NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
461816 |
2e7k   |
11226 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2e7k
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 1510
_Distance_constraint_stats_list.Viol_count 341
_Distance_constraint_stats_list.Viol_total 70.864
_Distance_constraint_stats_list.Viol_max 0.094
_Distance_constraint_stats_list.Viol_rms 0.0021
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0104
_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 7 GLY 0.002 0.001 13 0 "[ . 1 . 2]"
1 8 ARG 0.056 0.032 8 0 "[ . 1 . 2]"
1 9 MET 0.181 0.067 15 0 "[ . 1 . 2]"
1 10 VAL 0.017 0.010 10 0 "[ . 1 . 2]"
1 11 GLY 0.002 0.002 1 0 "[ . 1 . 2]"
1 12 ILE 0.025 0.010 18 0 "[ . 1 . 2]"
1 13 ARG 0.032 0.013 18 0 "[ . 1 . 2]"
1 14 LYS 0.388 0.054 15 0 "[ . 1 . 2]"
1 15 THR 0.068 0.036 1 0 "[ . 1 . 2]"
1 16 ALA 0.061 0.036 1 0 "[ . 1 . 2]"
1 17 GLY 0.002 0.002 12 0 "[ . 1 . 2]"
1 18 GLU 0.008 0.003 1 0 "[ . 1 . 2]"
1 19 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 LEU 0.007 0.003 12 0 "[ . 1 . 2]"
1 21 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 VAL 0.048 0.010 19 0 "[ . 1 . 2]"
1 23 THR 0.025 0.010 19 0 "[ . 1 . 2]"
1 24 PHE 0.044 0.008 19 0 "[ . 1 . 2]"
1 25 ARG 0.083 0.020 17 0 "[ . 1 . 2]"
1 26 VAL 0.014 0.003 18 0 "[ . 1 . 2]"
1 27 GLU 0.049 0.026 20 0 "[ . 1 . 2]"
1 28 GLY 0.000 0.000 20 0 "[ . 1 . 2]"
1 29 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 GLU 0.002 0.002 12 0 "[ . 1 . 2]"
1 31 LEU 0.042 0.011 2 0 "[ . 1 . 2]"
1 32 VAL 0.077 0.020 17 0 "[ . 1 . 2]"
1 33 ILE 0.042 0.011 2 0 "[ . 1 . 2]"
1 34 ALA 0.018 0.016 12 0 "[ . 1 . 2]"
1 35 ARG 0.009 0.007 12 0 "[ . 1 . 2]"
1 36 ILE 0.051 0.030 18 0 "[ . 1 . 2]"
1 37 LEU 0.001 0.001 1 0 "[ . 1 . 2]"
1 38 HIS 0.032 0.030 18 0 "[ . 1 . 2]"
1 39 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 GLY 0.014 0.011 18 0 "[ . 1 . 2]"
1 41 MET 0.021 0.014 12 0 "[ . 1 . 2]"
1 42 VAL 0.020 0.016 20 0 "[ . 1 . 2]"
1 43 ALA 0.005 0.005 12 0 "[ . 1 . 2]"
1 44 GLN 0.138 0.079 12 0 "[ . 1 . 2]"
1 45 GLN 0.041 0.016 20 0 "[ . 1 . 2]"
1 46 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 LEU 0.001 0.001 20 0 "[ . 1 . 2]"
1 48 LEU 0.050 0.022 18 0 "[ . 1 . 2]"
1 49 HIS 0.003 0.003 10 0 "[ . 1 . 2]"
1 50 VAL 0.006 0.004 18 0 "[ . 1 . 2]"
1 51 GLY 0.000 0.000 18 0 "[ . 1 . 2]"
1 52 ASP 0.005 0.005 17 0 "[ . 1 . 2]"
1 53 ILE 0.013 0.005 13 0 "[ . 1 . 2]"
1 54 ILE 0.019 0.008 19 0 "[ . 1 . 2]"
1 55 LYS 0.184 0.035 5 0 "[ . 1 . 2]"
1 56 GLU 0.060 0.025 16 0 "[ . 1 . 2]"
1 57 VAL 0.004 0.004 19 0 "[ . 1 . 2]"
1 58 ASN 0.004 0.003 3 0 "[ . 1 . 2]"
1 59 GLY 0.025 0.025 16 0 "[ . 1 . 2]"
1 60 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 PRO 0.009 0.005 19 0 "[ . 1 . 2]"
