 0 "[ . 1 . 2]" 1
1476 1 40 TRP HZ2 2 7 ARG HG2 . . 4.080 3.956 3.412 4.111 0.031 6 0 "[ . 1 . 2]" 1
1477 1 31 PHE QE 1 46 GLU QG . . 3.940 3.705 3.288 3.951 0.011 7 0 "[ . 1 . 2]" 1
1478 1 14 PHE QD 2 10 PRO HG3 . . 3.940 2.331 1.999 2.641 . 0 0 "[ . 1 . 2]" 1
1479 1 40 TRP HZ3 1 53 LEU HB3 . . 4.620 4.531 4.300 4.644 0.024 17 0 "[ . 1 . 2]" 1
1480 1 40 TRP HD1 1 53 LEU MD2 . . 5.500 5.026 4.810 5.255 . 0 0 "[ . 1 . 2]" 1
1481 1 32 ILE MG 1 61 TYR QE . . 3.320 2.983 2.845 3.101 . 0 0 "[ . 1 . 2]" 1
1482 1 41 LEU MD1 1 61 TYR QE . . 3.540 2.710 2.555 2.853 . 0 0 "[ . 1 . 2]" 1
1483 1 32 ILE HG13 1 61 TYR QE . . 3.120 2.333 2.184 2.414 . 0 0 "[ . 1 . 2]" 1
1484 1 3 ILE MG 1 34 TYR QD . . 4.140 3.768 3.061 4.146 0.006 14 0 "[ . 1 . 2]" 1
1485 1 3 ILE MD 1 34 TYR QD . . 4.540 4.297 1.884 4.558 0.018 16 0 "[ . 1 . 2]" 1
1486 1 32 ILE HG12 1 61 TYR QE . . 3.950 3.898 3.776 3.953 0.003 13 0 "[ . 1 . 2]" 1
1487 1 6 GLN HB3 1 61 TYR QE . . 3.520 3.120 2.956 3.299 . 0 0 "[ . 1 . 2]" 1
1488 1 6 GLN HB2 1 61 TYR QE . . 3.830 3.709 3.527 3.828 . 0 0 "[ . 1 . 2]" 1
1489 1 12 TYR QE 2 13 PRO HD3 . . 4.130 4.187 4.160 4.203 0.073 2 0 "[ . 1 . 2]" 1
1490 1 6 GLN HG2 1 61 TYR QE . . 3.010 2.573 2.325 2.800 . 0 0 "[ . 1 . 2]" 1
1491 1 8 ALA MB 1 61 TYR QD . . 2.810 2.701 2.620 2.807 . 0 0 "[ . 1 . 2]" 1
1492 1 32 ILE HG13 1 61 TYR QD . . 4.080 3.794 3.691 3.883 . 0 0 "[ . 1 . 2]" 1
1493 1 59 VAL HB 1 61 TYR QD . . 4.680 4.508 4.336 4.616 . 0 0 "[ . 1 . 2]" 1
1494 1 6 GLN HB3 1 61 TYR QD . . 4.430 4.156 3.949 4.393 . 0 0 "[ . 1 . 2]" 1
1495 1 6 GLN HG2 1 61 TYR QD . . 3.490 2.279 2.137 2.379 . 0 0 "[ . 1 . 2]" 1
1496 1 58 PHE QD 2 10 PRO HG2 . . 4.610 4.089 3.708 4.172 . 0 0 "[ . 1 . 2]" 1
1497 1 36 HIS HD2 1 42 VAL MG2 . . 4.720 4.669 4.512 4.736 0.016 14 0 "[ . 1 . 2]" 1
1498 1 36 HIS HD2 2 5 PRO HG3 . . 4.170 3.283 2.974 3.493 . 0 0 "[ . 1 . 2]" 1
1499 1 36 HIS HD2 2 5 PRO HG2 . . 4.170 3.103 2.845 3.896 . 0 0 "[ . 1 . 2]" 1
1500 1 36 HIS HD2 1 38 GLN QB . . 4.430 4.031 3.928 4.132 . 0 0 "[ . 1 . 2]" 1
1501 1 36 HIS HD2 1 38 GLN QG . . 4.670 3.858 3.605 4.645 . 0 0 "[ . 1 . 2]" 1
1502 1 11 LEU HB2 1 12 TYR QD . . 3.580 2.946 2.750 3.095 . 0 0 "[ . 1 . 2]" 1
1503 1 11 LEU HB3 1 12 TYR QD . . 4.290 3.987 3.923 4.090 . 0 0 "[ . 1 . 2]" 1
1504 1 11 LEU MD1 1 12 TYR QD . . 3.810 3.783 3.712 3.826 0.016 14 0 "[ . 1 . 2]" 1
1505 1 11 LEU HB2 1 12 TYR QE . . 3.460 3.087 2.925 3.232 . 0 0 "[ . 1 . 2]" 1
1506 1 11 LEU HB3 1 12 TYR QE . . 4.050 3.507 3.434 3.612 . 0 0 "[ . 1 . 2]" 1
1507 1 59 VAL MG2 1 61 TYR QE . . 4.610 3.495 3.250 3.735 . 0 0 "[ . 1 . 2]" 1
1508 1 11 LEU MD1 1 12 TYR QE . . 3.080 2.809 2.685 2.970 . 0 0 "[ . 1 . 2]" 1
1509 1 12 TYR QE 1 58 PHE QD . . 4.370 3.877 3.795 3.987 . 0 0 "[ . 1 . 2]" 1
1510 1 33 SER HB3 1 34 TYR QD . . 3.440 2.305 2.038 2.448 . 0 0 "[ . 1 . 2]" 1
1511 1 33 SER HB2 1 34 TYR QD . . 3.920 3.054 2.811 3.141 . 0 0 "[ . 1 . 2]" 1
1512 1 34 TYR QD 1 42 VAL HB . . 4.000 3.333 3.144 3.490 . 0 0 "[ . 1 . 2]" 1
1513 1 34 TYR QD 1 42 VAL MG2 . . 3.780 3.669 3.546 3.715 . 0 0 "[ . 1 . 2]" 1
1514 1 34 TYR QD 1 42 VAL MG1 . . 4.180 3.790 3.545 3.983 . 0 0 "[ . 1 . 2]" 1
1515 1 33 SER HB3 1 34 TYR QE . . 3.940 3.917 3.398 3.975 0.035 15 0 "[ . 1 . 2]" 1
1516 1 34 TYR QE 1 36 HIS HB3 . . 5.150 4.133 4.018 4.476 . 0 0 "[ . 1 . 2]" 1
1517 1 34 TYR QE 1 42 VAL MG2 . . 3.210 2.631 2.545 2.658 . 0 0 "[ . 1 . 2]" 1
1518 1 34 TYR QE 1 42 VAL MG1 . . 3.350 2.747 2.583 2.897 . 0 0 "[ . 1 . 2]" 1
1519 1 36 HIS HB3 1 36 HIS HD2 . . 3.540 2.692 2.690 2.696 . 0 0 "[ . 1 . 2]" 1
1520 1 36 HIS HB2 1 36 HIS HD2 . . 3.910 3.679 3.638 3.732 . 0 0 "[ . 1 . 2]" 1
1521 1 36 HIS HD2 1 40 TRP HD1 . . 5.500 5.213 5.123 5.283 . 0 0 "[ . 1 . 2]" 1
1522 1 38 GLN QB 1 40 TRP HD1 . . 2.980 1.881 1.870 1.894 . 0 0 "[ . 1 . 2]" 1
1523 1 40 TRP HB2 1 40 TRP HD1 . . 3.230 2.595 2.584 2.620 . 0 0 "[ . 1 . 2]" 1
1524 1 40 TRP HA 1 40 TRP HE3 . . 3.570 2.823 2.739 2.979 . 0 0 "[ . 1 . 2]" 1
1525 1 40 TRP HB3 1 40 TRP HE3 . . 4.030 2.709 2.649 2.741 . 0 0 "[ . 1 . 2]" 1
1526 1 40 TRP HE3 1 53 LEU HB3 . . 3.570 2.931 2.696 3.046 . 0 0 "[ . 1 . 2]" 1
1527 1 40 TRP HE3 1 53 LEU HB2 . . 4.390 4.035 3.688 4.361 . 0 0 "[ . 1 . 2]" 1
1528 1 40 TRP HE3 1 53 LEU MD1 . . 5.440 4.652 4.457 4.910 . 0 0 "[ . 1 . 2]" 1
1529 1 40 TRP HE3 1 53 LEU MD2 . . 5.440 4.190 3.889 4.366 . 0 0 "[ . 1 . 2]" 1
1530 1 12 TYR HB2 1 58 PHE QD . . 3.750 2.897 2.817 2.958 . 0 0 "[ . 1 . 2]" 1
1531 1 14 PHE HB3 1 58 PHE QD . . 3.800 2.794 2.619 3.051 . 0 0 "[ . 1 . 2]" 1
1532 1 55 PRO QB 1 58 PHE QD . . 3.740 3.581 3.504 3.661 . 0 0 "[ . 1 . 2]" 1
1533 1 57 GLU HB3 1 58 PHE QD . . 4.050 3.058 2.947 3.142 . 0 0 "[ . 1 . 2]" 1
1534 1 57 GLU HB2 1 58 PHE QD . . 4.590 4.330 4.176 4.451 . 0 0 "[ . 1 . 2]" 1
1535 1 14 PHE HB2 1 58 PHE QD . . 3.300 2.228 2.123 2.384 . 0 0 "[ . 1 . 2]" 1
1536 1 14 PHE HB2 1 58 PHE QE . . 3.810 2.665 2.398 2.824 . 0 0 "[ . 1 . 2]" 1
1537 1 14 PHE HB3 1 58 PHE QE . . 4.400 4.068 3.842 4.293 . 0 0 "[ . 1 . 2]" 1
1538 1 59 VAL MG2 1 61 TYR QD . . 3.770 3.442 3.283 3.614 . 0 0 "[ . 1 . 2]" 1
1539 1 40 TRP HZ2 2 9 ALA MB . . 4.320 3.543 3.363 3.874 . 0 0 "[ . 1 . 2]" 1
1540 1 40 TRP HZ2 2 9 ALA HA . . 3.600 2.389 2.199 2.609 . 0 0 "[ . 1 . 2]" 1
1541 1 40 TRP HZ2 2 10 PRO HD3 . . 4.050 3.197 3.040 3.414 . 0 0 "[ . 1 . 2]" 1
1542 1 12 TYR QE 2 12 PRO HB3 . . 3.740 2.323 2.084 2.512 . 0 0 "[ . 1 . 2]" 1
1543 1 12 TYR QE 2 12 PRO HG3 . . 3.940 3.923 3.781 3.976 0.036 10 0 "[ . 1 . 2]" 1
1544 1 12 TYR QE 2 13 PRO HG3 . . 4.610 3.639 3.462 3.798 . 0 0 "[ . 1 . 2]" 1
1545 1 12 TYR QE 2 13 PRO HD2 . . 4.130 3.235 3.059 3.295 . 0 0 "[ . 1 . 2]" 1
1546 1 12 TYR QE 2 12 PRO HD3 . . 4.940 4.823 4.674 4.957 0.017 8 0 "[ . 1 . 2]" 1
1547 1 41 LEU HB3 1 61 TYR QE . . 5.330 4.893 4.784 5.054 . 0 0 "[ . 1 . 2]" 1
1548 1 11 LEU HA 1 12 TYR QE . . 5.090 5.001 4.949 5.091 0.001 3 0 "[ . 1 . 2]" 1
1549 1 12 TYR QE 2 12 PRO HA . . 4.300 3.985 3.724 4.176 . 0 0 "[ . 1 . 2]" 1
1550 1 12 TYR QE 1 57 GLU HA . . 5.500 5.539 5.524 5.551 0.051 5 0 "[ . 1 . 2]" 1
1551 1 12 TYR QE 2 13 PRO HG2 . . 3.760 3.400 3.066 3.553 . 0 0 "[ . 1 . 2]" 1
1552 1 56 GLU HA 1 61 TYR QE . . 5.410 4.932 4.688 5.165 . 0 0 "[ . 1 . 2]" 1
1553 1 61 TYR HA 1 61 TYR QE . . 4.530 4.345 4.315 4.371 . 0 0 "[ . 1 . 2]" 1
1554 1 34 TYR QE 1 42 VAL HB . . 3.960 3.061 2.835 3.244 . 0 0 "[ . 1 . 2]" 1
1555 1 33 SER HB2 1 34 TYR QE . . 4.120 4.044 3.539 4.137 0.017 18 0 "[ . 1 . 2]" 1
1556 1 34 TYR QE 1 36 HIS HB2 . . 3.680 2.513 2.382 2.850 . 0 0 "[ . 1 . 2]" 1
1557 1 36 HIS HA 1 36 HIS HD2 . . 4.940 4.509 4.423 4.564 . 0 0 "[ . 1 . 2]" 1
1558 1 40 TRP HE3 1 54 VAL HA . . 4.560 3.493 3.393 3.579 . 0 0 "[ . 1 . 2]" 1
1559 1 40 TRP HE3 1 55 PRO HA . . 4.160 3.315 3.106 3.569 . 0 0 "[ . 1 . 2]" 1
1560 1 40 TRP HH2 2 9 ALA MB . . 4.770 4.034 3.720 4.558 . 0 0 "[ . 1 . 2]" 1
1561 1 40 TRP HH2 1 54 VAL HA . . 5.500 5.391 5.264 5.474 . 0 0 "[ . 1 . 2]" 1
1562 1 40 TRP HH2 2 9 ALA HA . . 4.370 3.535 3.376 3.737 . 0 0 "[ . 1 . 2]" 1
1563 1 40 TRP HH2 2 10 PRO HD3 . . 4.200 2.813 2.661 2.949 . 0 0 "[ . 1 . 2]" 1
1564 1 40 TRP HH2 1 55 PRO HD3 . . 4.560 4.144 3.991 4.289 . 0 0 "[ . 1 . 2]" 1
1565 1 40 TRP HH2 2 10 PRO HG3 . . 4.900 3.882 3.685 4.088 . 0 0 "[ . 1 . 2]" 1
1566 1 21 GLU HB3 1 40 TRP HH2 . . 5.500 5.319 5.033 5.509 0.009 3 0 "[ . 1 . 2]" 1
1567 1 40 TRP HH2 2 10 PRO HB3 . . 5.500 5.428 5.205 5.519 0.019 14 0 "[ . 1 . 2]" 1
1568 1 40 TRP HA 1 40 TRP HD1 . . 4.370 4.276 4.194 4.325 . 0 0 "[ . 1 . 2]" 1
1569 1 40 TRP HD1 2 5 PRO HB2 . . 3.940 2.684 2.554 2.892 . 0 0 "[ . 1 . 2]" 1
1570 1 40 TRP HD1 2 5 PRO HB3 . . 3.940 3.794 3.286 3.966 0.026 11 0 "[ . 1 . 2]" 1
1571 1 40 TRP HD1 2 5 PRO HG3 . . 3.540 3.291 2.386 3.576 0.036 18 0 "[ . 1 . 2]" 1
1572 1 40 TRP HD1 1 53 LEU MD1 . . 5.500 5.318 5.187 5.508 0.008 16 0 "[ . 1 . 2]" 1
1573 1 40 TRP HD1 2 9 ALA MB . . 4.270 4.289 4.268 4.304 0.034 20 0 "[ . 1 . 2]" 1
1574 1 40 TRP HD1 2 5 PRO HG2 . . 3.540 3.131 2.861 3.304 . 0 0 "[ . 1 . 2]" 1
1575 1 14 PHE QE 2 10 PRO HG3 . . 4.050 2.557 2.227 2.904 . 0 0 "[ . 1 . 2]" 1
1576 1 14 PHE QE 1 55 PRO HD3 . . 4.620 2.904 2.554 3.109 . 0 0 "[ . 1 . 2]" 1
1577 1 40 TRP HZ3 1 54 VAL HA . . 3.740 3.032 2.905 3.117 . 0 0 "[ . 1 . 2]" 1
1578 1 40 TRP HZ3 1 53 LEU HB2 . . 5.090 4.777 4.371 5.095 0.005 12 0 "[ . 1 . 2]" 1
1579 1 14 PHE QE 1 40 TRP HZ3 . . 3.970 2.903 2.572 3.111 . 0 0 "[ . 1 . 2]" 1
1580 1 40 TRP HZ3 1 55 PRO HD3 . . 3.900 2.371 2.215 2.580 . 0 0 "[ . 1 . 2]" 1
1581 1 40 TRP HZ3 1 55 PRO HD2 . . 4.120 3.971 3.813 4.140 0.020 11 0 "[ . 1 . 2]" 1
1582 1 40 TRP HZ3 1 55 PRO HG3 . . 4.630 4.102 3.910 4.417 . 0 0 "[ . 1 . 2]" 1
1583 1 14 PHE QE 1 40 TRP HH2 . . 3.420 2.758 2.257 3.050 . 0 0 "[ . 1 . 2]" 1
1584 1 34 TYR HA 1 34 TYR QD . . 3.750 3.724 3.719 3.742 . 0 0 "[ . 1 . 2]" 1
1585 1 34 TYR QD 1 36 HIS HA . . 3.910 3.834 3.762 3.931 0.021 12 0 "[ . 1 . 2]" 1
1586 1 33 SER HA 1 34 TYR QD . . 5.000 4.411 4.043 4.465 . 0 0 "[ . 1 . 2]" 1
1587 1 3 ILE HA 1 34 TYR QD . . 4.360 4.056 3.613 4.183 . 0 0 "[ . 1 . 2]" 1
1588 1 12 TYR QD 2 13 PRO HG2 . . 4.340 4.220 4.058 4.336 . 0 0 "[ . 1 . 2]" 1
1589 1 12 TYR QD 2 12 PRO HG3 . . 5.340 5.353 5.126 5.383 0.043 6 0 "[ . 1 . 2]" 1
1590 1 12 TYR QD 2 13 PRO HG3 . . 4.130 3.407 3.235 3.561 . 0 0 "[ . 1 . 2]" 1
1591 1 12 TYR QD 1 26 GLU HG3 . . 4.400 3.928 3.723 4.105 . 0 0 "[ . 1 . 2]" 1
1592 1 12 TYR QD 1 58 PHE HB3 . . 4.070 3.713 3.547 3.873 . 0 0 "[ . 1 . 2]" 1
1593 1 12 TYR QD 1 58 PHE QE . . 4.360 3.486 3.369 3.621 . 0 0 "[ . 1 . 2]" 1
1594 1 31 PHE HZ 1 46 GLU HA . . 4.560 4.368 3.755 4.568 0.008 15 0 "[ . 1 . 2]" 1
1595 1 7 ARG QD 1 31 PHE HZ . . 5.000 4.973 4.877 5.009 0.009 7 0 "[ . 1 . 2]" 1
1596 1 31 PHE HZ 1 46 GLU QG . . 4.400 3.986 3.274 4.323 . 0 0 "[ . 1 . 2]" 1
1597 1 29 ILE MG 1 31 PHE HZ . . 4.260 3.659 3.305 4.058 . 0 0 "[ . 1 . 2]" 1
1598 1 58 PHE HZ 2 13 PRO HD2 . . 4.910 4.992 4.961 5.009 0.099 20 0 "[ . 1 . 2]" 1
1599 1 58 PHE HZ 2 12 PRO HA . . 3.700 3.313 3.167 3.526 . 0 0 "[ . 1 . 2]" 1
1600 1 12 TYR HB2 1 58 PHE HZ . . 4.480 3.650 3.550 3.764 . 0 0 "[ . 1 . 2]" 1
1601 1 58 PHE HZ 2 10 PRO HB2 . . 4.520 3.757 3.363 3.937 . 0 0 "[ . 1 . 2]" 1
1602 1 58 PHE HZ 2 13 PRO HD3 . . 4.910 3.694 3.636 3.793 . 0 0 "[ . 1 . 2]" 1
1603 1 58 PHE HZ 2 10 PRO HG2 . . 4.730 4.644 4.469 4.760 0.030 11 0 "[ . 1 . 2]" 1
1604 1 58 PHE QE 2 12 PRO HD3 . . 4.080 3.322 3.181 3.540 . 0 0 "[ . 1 . 2]" 1
1605 1 58 PHE QE 2 12 PRO HA . . 3.690 1.971 1.955 1.992 . 0 0 "[ . 1 . 2]" 1
1606 1 58 PHE QE 2 11 LYS HA . . 4.010 3.551 3.465 3.633 . 0 0 "[ . 1 . 2]" 1
1607 1 58 PHE HA 1 58 PHE QE . . 4.400 4.177 4.161 4.205 . 0 0 "[ . 1 . 2]" 1
1608 1 14 PHE HA 1 58 PHE QE . . 3.780 3.178 2.988 3.386 . 0 0 "[ . 1 . 2]" 1
1609 1 14 PHE QD 1 15 GLU HA . . 4.330 4.140 4.010 4.319 . 0 0 "[ . 1 . 2]" 1
1610 1 31 PHE QE 1 46 GLU HA . . 3.620 2.932 2.422 3.163 . 0 0 "[ . 1 . 2]" 1
1611 1 7 ARG HB3 1 31 PHE QE . . 4.170 2.403 2.239 2.531 . 0 0 "[ . 1 . 2]" 1
1612 1 7 ARG HG2 1 31 PHE QE . . 4.910 4.870 4.768 4.930 0.020 15 0 "[ . 1 . 2]" 1
1613 1 14 PHE QD 1 40 TRP HZ3 . . 4.410 4.203 4.037 4.367 . 0 0 "[ . 1 . 2]" 1
1614 1 60 SER HA 1 61 TYR QD . . 3.900 3.766 3.651 3.885 . 0 0 "[ . 1 . 2]" 1
1615 1 61 TYR HA 1 61 TYR QD . . 2.920 2.546 2.489 2.622 . 0 0 "[ . 1 . 2]" 1