1 62 VAL 0.066 0.030 6 0 "[ . 1 . 2]"
1 63 GLY 0.052 0.030 6 0 "[ . 1 . 2]"
1 64 SER 0.006 0.003 19 0 "[ . 1 . 2]"
1 65 ASP 0.043 0.013 3 0 "[ . 1 . 2]"
1 66 PRO 0.069 0.023 17 0 "[ . 1 . 2]"
1 67 ARG 0.053 0.009 20 0 "[ . 1 . 2]"
1 68 ALA 0.096 0.015 19 0 "[ . 1 . 2]"
1 69 LEU 0.152 0.025 4 0 "[ . 1 . 2]"
1 70 GLN 0.057 0.015 19 0 "[ . 1 . 2]"
1 71 GLU 0.089 0.033 14 0 "[ . 1 . 2]"
1 72 LEU 0.259 0.025 4 0 "[ . 1 . 2]"
1 73 LEU 0.060 0.008 18 0 "[ . 1 . 2]"
1 74 ARG 0.033 0.033 16 0 "[ . 1 . 2]"
1 75 ASN 0.008 0.004 16 0 "[ . 1 . 2]"
1 76 ALA 0.011 0.010 16 0 "[ . 1 . 2]"
1 77 SER 0.011 0.010 16 0 "[ . 1 . 2]"
1 78 GLY 0.000 0.000 3 0 "[ . 1 . 2]"
1 79 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 VAL 0.014 0.007 15 0 "[ . 1 . 2]"
1 81 ILE 0.022 0.007 15 0 "[ . 1 . 2]"
1 82 LEU 0.004 0.002 1 0 "[ . 1 . 2]"
1 83 LYS 0.053 0.013 19 0 "[ . 1 . 2]"
1 84 ILE 1.390 0.094 19 0 "[ . 1 . 2]"
1 85 LEU 1.387 0.094 19 0 "[ . 1 . 2]"
1 86 SER 0.004 0.004 11 0 "[ . 1 . 2]"
1 87 GLY 0.004 0.004 11 0 "[ . 1 . 2]"
1 88 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 7 GLY QA 1 8 ARG H . . 3.110 2.177 2.109 2.283 . 0 0 "[ . 1 . 2]" 1
2 1 7 GLY QA 1 83 LYS QE . . 4.330 3.445 2.296 4.331 0.001 15 0 "[ . 1 . 2]" 1
3 1 7 GLY QA 1 83 LYS HG2 . . 4.300 3.332 2.468 4.283 . 0 0 "[ . 1 . 2]" 1
4 1 7 GLY QA 1 83 LYS HG3 . . 4.550 3.151 2.216 4.009 . 0 0 "[ . 1 . 2]" 1
5 1 7 GLY QA 1 85 LEU HA . . 3.720 3.275 2.401 3.721 0.001 13 0 "[ . 1 . 2]" 1
6 1 7 GLY QA 1 85 LEU QD . . 3.360 2.182 1.887 3.040 . 0 0 "[ . 1 . 2]" 1
7 1 7 GLY QA 1 85 LEU HG . . 4.580 2.596 1.988 3.559 . 0 0 "[ . 1 . 2]" 1
8 1 7 GLY HA2 1 85 LEU HA . . 4.310 3.512 2.444 4.262 . 0 0 "[ . 1 . 2]" 1
9 1 7 GLY HA3 1 85 LEU HA . . 4.310 4.084 3.515 4.310 . 0 0 "[ . 1 . 2]" 1
10 1 8 ARG H 1 8 ARG QD . . 5.500 4.649 3.924 5.215 . 0 0 "[ . 1 . 2]" 1
11 1 8 ARG H 1 8 ARG HG2 . . 5.000 4.035 2.024 5.004 0.004 11 0 "[ . 1 . 2]" 1
12 1 8 ARG H 1 8 ARG QG . . 4.220 3.619 1.965 4.131 . 0 0 "[ . 1 . 2]" 1
13 1 8 ARG H 1 8 ARG HG3 . . 5.000 4.243 2.570 4.976 . 0 0 "[ . 1 . 2]" 1
14 1 8 ARG H 1 9 MET H . . 4.650 3.875 3.250 4.422 . 0 0 "[ . 1 . 2]" 1
15 1 8 ARG H 1 84 ILE H . . 3.860 2.542 1.964 3.072 . 0 0 "[ . 1 . 2]" 1
16 1 8 ARG H 1 84 ILE HB . . 4.850 3.629 2.580 4.694 . 0 0 "[ . 1 . 2]" 1
17 1 8 ARG H 1 84 ILE QG . . 4.800 4.165 3.310 4.778 . 0 0 "[ . 1 . 2]" 1
18 1 8 ARG H 1 85 LEU QD . . 4.500 3.498 2.920 4.492 . 0 0 "[ . 1 . 2]" 1
19 1 8 ARG QB 1 8 ARG QD . . 3.180 2.191 2.050 2.596 . 0 0 "[ . 1 . 2]" 1
20 1 8 ARG QB 1 9 MET H . . 3.990 3.828 2.646 4.022 0.032 8 0 "[ . 1 . 2]" 1
21 1 8 ARG QB 1 10 VAL MG2 . . 4.200 3.549 2.575 4.069 . 0 0 "[ . 1 . 2]" 1
22 1 8 ARG QB 1 84 ILE H . . 5.250 3.185 2.475 4.909 . 0 0 "[ . 1 . 2]" 1