1616 1 29 ILE MG 1 31 PHE QE . . 4.420 3.480 3.350 3.602 . 0 0 "[ . 1 . 2]" 1
1617 1 40 TRP HZ2 2 10 PRO HD2 . . 4.610 3.888 3.729 4.296 . 0 0 "[ . 1 . 2]" 1
1618 1 39 GLY HA3 1 40 TRP HD1 . . 4.790 4.691 4.526 4.770 . 0 0 "[ . 1 . 2]" 1
1619 1 58 PHE QD 2 12 PRO HA . . 4.330 3.725 3.558 3.888 . 0 0 "[ . 1 . 2]" 1
1620 1 14 PHE QD 1 16 PRO HA . . 4.790 4.618 4.544 4.740 . 0 0 "[ . 1 . 2]" 1
1621 1 14 PHE QD 1 54 VAL HA . . 4.430 3.852 3.718 3.978 . 0 0 "[ . 1 . 2]" 1
1622 1 14 PHE QE 1 16 PRO HB3 . . 4.050 3.672 3.396 3.867 . 0 0 "[ . 1 . 2]" 1
1623 1 14 PHE QE 2 10 PRO HB3 . . 4.650 3.904 3.334 4.377 . 0 0 "[ . 1 . 2]" 1
1624 1 14 PHE QE 1 21 GLU HB3 . . 3.800 3.206 2.993 3.439 . 0 0 "[ . 1 . 2]" 1
1625 1 14 PHE QE 1 16 PRO HA . . 4.080 2.972 2.802 3.227 . 0 0 "[ . 1 . 2]" 1
1626 1 14 PHE QE 1 54 VAL HA . . 4.280 3.410 3.193 3.666 . 0 0 "[ . 1 . 2]" 1
1627 1 31 PHE HA 1 31 PHE QD . . 3.330 2.371 2.202 2.554 . 0 0 "[ . 1 . 2]" 1
1628 1 7 ARG HA 1 31 PHE QD . . 3.770 2.162 2.017 2.296 . 0 0 "[ . 1 . 2]" 1
1629 1 8 ALA HA 1 61 TYR QD . . 4.460 4.420 4.300 4.464 0.004 1 0 "[ . 1 . 2]" 1
1630 1 31 PHE QD 1 46 GLU HA . . 4.190 3.948 3.578 4.196 0.006 9 0 "[ . 1 . 2]" 1
1631 1 31 PHE QD 1 44 GLU HB3 . . 5.500 4.929 4.702 5.187 . 0 0 "[ . 1 . 2]" 1
1632 1 31 PHE QD 1 46 GLU QG . . 5.500 5.183 4.868 5.510 0.010 8 0 "[ . 1 . 2]" 1
1633 1 31 PHE QD 1 44 GLU HB2 . . 4.970 4.633 4.427 4.936 . 0 0 "[ . 1 . 2]" 1
1634 1 7 ARG HB3 1 31 PHE QD . . 4.300 2.322 2.252 2.424 . 0 0 "[ . 1 . 2]" 1
1635 1 14 PHE QD 1 55 PRO HG2 . . 4.690 4.187 3.924 4.375 . 0 0 "[ . 1 . 2]" 1
1636 1 12 TYR QD 1 58 PHE HA . . 3.000 2.099 2.055 2.152 . 0 0 "[ . 1 . 2]" 1
1637 1 12 TYR QE 1 58 PHE HA . . 3.460 3.128 2.968 3.259 . 0 0 "[ . 1 . 2]" 1
1638 1 40 TRP HH2 2 10 PRO HG2 . . 5.500 4.797 4.575 5.251 . 0 0 "[ . 1 . 2]" 1
1639 1 58 PHE QD 2 12 PRO HB3 . . 4.420 3.464 3.017 3.704 . 0 0 "[ . 1 . 2]" 1
1640 1 58 PHE QE 2 12 PRO HB2 . . 4.490 4.338 4.277 4.444 . 0 0 "[ . 1 . 2]" 1
1641 1 58 PHE QE 2 12 PRO HB3 . . 4.670 3.246 3.130 3.423 . 0 0 "[ . 1 . 2]" 1
1642 1 58 PHE QE 2 13 PRO HD2 . . 4.660 4.213 4.144 4.271 . 0 0 "[ . 1 . 2]" 1
1643 1 58 PHE QE 2 12 PRO HG2 . . 5.340 4.934 4.852 5.072 . 0 0 "[ . 1 . 2]" 1
1644 1 36 HIS HD2 2 5 PRO HD2 . . 4.550 2.751 2.381 3.241 . 0 0 "[ . 1 . 2]" 1
1645 1 36 HIS HD2 2 5 PRO HD3 . . 4.550 3.711 3.195 4.166 . 0 0 "[ . 1 . 2]" 1
1646 1 51 THR MG 2 3 PHE QE . . 3.480 2.259 1.974 3.276 . 0 0 "[ . 1 . 2]" 1
1647 1 51 THR MG 2 3 PHE QD . . 4.010 3.913 3.587 4.037 0.027 11 0 "[ . 1 . 2]" 1
1648 1 42 VAL MG1 2 3 PHE QE . . 3.930 2.388 1.959 3.654 . 0 0 "[ . 1 . 2]" 1
1649 1 42 VAL MG1 2 3 PHE QD . . 3.580 2.116 1.945 2.630 . 0 0 "[ . 1 . 2]" 1
1650 1 42 VAL MG2 2 3 PHE QD . . 3.640 2.444 2.020 3.351 . 0 0 "[ . 1 . 2]" 1
1651 1 42 VAL MG2 2 3 PHE QE . . 5.040 4.042 3.625 5.060 0.020 14 0 "[ . 1 . 2]" 1
1652 1 42 VAL MG2 2 3 PHE HB2 . . 3.550 2.962 2.686 3.199 . 0 0 "[ . 1 . 2]" 1
1653 1 42 VAL MG2 2 3 PHE HB3 . . 4.300 4.008 3.764 4.309 0.009 7 0 "[ . 1 . 2]" 1
1654 1 53 LEU MD2 2 3 PHE HB3 . . 4.160 2.715 2.256 3.598 . 0 0 "[ . 1 . 2]" 1
1655 1 53 LEU MD2 2 3 PHE HA . . 4.950 4.496 4.189 4.959 0.009 12 0 "[ . 1 . 2]" 1
1656 1 53 LEU MD2 2 3 PHE QD . . 4.220 3.277 2.766 4.222 0.002 14 0 "[ . 1 . 2]" 1
1657 1 53 LEU MD2 2 4 ILE MG . . 5.430 5.187 4.825 5.430 . 0 0 "[ . 1 . 2]" 1
1658 1 53 LEU MD2 2 3 PHE HB2 . . 4.060 2.342 1.974 3.093 . 0 0 "[ . 1 . 2]" 1
1659 1 53 LEU MD2 2 5 PRO HG2 . . 4.580 3.752 3.522 4.590 0.010 14 0 "[ . 1 . 2]" 1
1660 1 53 LEU MD1 2 3 PHE HB3 . . 4.160 1.954 1.924 2.054 . 0 0 "[ . 1 . 2]" 1
1661 1 53 LEU MD1 2 3 PHE HA . . 4.950 3.386 3.162 3.649 . 0 0 "[ . 1 . 2]" 1
1662 1 53 LEU MD1 2 3 PHE QD . . 4.220 3.733 3.640 3.816 . 0 0 "[ . 1 . 2]" 1
1663 1 53 LEU MD1 2 5 PRO HB2 . . 5.120 3.731 3.551 4.412 . 0 0 "[ . 1 . 2]" 1
1664 1 53 LEU MD1 2 5 PRO HG3 . . 4.580 3.028 2.760 3.787 . 0 0 "[ . 1 . 2]" 1
1665 1 53 LEU MD1 2 5 PRO HG2 . . 4.580 4.013 3.849 4.598 0.018 14 0 "[ . 1 . 2]" 1
1666 1 53 LEU MD1 2 5 PRO HD2 . . 4.710 3.444 3.353 3.773 . 0 0 "[ . 1 . 2]" 1
1667 1 53 LEU HG 2 3 PHE HB3 . . 4.110 2.276 1.999 2.659 . 0 0 "[ . 1 . 2]" 1
1668 1 53 LEU HG 2 3 PHE QD . . 4.150 3.340 3.027 3.592 . 0 0 "[ . 1 . 2]" 1
1669 1 53 LEU HG 2 3 PHE HB2 . . 4.180 2.996 2.635 3.216 . 0 0 "[ . 1 . 2]" 1
1670 1 55 PRO QB 2 9 ALA MB . . 3.690 3.031 2.857 3.264 . 0 0 "[ . 1 . 2]" 1
1671 1 55 PRO QB 2 10 PRO HD2 . . 4.430 2.599 2.225 2.681 . 0 0 "[ . 1 . 2]" 1
1672 1 55 PRO HA 2 9 ALA MB . . 3.840 3.297 3.143 3.547 . 0 0 "[ . 1 . 2]" 1
1673 1 20 ASN HB3 2 3 PHE QD . . 3.720 3.172 2.463 3.487 . 0 0 "[ . 1 . 2]" 1
1674 1 20 ASN HB3 2 3 PHE QE . . 4.870 4.732 4.193 4.883 0.013 11 0 "[ . 1 . 2]" 1
1675 1 20 ASN HB2 2 3 PHE QD . . 3.850 2.589 2.234 2.811 . 0 0 "[ . 1 . 2]" 1
1676 1 20 ASN HB2 2 3 PHE QE . . 4.590 4.571 4.391 4.611 0.021 3 0 "[ . 1 . 2]" 1
1677 1 20 ASN HB3 2 3 PHE HA . . 4.340 3.429 2.742 3.914 . 0 0 "[ . 1 . 2]" 1
1678 1 20 ASN HB2 2 3 PHE HA . . 4.270 2.613 2.120 3.013 . 0 0 "[ . 1 . 2]" 1
1679 1 20 ASN HB2 2 3 PHE HB2 . . 4.830 4.493 4.177 4.824 . 0 0 "[ . 1 . 2]" 1
1680 1 52 GLY QA 2 3 PHE QE . . 3.660 2.920 2.775 3.119 . 0 0 "[ . 1 . 2]" 1
1681 1 52 GLY QA 2 3 PHE QD . . 3.760 3.315 2.867 3.505 . 0 0 "[ . 1 . 2]" 1
1682 1 39 GLY HA3 2 9 ALA MB . . 3.680 3.134 2.998 3.207 . 0 0 "[ . 1 . 2]" 1
1683 1 3 ILE H 1 3 ILE QG . . 4.040 2.873 2.050 3.575 . 0 0 "[ . 1 . 2]" 1
1684 1 3 ILE HA 1 3 ILE QG . . 3.680 2.417 2.264 3.031 . 0 0 "[ . 1 . 2]" 1
1685 1 3 ILE QG 1 3 ILE MG . . 3.230 2.183 1.964 2.288 . 0 0 "[ . 1 . 2]" 1
1686 1 3 ILE MG 1 5 ASN QB . . 4.670 3.741 2.599 4.694 0.024 13 0 "[ . 1 . 2]" 1
1687 1 3 ILE QG 1 4 VAL H . . 4.720 4.161 4.019 4.741 0.021 12 0 "[ . 1 . 2]" 1
1688 1 3 ILE QG 1 34 TYR QE . . 4.690 4.669 4.392 4.730 0.040 12 0 "[ . 1 . 2]" 1
1689 1 4 VAL H 1 4 VAL QG . . 3.580 2.238 1.922 2.737 . 0 0 "[ . 1 . 2]" 1
1690 1 4 VAL QG 1 5 ASN H . . 4.370 2.539 2.031 3.388 . 0 0 "[ . 1 . 2]" 1
1691 1 4 VAL QG 1 5 ASN QB . . 5.280 3.897 3.655 4.142 . 0 0 "[ . 1 . 2]" 1
1692 1 4 VAL QG 1 6 GLN H . . 3.420 2.558 1.912 3.406 . 0 0 "[ . 1 . 2]" 1
1693 1 4 VAL QG 1 6 GLN HA . . 4.930 3.655 3.418 3.890 . 0 0 "[ . 1 . 2]" 1
1694 1 4 VAL QG 1 6 GLN HB2 . . 4.350 2.077 1.924 2.340 . 0 0 "[ . 1 . 2]" 1
1695 1 4 VAL QG 1 6 GLN HB3 . . 4.070 2.855 2.423 3.447 . 0 0 "[ . 1 . 2]" 1
1696 1 4 VAL QG 1 6 GLN HG2 . . 5.030 3.732 3.456 4.006 . 0 0 "[ . 1 . 2]" 1
1697 1 4 VAL QG 1 6 GLN HG3 . . 4.940 4.432 4.141 4.721 . 0 0 "[ . 1 . 2]" 1
1698 1 4 VAL QG 1 34 TYR HA . . 4.580 3.120 2.323 3.737 . 0 0 "[ . 1 . 2]" 1
1699 1 4 VAL QG 1 34 TYR HB2 . . 5.440 4.280 3.789 4.724 . 0 0 "[ . 1 . 2]" 1
1700 1 4 VAL QG 1 35 LYS H . . 4.590 4.114 3.410 4.514 . 0 0 "[ . 1 . 2]" 1
1701 1 5 ASN H 1 5 ASN QB . . 3.460 2.928 2.283 3.417 . 0 0 "[ . 1 . 2]" 1
1702 1 5 ASN QB 1 5 ASN HD21 . . 3.030 2.440 2.207 2.627 . 0 0 "[ . 1 . 2]" 1
1703 1 5 ASN QB 1 5 ASN HD22 . . 3.470 3.368 3.289 3.429 . 0 0 "[ . 1 . 2]" 1
1704 1 5 ASN QB 1 6 GLN H . . 4.150 3.923 3.895 3.984 . 0 0 "[ . 1 . 2]" 1
1705 1 6 GLN HE22 1 64 PRO QD . . 4.900 3.649 2.900 4.558 . 0 0 "[ . 1 . 2]" 1
1706 1 10 ALA H 1 28 ASP QB . . 4.210 4.006 3.749 4.126 . 0 0 "[ . 1 . 2]" 1
1707 1 10 ALA HA 1 24 LEU QD . . 4.010 3.095 2.967 3.217 . 0 0 "[ . 1 . 2]" 1
1708 1 10 ALA MB 1 24 LEU QD . . 2.890 2.565 2.471 2.630 . 0 0 "[ . 1 . 2]" 1
1709 1 10 ALA MB 1 28 ASP QB . . 3.340 2.261 2.107 2.358 . 0 0 "[ . 1 . 2]" 1
1710 1 11 LEU H 1 24 LEU QD . . 4.960 4.102 3.798 4.205 . 0 0 "[ . 1 . 2]" 1
1711 1 11 LEU HG 1 24 LEU QD . . 5.440 5.263 5.037 5.336 . 0 0 "[ . 1 . 2]" 1
1712 1 12 TYR H 1 24 LEU QD . . 4.610 4.235 4.055 4.334 . 0 0 "[ . 1 . 2]" 1
1713 1 12 TYR HB2 2 13 PRO QD . . 4.740 3.959 3.760 4.075 . 0 0 "[ . 1 . 2]" 1
1714 1 12 TYR HB3 2 13 PRO QD . . 5.040 3.573 3.259 3.807 . 0 0 "[ . 1 . 2]" 1
1715 1 12 TYR QD 2 13 PRO QD . . 4.500 3.273 3.178 3.346 . 0 0 "[ . 1 . 2]" 1
1716 1 13 ASP H 1 13 ASP QB . . 2.780 2.428 2.182 2.734 . 0 0 "[ . 1 . 2]" 1
1717 1 13 ASP QB 1 14 PHE H . . 3.300 3.059 2.911 3.451 0.151 15 0 "[ . 1 . 2]" 1
1718 1 13 ASP QB 1 25 ALA HA . . 4.070 2.101 1.977 2.428 . 0 0 "[ . 1 . 2]" 1
1719 1 13 ASP QB 1 25 ALA MB . . 4.700 2.961 2.884 3.196 . 0 0 "[ . 1 . 2]" 1
1720 1 13 ASP QB 1 26 GLU H . . 3.810 2.144 1.993 3.259 . 0 0 "[ . 1 . 2]" 1
1721 1 14 PHE H 1 24 LEU QD . . 4.360 4.092 3.959 4.258 . 0 0 "[ . 1 . 2]" 1
1722 1 14 PHE HB2 1 24 LEU QD . . 4.470 4.209 3.975 4.415 . 0 0 "[ . 1 . 2]" 1
1723 1 14 PHE HB3 1 24 LEU QD . . 3.810 3.084 2.951 3.255 . 0 0 "[ . 1 . 2]" 1
1724 1 14 PHE QD 1 24 LEU QD . . 4.790 3.325 3.184 3.404 . 0 0 "[ . 1 . 2]" 1
1725 1 14 PHE QD 1 54 VAL QG . . 4.220 4.174 3.926 4.246 0.026 10 0 "[ . 1 . 2]" 1
1726 1 14 PHE QE 1 54 VAL QG . . 5.050 4.265 3.905 4.502 . 0 0 "[ . 1 . 2]" 1
1727 1 15 GLU HA 1 23 ARG QG . . 4.400 3.698 3.288 4.165 . 0 0 "[ . 1 . 2]" 1
1728 1 15 GLU QG 1 16 PRO HA . . 5.340 4.607 4.122 5.278 . 0 0 "[ . 1 . 2]" 1
1729 1 15 GLU QG 1 16 PRO HG2 . . 3.680 3.355 3.117 3.793 0.113 15 0 "[ . 1 . 2]" 1
1730 1 15 GLU QG 1 16 PRO HG3 . . 4.510 4.218 4.119 4.458 . 0 0 "[ . 1 . 2]" 1
1731 1 15 GLU QG 1 16 PRO HD2 . . 4.120 1.959 1.912 2.025 . 0 0 "[ . 1 . 2]" 1
1732 1 15 GLU QG 1 16 PRO HD3 . . 4.560 3.314 3.201 3.470 . 0 0 "[ . 1 . 2]" 1
1733 1 16 PRO HG2 1 23 ARG QG . . 3.990 3.121 2.962 3.344 . 0 0 "[ . 1 . 2]" 1
1734 1 16 PRO HG3 1 23 ARG QG . . 3.210 1.949 1.908 1.981 . 0 0 "[ . 1 . 2]" 1
1735 1 16 PRO HG3 1 23 ARG QD . . 3.980 3.482 2.886 3.988 0.008 3 0 "[ . 1 . 2]" 1
1736 1 16 PRO HD2 1 23 ARG QG . . 3.980 2.596 2.184 3.088 . 0 0 "[ . 1 . 2]" 1
1737 1 16 PRO HD3 1 23 ARG QG . . 3.940 2.184 2.044 2.411 . 0 0 "[ . 1 . 2]" 1
1738 1 16 PRO HD3 1 23 ARG QD . . 4.480 3.677 2.614 4.241 . 0 0 "[ . 1 . 2]" 1
1739 1 17 GLU H 1 17 GLU QB . . 2.950 2.301 2.205 2.427 . 0 0 "[ . 1 . 2]" 1
1740 1 17 GLU H 1 17 GLU QG . . 3.990 3.552 3.202 4.033 0.043 11 0 "[ . 1 . 2]" 1
1741 1 17 GLU H 1 21 GLU QG . . 5.340 3.419 2.861 3.703 . 0 0 "[ . 1 . 2]" 1
1742 1 17 GLU HA 1 17 GLU QG . . 3.260 2.422 2.111 3.058 . 0 0 "[ . 1 . 2]" 1
1743 1 17 GLU QB 1 18 ASN H . . 3.450 3.101 2.991 3.276 . 0 0 "[ . 1 . 2]" 1
1744 1 17 GLU QB 1 18 ASN HD21 . . 3.760 3.485 2.601 3.777 0.017 4 0 "[ . 1 . 2]" 1
1745 1 17 GLU QB 1 18 ASN HD22 . . 4.100 3.821 3.186 4.114 0.014 15 0 "[ . 1 . 2]" 1
1746 1 18 ASN H 1 21 GLU QG . . 3.160 2.789 2.382 3.051 . 0 0 "[ . 1 . 2]" 1
1747 1 18 ASN HB2 1 21 GLU QG . . 4.600 2.148 1.976 2.618 . 0 0 "[ . 1 . 2]" 1
1748 1 18 ASN HB3 1 21 GLU QG . . 5.180 3.604 3.371 4.013 . 0 0 "[ . 1 . 2]" 1
1749 1 18 ASN HD21 1 21 GLU QG . . 3.880 3.018 2.629 3.221 . 0 0 "[ . 1 . 2]" 1
1750 1 18 ASN HD21 2 7 ARG QG . . 5.050 3.429 2.807 4.348 . 0 0 "[ . 1 . 2]" 1
1751 1 18 ASN HD21 2 7 ARG QD . . 4.090 2.794 2.393 3.825 . 0 0 "[ . 1 . 2]" 1
1752 1 18 ASN HD22 1 21 GLU QG . . 4.850 4.563 4.039 4.793 . 0 0 "[ . 1 . 2]" 1
1753 1 18 ASN HD22 2 7 ARG QG . . 4.820 3.209 1.938 4.454 . 0 0 "[ . 1 . 2]" 1
1754 1 18 ASN HD22 2 7 ARG QD . . 3.800 2.556 1.925 3.823 0.023 18 0 "[ . 1 . 2]" 1
1755 1 20 ASN H 1 21 GLU QG . . 3.850 3.494 3.296 3.743 . 0 0 "[ . 1 . 2]" 1
1756 1 20 ASN HB2 1 53 LEU QD . . 4.380 2.849 2.730 3.020 . 0 0 "[ . 1 . 2]" 1
1757 1 20 ASN HB3 1 53 LEU QD . . 4.820 4.245 4.105 4.417 . 0 0 "[ . 1 . 2]" 1
1758 1 20 ASN HD21 1 21 GLU QG . . 4.380 3.527 3.267 3.819 . 0 0 "[ . 1 . 2]" 1
1759 1 20 ASN HD21 1 53 LEU QD . . 3.720 2.102 1.909 2.372 . 0 0 "[ . 1 . 2]" 1
1760 1 20 ASN HD22 1 53 LEU QD . . 4.170 3.242 3.022 3.607 . 0 0 "[ . 1 . 2]" 1
1761 1 20 ASN HD22 2 5 PRO QD . . 5.350 4.666 4.286 5.260 . 0 0 "[ . 1 . 2]" 1
1762 1 21 GLU H 1 21 GLU QG . . 3.250 3.057 2.927 3.208 . 0 0 "[ . 1 . 2]" 1
1763 1 21 GLU H 1 53 LEU QD . . 4.600 4.114 3.878 4.523 . 0 0 "[ . 1 . 2]" 1
1764 1 21 GLU HA 1 21 GLU QG . . 3.290 2.258 2.150 2.430 . 0 0 "[ . 1 . 2]" 1
1765 1 21 GLU HA 1 53 LEU QD . . 4.510 2.704 2.490 3.095 . 0 0 "[ . 1 . 2]" 1
1766 1 21 GLU HB3 1 22 LEU QB . . 5.020 4.557 4.452 4.637 . 0 0 "[ . 1 . 2]" 1
1767 1 21 GLU QG 1 22 LEU H . . 4.010 3.755 3.569 4.022 0.012 9 0 "[ . 1 . 2]" 1
1768 1 21 GLU QG 1 53 LEU H . . 4.320 3.862 3.561 4.177 . 0 0 "[ . 1 . 2]" 1
1769 1 21 GLU QG 1 53 LEU HB2 . . 4.520 2.240 1.983 2.739 . 0 0 "[ . 1 . 2]" 1
1770 1 21 GLU QG 1 53 LEU HB3 . . 4.910 3.551 3.289 3.995 . 0 0 "[ . 1 . 2]" 1
1771 1 21 GLU QG 1 53 LEU QD . . 3.890 2.320 2.069 2.799 . 0 0 "[ . 1 . 2]" 1
1772 1 22 LEU H 1 22 LEU QB . . 2.790 2.371 2.325 2.395 . 0 0 "[ . 1 . 2]" 1
1773 1 22 LEU H 1 22 LEU QD . . 4.310 3.839 3.810 3.864 . 0 0 "[ . 1 . 2]" 1
1774 1 22 LEU H 1 23 ARG QG . . 5.340 5.291 5.211 5.358 0.018 18 0 "[ . 1 . 2]" 1
1775 1 22 LEU H 1 53 LEU QD . . 5.200 4.327 4.144 4.556 . 0 0 "[ . 1 . 2]" 1
1776 1 22 LEU H 1 54 VAL QG . . 3.770 3.300 3.146 3.461 . 0 0 "[ . 1 . 2]" 1
1777 1 22 LEU HA 1 22 LEU QD . . 2.910 2.329 1.959 2.991 0.081 8 0 "[ . 1 . 2]" 1
1778 1 22 LEU HA 1 54 VAL QG . . 4.660 4.325 4.278 4.380 . 0 0 "[ . 1 . 2]" 1
1779 1 22 LEU QB 1 22 LEU QD . . 2.730 1.883 1.772 1.938 . 0 0 "[ . 1 . 2]" 1
1780 1 22 LEU QB 1 23 ARG H . . 4.000 3.418 3.176 3.581 . 0 0 "[ . 1 . 2]" 1
1781 1 22 LEU QB 1 43 ALA MB . . 4.820 4.437 4.285 4.515 . 0 0 "[ . 1 . 2]" 1
1782 1 22 LEU QB 1 52 GLY H . . 4.310 3.091 2.847 3.331 . 0 0 "[ . 1 . 2]" 1
1783 1 22 LEU QB 1 53 LEU H . . 4.150 2.812 2.512 2.893 . 0 0 "[ . 1 . 2]" 1
1784 1 22 LEU QB 1 54 VAL QG . . 3.120 1.928 1.888 1.993 . 0 0 "[ . 1 . 2]" 1
1785 1 22 LEU HG 1 54 VAL QG . . 4.710 3.374 2.526 4.252 . 0 0 "[ . 1 . 2]" 1
1786 1 22 LEU QD 1 23 ARG H . . 3.000 2.145 1.830 2.740 . 0 0 "[ . 1 . 2]" 1
1787 1 22 LEU QD 1 23 ARG HA . . 4.850 4.041 3.839 4.247 . 0 0 "[ . 1 . 2]" 1
1788 1 22 LEU QD 1 24 LEU QD . . 4.880 2.860 2.461 3.264 . 0 0 "[ . 1 . 2]" 1
1789 1 22 LEU QD 1 43 ALA H . . 4.450 3.645 3.410 3.959 . 0 0 "[ . 1 . 2]" 1
1790 1 22 LEU QD 1 43 ALA HA . . 5.440 4.653 4.522 4.858 . 0 0 "[ . 1 . 2]" 1
1791 1 22 LEU QD 1 44 GLU H . . 4.150 4.076 3.909 4.206 0.056 8 0 "[ . 1 . 2]" 1
1792 1 22 LEU QD 1 44 GLU HA . . 3.780 2.427 2.153 2.623 . 0 0 "[ . 1 . 2]" 1
1793 1 22 LEU QD 1 44 GLU HB2 . . 5.330 4.075 3.831 4.374 . 0 0 "[ . 1 . 2]" 1
1794 1 22 LEU QD 1 45 ASN H . . 3.420 2.776 2.465 3.036 . 0 0 "[ . 1 . 2]" 1
1795 1 22 LEU QD 1 45 ASN HA . . 4.240 3.335 3.050 3.696 . 0 0 "[ . 1 . 2]" 1
1796 1 22 LEU QD 1 45 ASN HB3 . . 3.640 2.846 2.524 3.149 . 0 0 "[ . 1 . 2]" 1
1797 1 22 LEU QD 1 50 LYS HA . . 5.080 4.519 4.108 4.788 . 0 0 "[ . 1 . 2]" 1
1798 1 22 LEU QD 1 50 LYS HB2 . . 4.120 3.985 3.683 4.191 0.071 6 0 "[ . 1 . 2]" 1
1799 1 22 LEU QD 1 50 LYS HB3 . . 4.280 4.088 3.758 4.321 0.041 5 0 "[ . 1 . 2]" 1
1800 1 22 LEU QD 1 50 LYS HG2 . . 3.670 2.381 1.914 2.965 . 0 0 "[ . 1 . 2]" 1
1801 1 22 LEU QD 1 50 LYS HG3 . . 3.520 2.213 1.883 2.560 . 0 0 "[ . 1 . 2]" 1
1802 1 22 LEU QD 1 50 LYS QD . . 2.950 2.141 1.848 2.602 . 0 0 "[ . 1 . 2]" 1
1803 1 22 LEU QD 1 50 LYS QE . . 3.700 2.833 1.891 3.596 . 0 0 "[ . 1 . 2]" 1
1804 1 22 LEU QD 1 51 THR H . . 4.750 3.898 3.293 4.348 . 0 0 "[ . 1 . 2]" 1
1805 1 22 LEU QD 1 51 THR HA . . 3.710 2.597 1.951 3.102 . 0 0 "[ . 1 . 2]" 1
1806 1 22 LEU QD 1 51 THR MG . . 3.980 3.511 3.153 3.881 . 0 0 "[ . 1 . 2]" 1
1807 1 22 LEU QD 1 52 GLY H . . 3.440 2.357 1.982 2.703 . 0 0 "[ . 1 . 2]" 1
1808 1 22 LEU QD 1 53 LEU H . . 5.410 4.100 4.017 4.219 . 0 0 "[ . 1 . 2]" 1
1809 1 22 LEU QD 1 54 VAL QG . . 3.110 2.226 1.967 2.442 . 0 0 "[ . 1 . 2]" 1
1810 1 23 ARG H 1 23 ARG QG . . 3.170 2.118 1.917 2.482 . 0 0 "[ . 1 . 2]" 1
1811 1 23 ARG H 1 23 ARG QD . . 4.200 3.685 2.179 4.208 0.008 13 0 "[ . 1 . 2]" 1
1812 1 23 ARG H 1 54 VAL QG . . 4.620 4.550 4.339 4.648 0.028 8 0 "[ . 1 . 2]" 1
1813 1 23 ARG HB3 1 23 ARG QD . . 3.330 2.515 2.025 3.316 . 0 0 "[ . 1 . 2]" 1
1814 1 24 LEU H 1 24 LEU QD . . 4.420 3.613 3.547 3.666 . 0 0 "[ . 1 . 2]" 1
1815 1 24 LEU HA 1 24 LEU QD . . 3.020 2.039 2.019 2.063 . 0 0 "[ . 1 . 2]" 1
1816 1 24 LEU HA 1 28 ASP QB . . 4.260 3.730 3.631 3.825 . 0 0 "[ . 1 . 2]" 1
1817 1 24 LEU HB2 1 54 VAL QG . . 4.170 3.716 3.553 3.872 . 0 0 "[ . 1 . 2]" 1
1818 1 24 LEU HG 1 28 ASP QB . . 5.340 3.503 3.344 3.645 . 0 0 "[ . 1 . 2]" 1
1819 1 24 LEU HG 1 54 VAL QG . . 4.340 4.353 4.251 4.397 0.057 1 0 "[ . 1 . 2]" 1
1820 1 24 LEU QD 1 25 ALA H . . 3.320 3.073 2.986 3.167 . 0 0 "[ . 1 . 2]" 1
1821 1 24 LEU QD 1 25 ALA HA . . 5.270 4.908 4.866 4.953 . 0 0 "[ . 1 . 2]" 1
1822 1 24 LEU QD 1 28 ASP HA . . 5.440 5.613 5.577 5.639 0.199 14 0 "[ . 1 . 2]" 1
1823 1 24 LEU QD 1 28 ASP QB . . 3.700 3.221 3.131 3.275 . 0 0 "[ . 1 . 2]" 1
1824 1 24 LEU QD 1 30 VAL HA . . 5.330 4.699 4.601 4.749 . 0 0 "[ . 1 . 2]" 1
1825 1 24 LEU QD 1 30 VAL MG1 . . 2.850 1.876 1.848 1.910 . 0 0 "[ . 1 . 2]" 1
1826 1 24 LEU QD 1 30 VAL MG2 . . 3.400 2.356 2.298 2.391 . 0 0 "[ . 1 . 2]" 1
1827 1 24 LEU QD 1 43 ALA MB . . 4.150 3.664 3.548 3.767 . 0 0 "[ . 1 . 2]" 1
1828 1 24 LEU QD 1 45 ASN HA . . 5.440 4.547 4.238 4.862 . 0 0 "[ . 1 . 2]" 1
1829 1 24 LEU QD 1 54 VAL H . . 5.440 5.016 4.934 5.081 . 0 0 "[ . 1 . 2]" 1
1830 1 24 LEU QD 1 54 VAL HA . . 4.600 3.617 3.544 3.693 . 0 0 "[ . 1 . 2]" 1
1831 1 24 LEU QD 1 54 VAL HB . . 4.170 2.174 1.998 2.266 . 0 0 "[ . 1 . 2]" 1
1832 1 24 LEU QD 1 54 VAL QG . . 2.990 2.065 1.983 2.104 . 0 0 "[ . 1 . 2]" 1
1833 1 24 LEU QD 1 55 PRO HD2 . . 3.920 2.019 1.936 2.090 . 0 0 "[ . 1 . 2]" 1
1834 1 24 LEU QD 1 58 PHE H . . 4.930 4.648 4.511 4.706 . 0 0 "[ . 1 . 2]" 1
1835 1 24 LEU QD 1 58 PHE HB2 . . 4.130 3.626 3.504 3.698 . 0 0 "[ . 1 . 2]" 1
1836 1 24 LEU QD 1 58 PHE HB3 . . 3.950 2.896 2.767 2.961 . 0 0 "[ . 1 . 2]" 1
1837 1 24 LEU QD 1 58 PHE QD . . 3.850 3.676 3.572 3.722 . 0 0 "[ . 1 . 2]" 1
1838 1 24 LEU QD 1 59 VAL H . . 4.690 4.391 4.271 4.559 . 0 0 "[ . 1 . 2]" 1
1839 1 24 LEU QD 1 59 VAL HA . . 4.590 3.881 3.749 4.013 . 0 0 "[ . 1 . 2]" 1
1840 1 24 LEU QD 1 59 VAL MG1 . . 2.860 1.808 1.776 1.866 . 0 0 "[ . 1 . 2]" 1
1841 1 25 ALA H 1 28 ASP QB . . 3.240 2.338 2.274 2.388 . 0 0 "[ . 1 . 2]" 1
1842 1 27 GLY H 1 28 ASP QB . . 4.710 4.398 4.244 4.456 . 0 0 "[ . 1 . 2]" 1
1843 1 28 ASP H 1 28 ASP QB . . 2.760 2.349 2.244 2.376 . 0 0 "[ . 1 . 2]" 1
1844 1 28 ASP QB 1 29 ILE H . . 3.150 2.845 2.655 3.282 0.132 10 0 "[ . 1 . 2]" 1
1845 1 28 ASP QB 1 29 ILE HA . . 5.340 4.284 4.155 4.439 . 0 0 "[ . 1 . 2]" 1
1846 1 28 ASP QB 1 30 VAL MG1 . . 3.940 3.452 3.346 3.560 . 0 0 "[ . 1 . 2]" 1
1847 1 30 VAL MG1 1 46 GLU QB . . 5.340 4.697 4.239 5.333 . 0 0 "[ . 1 . 2]" 1
1848 1 30 VAL MG1 1 54 VAL QG . . 3.570 2.894 2.673 3.036 . 0 0 "[ . 1 . 2]" 1
1849 1 30 VAL MG2 1 54 VAL QG . . 3.930 2.913 2.601 3.063 . 0 0 "[ . 1 . 2]" 1
1850 1 31 PHE H 1 44 GLU QG . . 4.610 2.545 2.335 2.750 . 0 0 "[ . 1 . 2]" 1
1851 1 31 PHE QD 1 44 GLU QG . . 4.170 2.222 2.049 2.446 . 0 0 "[ . 1 . 2]" 1
1852 1 32 ILE MG 1 54 VAL QG . . 5.440 3.654 3.580 3.725 . 0 0 "[ . 1 . 2]" 1
1853 1 32 ILE MD 1 54 VAL QG . . 4.270 2.419 2.275 2.503 . 0 0 "[ . 1 . 2]" 1
1854 1 36 HIS H 1 53 LEU QD . . 5.440 5.259 4.917 5.456 0.016 3 0 "[ . 1 . 2]" 1
1855 1 36 HIS HB2 1 53 LEU QD . . 4.550 3.987 3.595 4.237 . 0 0 "[ . 1 . 2]" 1
1856 1 36 HIS HB3 1 53 LEU QD . . 4.680 3.615 3.290 3.865 . 0 0 "[ . 1 . 2]" 1
1857 1 36 HIS HD2 1 53 LEU QD . . 3.940 3.634 3.437 3.877 . 0 0 "[ . 1 . 2]" 1
1858 1 36 HIS HD2 2 5 PRO QG . . 3.660 2.822 2.653 3.258 . 0 0 "[ . 1 . 2]" 1
1859 1 36 HIS HD2 2 5 PRO QD . . 3.700 2.677 2.346 3.123 . 0 0 "[ . 1 . 2]" 1
1860 1 38 GLN QB 1 38 GLN QE . . 4.070 3.314 2.029 3.735 . 0 0 "[ . 1 . 2]" 1
1861 1 39 GLY HA2 1 56 GLU QG . . 5.340 5.371 5.332 5.418 0.078 15 0 "[ . 1 . 2]" 1
1862 1 39 GLY HA3 1 56 GLU QB . . 5.000 4.593 4.363 4.806 . 0 0 "[ . 1 . 2]" 1
1863 1 40 TRP H 1 53 LEU QD . . 5.310 5.070 4.787 5.259 . 0 0 "[ . 1 . 2]" 1
1864 1 40 TRP H 1 56 GLU QB . . 5.340 5.039 4.837 5.212 . 0 0 "[ . 1 . 2]" 1
1865 1 40 TRP H 2 5 PRO QG . . 4.700 4.276 4.017 4.436 . 0 0 "[ . 1 . 2]" 1
1866 1 40 TRP HA 1 53 LEU QD . . 4.850 4.476 4.236 4.621 . 0 0 "[ . 1 . 2]" 1
1867 1 40 TRP HB2 1 53 LEU QD . . 3.910 3.208 2.912 3.428 . 0 0 "[ . 1 . 2]" 1
1868 1 40 TRP HB2 2 5 PRO QG . . 4.890 2.141 1.982 2.294 . 0 0 "[ . 1 . 2]" 1
1869 1 40 TRP HB3 1 53 LEU QD . . 3.530 2.584 2.239 2.792 . 0 0 "[ . 1 . 2]" 1
1870 1 40 TRP HB3 2 5 PRO QG . . 5.350 2.661 2.422 3.064 . 0 0 "[ . 1 . 2]" 1
1871 1 40 TRP HD1 1 53 LEU QD . . 4.760 4.590 4.449 4.721 . 0 0 "[ . 1 . 2]" 1
1872 1 40 TRP HD1 2 5 PRO QB . . 3.420 2.625 2.505 2.727 . 0 0 "[ . 1 . 2]" 1
1873 1 40 TRP HD1 2 5 PRO QG . . 3.090 2.833 2.294 3.033 . 0 0 "[ . 1 . 2]" 1
1874 1 40 TRP HE3 1 53 LEU QD . . 4.260 3.893 3.693 4.021 . 0 0 "[ . 1 . 2]" 1
1875 1 40 TRP HE1 2 5 PRO QB . . 3.650 3.125 2.848 3.240 . 0 0 "[ . 1 . 2]" 1
1876 1 40 TRP HE1 2 5 PRO QG . . 5.010 4.466 3.929 4.654 . 0 0 "[ . 1 . 2]" 1
1877 1 40 TRP HE1 2 7 ARG QB . . 5.030 4.540 4.376 4.822 . 0 0 "[ . 1 . 2]" 1
1878 1 40 TRP HE1 2 7 ARG QG . . 4.050 3.030 2.722 3.565 . 0 0 "[ . 1 . 2]" 1
1879 1 40 TRP HE1 2 8 PRO QD . . 5.350 5.028 4.978 5.104 . 0 0 "[ . 1 . 2]" 1
1880 1 40 TRP HZ3 1 54 VAL QG . . 4.650 4.482 4.368 4.546 . 0 0 "[ . 1 . 2]" 1
1881 1 40 TRP HZ2 2 7 ARG QB . . 5.340 4.519 3.922 5.027 . 0 0 "[ . 1 . 2]" 1
1882 1 40 TRP HZ2 2 7 ARG QG . . 3.550 2.696 2.503 2.997 . 0 0 "[ . 1 . 2]" 1
1883 1 40 TRP HZ2 2 7 ARG QD . . 5.100 3.778 1.993 4.776 . 0 0 "[ . 1 . 2]" 1
1884 1 40 TRP HH2 2 7 ARG QG . . 5.340 4.589 4.322 4.835 . 0 0 "[ . 1 . 2]" 1
1885 1 41 LEU H 1 53 LEU QD . . 4.370 4.052 3.705 4.227 . 0 0 "[ . 1 . 2]" 1
1886 1 41 LEU H 1 54 VAL QG . . 4.520 3.335 3.110 3.476 . 0 0 "[ . 1 . 2]" 1
1887 1 41 LEU HA 1 53 LEU QD . . 4.660 4.086 3.809 4.254 . 0 0 "[ . 1 . 2]" 1
1888 1 41 LEU HB2 1 54 VAL QG . . 3.770 2.723 2.612 2.855 . 0 0 "[ . 1 . 2]" 1
1889 1 41 LEU HB3 1 54 VAL QG . . 4.710 4.117 4.008 4.257 . 0 0 "[ . 1 . 2]" 1
1890 1 41 LEU HB3 1 56 GLU QG . . 5.340 5.108 4.863 5.357 0.017 15 0 "[ . 1 . 2]" 1
1891 1 41 LEU HG 1 56 GLU QG . . 4.550 3.678 3.467 3.950 . 0 0 "[ . 1 . 2]" 1
1892 1 41 LEU MD1 1 56 GLU QB . . 3.690 2.108 2.072 2.137 . 0 0 "[ . 1 . 2]" 1
1893 1 41 LEU MD1 1 56 GLU QG . . 3.520 1.968 1.853 2.118 . 0 0 "[ . 1 . 2]" 1
1894 1 41 LEU MD2 1 53 LEU QD . . 5.280 5.033 4.763 5.183 . 0 0 "[ . 1 . 2]" 1
1895 1 41 LEU MD2 1 56 GLU QB . . 3.410 2.367 2.193 2.489 . 0 0 "[ . 1 . 2]" 1
1896 1 41 LEU MD2 1 56 GLU QG . . 3.490 3.089 2.794 3.377 . 0 0 "[ . 1 . 2]" 1
1897 1 42 VAL H 1 53 LEU QD . . 4.200 3.669 3.436 3.809 . 0 0 "[ . 1 . 2]" 1
1898 1 42 VAL HA 1 53 LEU QD . . 3.740 2.893 2.750 2.998 . 0 0 "[ . 1 . 2]" 1
1899 1 42 VAL HA 1 54 VAL QG . . 5.440 3.633 3.570 3.682 . 0 0 "[ . 1 . 2]" 1
1900 1 42 VAL HB 1 54 VAL QG . . 5.440 5.509 5.473 5.531 0.091 11 0 "[ . 1 . 2]" 1
1901 1 42 VAL MG2 1 53 LEU QD . . 3.100 1.857 1.825 1.894 . 0 0 "[ . 1 . 2]" 1
1902 1 43 ALA H 1 54 VAL QG . . 3.990 2.645 2.542 2.744 . 0 0 "[ . 1 . 2]" 1
1903 1 43 ALA HA 1 54 VAL QG . . 5.440 3.921 3.826 4.048 . 0 0 "[ . 1 . 2]" 1
1904 1 44 GLU H 1 44 GLU QG . . 3.590 2.359 2.279 2.451 . 0 0 "[ . 1 . 2]" 1
1905 1 44 GLU HA 1 44 GLU QG . . 3.700 3.336 3.323 3.353 . 0 0 "[ . 1 . 2]" 1
1906 1 44 GLU QG 1 45 ASN H . . 3.540 3.502 3.356 3.554 0.014 7 0 "[ . 1 . 2]" 1
1907 1 44 GLU QG 1 46 GLU HA . . 4.690 4.657 4.593 4.704 0.014 1 0 "[ . 1 . 2]" 1
1908 1 44 GLU QG 1 48 GLY H . . 4.550 3.617 3.418 3.856 . 0 0 "[ . 1 . 2]" 1
1909 1 44 GLU QG 1 48 GLY HA2 . . 4.360 2.205 2.047 2.372 . 0 0 "[ . 1 . 2]" 1
1910 1 44 GLU QG 1 48 GLY HA3 . . 5.270 3.692 3.590 3.854 . 0 0 "[ . 1 . 2]" 1
1911 1 44 GLU QG 1 51 THR MG . . 4.160 4.068 3.861 4.169 0.009 11 0 "[ . 1 . 2]" 1
1912 1 45 ASN H 1 45 ASN QD . . 3.860 2.291 1.875 3.904 0.044 11 0 "[ . 1 . 2]" 1
1913 1 45 ASN QD 1 46 GLU H . . 4.060 3.818 3.764 3.955 . 0 0 "[ . 1 . 2]" 1
1914 1 45 ASN QD 1 47 SER H . . 3.990 2.915 2.800 3.299 . 0 0 "[ . 1 . 2]" 1
1915 1 45 ASN QD 1 48 GLY H . . 3.670 2.251 1.958 3.249 . 0 0 "[ . 1 . 2]" 1
1916 1 45 ASN QD 1 49 SER H . . 3.190 1.879 1.843 2.050 . 0 0 "[ . 1 . 2]" 1
1917 1 45 ASN QD 1 50 LYS H . . 2.810 1.973 1.854 2.120 . 0 0 "[ . 1 . 2]" 1
1918 1 46 GLU H 1 46 GLU QB . . 2.970 2.183 2.105 2.278 . 0 0 "[ . 1 . 2]" 1
1919 1 46 GLU QB 1 47 SER H . . 3.320 2.653 2.585 2.740 . 0 0 "[ . 1 . 2]" 1
1920 1 46 GLU QB 1 47 SER HA . . 5.340 3.883 3.785 4.077 . 0 0 "[ . 1 . 2]" 1
1921 1 46 GLU QB 1 48 GLY H . . 5.340 4.456 4.389 4.538 . 0 0 "[ . 1 . 2]" 1
1922 1 47 SER H 1 47 SER QB . . 3.050 2.294 2.149 2.623 . 0 0 "[ . 1 . 2]" 1
1923 1 47 SER HA 1 47 SER QB . . 2.630 2.414 2.294 2.477 . 0 0 "[ . 1 . 2]" 1
1924 1 47 SER QB 1 48 GLY H . . 3.450 2.990 2.976 3.009 . 0 0 "[ . 1 . 2]" 1
1925 1 47 SER QB 1 49 SER H . . 3.890 2.414 2.271 2.885 . 0 0 "[ . 1 . 2]" 1
1926 1 47 SER QB 1 50 LYS H . . 4.570 3.449 3.109 4.257 . 0 0 "[ . 1 . 2]" 1
1927 1 49 SER H 1 49 SER QB . . 3.000 2.479 2.301 3.006 0.006 12 0 "[ . 1 . 2]" 1
1928 1 49 SER QB 1 50 LYS H . . 3.520 3.127 2.962 3.525 0.005 12 0 "[ . 1 . 2]" 1
1929 1 52 GLY QA 1 53 LEU QD . . 5.060 3.906 3.834 4.053 . 0 0 "[ . 1 . 2]" 1
1930 1 52 GLY QA 1 54 VAL QG . . 5.040 4.095 4.034 4.143 . 0 0 "[ . 1 . 2]" 1
1931 1 53 LEU H 1 53 LEU QD . . 3.450 3.202 3.081 3.401 . 0 0 "[ . 1 . 2]" 1
1932 1 53 LEU H 1 54 VAL QG . . 5.160 3.987 3.923 4.072 . 0 0 "[ . 1 . 2]" 1
1933 1 53 LEU HA 1 53 LEU QD . . 3.240 2.364 2.251 2.482 . 0 0 "[ . 1 . 2]" 1
1934 1 53 LEU HB2 1 53 LEU QD . . 3.130 2.145 2.083 2.184 . 0 0 "[ . 1 . 2]" 1
1935 1 53 LEU HB3 1 54 VAL QG . . 5.440 4.392 4.330 4.458 . 0 0 "[ . 1 . 2]" 1
1936 1 53 LEU QD 2 3 PHE HA . . 3.910 3.285 3.104 3.533 . 0 0 "[ . 1 . 2]" 1
1937 1 53 LEU QD 2 3 PHE HB2 . . 3.320 2.194 1.946 2.627 . 0 0 "[ . 1 . 2]" 1
1938 1 53 LEU QD 2 3 PHE HB3 . . 3.470 1.894 1.842 2.038 . 0 0 "[ . 1 . 2]" 1
1939 1 53 LEU QD 2 3 PHE QD . . 3.660 3.035 2.700 3.530 . 0 0 "[ . 1 . 2]" 1
1940 1 53 LEU QD 2 4 ILE MG . . 4.450 4.198 3.757 4.480 0.030 17 0 "[ . 1 . 2]" 1
1941 1 53 LEU QD 2 5 PRO HA . . 3.120 2.954 2.670 3.104 . 0 0 "[ . 1 . 2]" 1
1942 1 53 LEU QD 2 5 PRO QB . . 3.300 2.115 1.931 2.798 . 0 0 "[ . 1 . 2]" 1
1943 1 53 LEU QD 2 5 PRO QG . . 3.440 2.202 1.989 3.006 . 0 0 "[ . 1 . 2]" 1
1944 1 53 LEU QD 2 5 PRO QD . . 3.540 1.786 1.709 2.133 . 0 0 "[ . 1 . 2]" 1
1945 1 54 VAL H 1 54 VAL QG . . 3.240 2.222 2.144 2.281 . 0 0 "[ . 1 . 2]" 1
1946 1 54 VAL QG 1 55 PRO HA . . 5.440 4.167 4.118 4.233 . 0 0 "[ . 1 . 2]" 1
1947 1 54 VAL QG 1 55 PRO HD2 . . 3.890 2.975 2.955 2.994 . 0 0 "[ . 1 . 2]" 1
1948 1 54 VAL QG 1 56 GLU H . . 5.440 4.774 4.665 4.893 . 0 0 "[ . 1 . 2]" 1
1949 1 54 VAL QG 1 56 GLU HA . . 4.960 4.066 3.959 4.162 . 0 0 "[ . 1 . 2]" 1
1950 1 54 VAL QG 1 59 VAL HB . . 5.440 4.666 4.566 4.777 . 0 0 "[ . 1 . 2]" 1
1951 1 54 VAL QG 1 59 VAL MG1 . . 4.190 2.933 2.767 3.074 . 0 0 "[ . 1 . 2]" 1
1952 1 54 VAL QG 1 59 VAL MG2 . . 5.070 3.019 2.872 3.170 . 0 0 "[ . 1 . 2]" 1
1953 1 55 PRO HA 1 56 GLU QB . . 5.340 4.054 4.044 4.061 . 0 0 "[ . 1 . 2]" 1
1954 1 56 GLU H 1 56 GLU QG . . 4.170 4.046 3.989 4.119 . 0 0 "[ . 1 . 2]" 1
1955 1 56 GLU QB 1 57 GLU H . . 3.220 2.843 2.800 2.880 . 0 0 "[ . 1 . 2]" 1
1956 1 56 GLU QB 1 58 PHE H . . 4.640 4.483 4.461 4.508 . 0 0 "[ . 1 . 2]" 1
1957 1 56 GLU QG 1 57 GLU H . . 4.740 4.141 3.844 4.430 . 0 0 "[ . 1 . 2]" 1
1958 1 57 GLU H 1 57 GLU QG . . 3.980 3.763 3.466 3.997 0.017 8 0 "[ . 1 . 2]" 1
1959 1 57 GLU HA 1 57 GLU QG . . 3.280 2.269 2.061 2.590 . 0 0 "[ . 1 . 2]" 1
1960 1 57 GLU QG 1 58 PHE H . . 5.340 4.776 4.652 4.945 . 0 0 "[ . 1 . 2]" 1
1961 1 58 PHE QE 2 13 PRO QD . . 4.000 3.499 3.371 3.569 . 0 0 "[ . 1 . 2]" 1
1962 1 58 PHE HZ 2 13 PRO QD . . 4.150 3.601 3.553 3.684 . 0 0 "[ . 1 . 2]" 1
1963 1 62 ILE MG 1 63 GLN QB . . 4.420 4.038 3.940 4.259 . 0 0 "[ . 1 . 2]" 1
1964 1 63 GLN H 1 63 GLN QB . . 3.250 2.554 2.488 2.898 . 0 0 "[ . 1 . 2]" 1
1965 1 63 GLN HA 1 66 LEU QD . . 5.440 4.291 3.362 4.985 . 0 0 "[ . 1 . 2]" 1
1966 1 63 GLN QB 1 64 PRO HA . . 4.640 4.533 4.475 4.754 0.114 16 0 "[ . 1 . 2]" 1
1967 1 63 GLN QB 1 64 PRO QG . . 3.710 3.547 3.533 3.564 . 0 0 "[ . 1 . 2]" 1
1968 1 63 GLN QB 1 64 PRO QD . . 3.160 2.073 1.905 2.137 . 0 0 "[ . 1 . 2]" 1
1969 1 63 GLN QB 1 65 GLU H . . 4.310 3.207 2.850 4.252 . 0 0 "[ . 1 . 2]" 1
1970 1 63 GLN QB 1 66 LEU H . . 4.220 2.251 1.944 3.127 . 0 0 "[ . 1 . 2]" 1
1971 1 63 GLN QB 1 66 LEU QB . . 4.380 2.734 2.277 4.398 0.018 19 0 "[ . 1 . 2]" 1
1972 1 63 GLN QB 1 66 LEU QD . . 4.490 2.988 1.888 3.852 . 0 0 "[ . 1 . 2]" 1
1973 1 63 GLN QG 1 64 PRO QD . . 3.980 2.386 2.026 3.496 . 0 0 "[ . 1 . 2]" 1
1974 1 63 GLN QG 1 66 LEU QB . . 5.040 2.772 2.020 4.691 . 0 0 "[ . 1 . 2]" 1
1975 1 63 GLN QG 1 66 LEU QD . . 4.270 2.450 1.900 3.561 . 0 0 "[ . 1 . 2]" 1
1976 1 63 GLN QE 1 66 LEU QD . . 4.410 2.974 1.890 4.352 . 0 0 "[ . 1 . 2]" 1
1977 1 64 PRO QB 1 65 GLU H . . 3.290 2.632 1.943 2.874 . 0 0 "[ . 1 . 2]" 1
1978 1 64 PRO QB 1 66 LEU H . . 5.040 4.518 3.984 4.829 . 0 0 "[ . 1 . 2]" 1
1979 1 64 PRO QB 1 66 LEU HG . . 4.780 4.400 3.897 4.564 . 0 0 "[ . 1 . 2]" 1
1980 1 64 PRO QB 1 66 LEU QD . . 4.530 4.194 3.387 4.356 . 0 0 "[ . 1 . 2]" 1
1981 1 64 PRO QG 1 66 LEU QD . . 4.040 2.816 1.954 3.005 . 0 0 "[ . 1 . 2]" 1
1982 1 64 PRO QD 1 65 GLU H . . 4.110 2.844 2.677 3.338 . 0 0 "[ . 1 . 2]" 1
1983 1 65 GLU H 1 65 GLU QB . . 3.050 2.772 2.475 3.097 0.047 7 0 "[ . 1 . 2]" 1
1984 1 65 GLU HA 1 65 GLU QG . . 3.480 2.438 2.124 3.324 . 0 0 "[ . 1 . 2]" 1
1985 1 65 GLU QB 1 66 LEU QD . . 5.280 3.301 2.725 4.589 . 0 0 "[ . 1 . 2]" 1
1986 1 65 GLU QG 1 66 LEU H . . 5.340 4.437 3.496 4.774 . 0 0 "[ . 1 . 2]" 1
1987 1 66 LEU H 1 66 LEU QB . . 3.120 2.772 2.441 3.192 0.072 13 0 "[ . 1 . 2]" 1
1988 1 66 LEU H 1 66 LEU QD . . 4.090 3.047 2.593 3.290 . 0 0 "[ . 1 . 2]" 1
1989 1 66 LEU HA 1 66 LEU QD . . 3.370 2.430 2.128 3.403 0.033 19 0 "[ . 1 . 2]" 1
1990 1 66 LEU QB 1 67 GLU H . . 3.670 2.511 1.983 3.768 0.098 9 0 "[ . 1 . 2]" 1
1991 1 66 LEU QB 1 67 GLU HA . . 5.180 4.203 3.901 4.990 . 0 0 "[ . 1 . 2]" 1
1992 1 66 LEU QB 1 67 GLU QB . . 5.340 4.284 3.161 4.790 . 0 0 "[ . 1 . 2]" 1
1993 1 66 LEU QD 1 67 GLU QB . . 5.440 4.905 4.090 5.314 . 0 0 "[ . 1 . 2]" 1
1994 1 67 GLU H 1 67 GLU QG . . 4.220 3.466 2.096 4.219 . 0 0 "[ . 1 . 2]" 1
1995 1 67 GLU HA 1 67 GLU QG . . 3.660 2.717 2.107 3.459 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 32
_Distance_constraint_stats_list.Viol_count 630
_Distance_constraint_stats_list.Viol_total 2115.684
_Distance_constraint_stats_list.Viol_max 0.330
_Distance_constraint_stats_list.Viol_rms 0.0885
_Distance_constraint_stats_list.Viol_average_all_restraints 0.1653
_Distance_constraint_stats_list.Viol_average_violations_only 0.1679
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 6 GLN 5.246 0.250 5 0 "[ . 1 . 2]"
1 8 ALA 12.437 0.330 15 0 "[ . 1 . 2]"
1 9 VAL 13.403 0.291 5 0 "[ . 1 . 2]"
1 10 ALA 5.972 0.290 15 0 "[ . 1 . 2]"
1 14 PHE 6.189 0.251 15 0 "[ . 1 . 2]"
1 24 LEU 6.189 0.251 15 0 "[ . 1 . 2]"
1 28 ASP 5.972 0.290 15 0 "[ . 1 . 2]"
1 30 VAL 12.437 0.330 15 0 "[ . 1 . 2]"
1 31 PHE 18.108 0.297 14 0 "[ . 1 . 2]"
1 32 ILE 5.246 0.250 5 0 "[ . 1 . 2]"
1 33 SER 5.093 0.228 8 0 "[ . 1 . 2]"
1 41 LEU 13.821 0.320 4 0 "[ . 1 . 2]"
1 42 VAL 5.093 0.228 8 0 "[ . 1 . 2]"
1 43 ALA 17.521 0.327 15 0 "[ . 1 . 2]"
1 44 GLU 18.108 0.297 14 0 "[ . 1 . 2]"
1 45 ASN 7.996 0.309 2 0 "[ . 1 . 2]"
1 50 LYS 7.996 0.309 2 0 "[ . 1 . 2]"
1 52 GLY 17.521 0.327 15 0 "[ . 1 . 2]"
1 54 VAL 13.821 0.320 4 0 "[ . 1 . 2]"
1 60 SER 13.403 0.291 5 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 6 GLN O 1 32 ILE H . . 1.800 2.017 1.974 2.050 0.250 5 0 "[ . 1 . 2]" 2
2 1 6 GLN O 1 32 ILE N . . 2.700 2.745 2.738 2.764 0.064 11 0 "[ . 1 . 2]" 2
3 1 9 VAL O 1 60 SER H . . 1.800 1.936 1.831 2.004 0.204 11 0 "[ . 1 . 2]" 2
4 1 9 VAL O 1 60 SER N . . 2.700 2.816 2.740 2.895 0.195 5 0 "[ . 1 . 2]" 2
5 1 8 ALA O 1 30 VAL H . . 1.800 2.024 2.001 2.060 0.260 15 0 "[ . 1 . 2]" 2
6 1 8 ALA O 1 30 VAL N . . 2.700 2.968 2.915 3.030 0.330 15 0 "[ . 1 . 2]" 2
7 1 14 PHE O 1 24 LEU H . . 1.800 1.892 1.793 2.001 0.201 15 0 "[ . 1 . 2]" 2
8 1 14 PHE O 1 24 LEU N . . 2.700 2.834 2.728 2.951 0.251 15 0 "[ . 1 . 2]" 2
9 1 14 PHE H 1 24 LEU O . . 1.800 1.843 1.787 1.901 0.101 20 0 "[ . 1 . 2]" 2
10 1 14 PHE N 1 24 LEU O . . 2.700 2.738 2.730 2.751 0.051 16 0 "[ . 1 . 2]" 2
11 1 10 ALA H 1 28 ASP O . . 1.800 1.980 1.886 2.032 0.232 10 0 "[ . 1 . 2]" 2
12 1 10 ALA N 1 28 ASP O . . 2.700 2.819 2.730 2.990 0.290 15 0 "[ . 1 . 2]" 2
13 1 8 ALA H 1 30 VAL O . . 1.800 1.881 1.858 1.919 0.119 3 0 "[ . 1 . 2]" 2
14 1 8 ALA N 1 30 VAL O . . 2.700 2.748 2.723 2.787 0.087 3 0 "[ . 1 . 2]" 2
15 1 31 PHE O 1 44 GLU H . . 1.800 2.077 2.061 2.097 0.297 14 0 "[ . 1 . 2]" 2
16 1 31 PHE O 1 44 GLU N . . 2.700 2.969 2.941 2.993 0.293 14 0 "[ . 1 . 2]" 2
17 1 41 LEU O 1 54 VAL H . . 1.800 1.870 1.795 1.974 0.174 3 0 "[ . 1 . 2]" 2
18 1 41 LEU O 1 54 VAL N . . 2.700 2.817 2.748 2.911 0.211 3 0 "[ . 1 . 2]" 2
19 1 33 SER H 1 42 VAL O . . 1.800 2.007 1.995 2.028 0.228 8 0 "[ . 1 . 2]" 2
20 1 33 SER N 1 42 VAL O . . 2.700 2.747 2.727 2.770 0.070 8 0 "[ . 1 . 2]" 2
21 1 43 ALA O 1 52 GLY H . . 1.800 1.966 1.894 2.013 0.213 18 0 "[ . 1 . 2]" 2
22 1 43 ALA O 1 52 GLY N . . 2.700 2.924 2.870 2.977 0.277 2 0 "[ . 1 . 2]" 2
23 1 31 PHE H 1 44 GLU O . . 1.800 1.962 1.815 2.034 0.234 11 0 "[ . 1 . 2]" 2
24 1 31 PHE N 1 44 GLU O . . 2.700 2.898 2.751 2.982 0.282 11 0 "[ . 1 . 2]" 2
25 1 45 ASN H 1 50 LYS O . . 1.800 1.987 1.796 2.091 0.291 2 0 "[ . 1 . 2]" 2
26 1 45 ASN N 1 50 LYS O . . 2.700 2.913 2.742 3.009 0.309 2 0 "[ . 1 . 2]" 2
27 1 43 ALA H 1 52 GLY O . . 1.800 2.094 2.059 2.127 0.327 15 0 "[ . 1 . 2]" 2
28 1 43 ALA N 1 52 GLY O . . 2.700 2.892 2.826 2.957 0.257 3 0 "[ . 1 . 2]" 2
29 1 41 LEU H 1 54 VAL O . . 1.800 2.019 1.985 2.059 0.259 4 0 "[ . 1 . 2]" 2
30 1 41 LEU N 1 54 VAL O . . 2.700 2.985 2.949 3.020 0.320 4 0 "[ . 1 . 2]" 2
31 1 9 VAL H 1 60 SER O . . 1.800 1.971 1.852 2.015 0.215 5 0 "[ . 1 . 2]" 2
32 1 9 VAL N 1 60 SER O . . 2.700 2.947 2.829 2.991 0.291 5 0 "[ . 1 . 2]" 2
stop_
save_
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