23 1 8 ARG QB 1 84 ILE MD . . 5.500 4.658 3.831 5.484 . 0 0 "[ . 1 . 2]" 1
24 1 8 ARG QB 1 84 ILE QG . . 4.090 3.293 2.315 4.089 . 0 0 "[ . 1 . 2]" 1
25 1 8 ARG QB 1 84 ILE MG . . 4.640 3.840 3.412 4.640 0.000 5 0 "[ . 1 . 2]" 1
26 1 8 ARG QD 1 10 VAL MG2 . . 3.810 2.976 1.946 3.808 . 0 0 "[ . 1 . 2]" 1
27 1 8 ARG QD 1 84 ILE MD . . 5.180 4.723 3.956 5.179 . 0 0 "[ . 1 . 2]" 1
28 1 8 ARG QG 1 9 MET H . . 4.360 3.570 2.568 4.370 0.010 19 0 "[ . 1 . 2]" 1
29 1 8 ARG QG 1 84 ILE HB . . 4.280 3.270 1.795 4.188 . 0 0 "[ . 1 . 2]" 1
30 1 8 ARG QG 1 84 ILE QG . . 4.120 3.335 2.023 4.121 0.001 19 0 "[ . 1 . 2]" 1
31 1 8 ARG HG2 1 9 MET H . . 5.140 4.152 2.803 5.040 . 0 0 "[ . 1 . 2]" 1
32 1 8 ARG HG3 1 9 MET H . . 5.140 3.971 2.980 5.085 . 0 0 "[ . 1 . 2]" 1
33 1 9 MET H 1 9 MET QB . . 3.580 2.315 2.112 2.523 . 0 0 "[ . 1 . 2]" 1
34 1 9 MET H 1 9 MET HG2 . . 4.440 3.621 2.535 4.507 0.067 15 0 "[ . 1 . 2]" 1
35 1 9 MET H 1 9 MET QG . . 3.740 3.061 2.379 3.753 0.013 15 0 "[ . 1 . 2]" 1
36 1 9 MET H 1 9 MET HG3 . . 4.440 3.485 2.461 4.260 . 0 0 "[ . 1 . 2]" 1
37 1 9 MET HA 1 9 MET ME . . 4.120 3.799 2.689 4.098 . 0 0 "[ . 1 . 2]" 1
38 1 9 MET HA 1 9 MET HG2 . . 3.650 2.919 2.171 3.641 . 0 0 "[ . 1 . 2]" 1
39 1 9 MET HA 1 9 MET HG3 . . 3.650 2.982 2.212 3.667 0.017 20 0 "[ . 1 . 2]" 1
40 1 9 MET HA 1 10 VAL H . . 2.880 2.163 2.141 2.224 . 0 0 "[ . 1 . 2]" 1
41 1 9 MET HA 1 10 VAL HA . . 5.050 4.408 4.395 4.437 . 0 0 "[ . 1 . 2]" 1
42 1 9 MET HA 1 10 VAL MG2 . . 4.270 3.851 3.681 4.087 . 0 0 "[ . 1 . 2]" 1
43 1 9 MET HA 1 81 ILE QG . . 5.340 5.242 4.973 5.345 0.005 15 0 "[ . 1 . 2]" 1
44 1 9 MET HA 1 81 ILE MG . . 4.220 2.939 2.544 3.364 . 0 0 "[ . 1 . 2]" 1
45 1 9 MET HA 1 82 LEU H . . 5.090 3.556 3.054 4.219 . 0 0 "[ . 1 . 2]" 1
46 1 9 MET HA 1 83 LYS HA . . 3.470 2.873 2.388 3.082 . 0 0 "[ . 1 . 2]" 1
47 1 9 MET HA 1 83 LYS QB . . 5.320 4.327 3.847 4.715 . 0 0 "[ . 1 . 2]" 1
48 1 9 MET HA 1 84 ILE H . . 4.220 3.927 3.588 4.215 . 0 0 "[ . 1 . 2]" 1
49 1 9 MET QB 1 9 MET ME . . 4.260 3.452 2.703 3.698 . 0 0 "[ . 1 . 2]" 1
50 1 9 MET HB2 1 10 VAL H . . 5.070 4.431 4.153 4.631 . 0 0 "[ . 1 . 2]" 1
51 1 9 MET HB2 1 81 ILE MG . . 4.190 3.955 3.596 4.180 . 0 0 "[ . 1 . 2]" 1
52 1 9 MET HB2 1 83 LYS HA . . 5.500 5.321 3.827 5.503 0.003 8 0 "[ . 1 . 2]" 1
53 1 9 MET HB3 1 10 VAL H . . 5.070 3.621 3.087 4.277 . 0 0 "[ . 1 . 2]" 1
54 1 9 MET HB3 1 81 ILE MG . . 4.190 2.674 2.192 3.897 . 0 0 "[ . 1 . 2]" 1
55 1 9 MET HB3 1 83 LYS HA . . 5.500 5.162 4.699 5.502 0.002 1 0 "[ . 1 . 2]" 1
56 1 9 MET ME 1 81 ILE MG . . 3.170 2.629 1.880 3.169 . 0 0 "[ . 1 . 2]" 1
57 1 9 MET ME 1 83 LYS HA . . 4.310 3.603 2.025 4.312 0.002 15 0 "[ . 1 . 2]" 1
58 1 9 MET ME 1 83 LYS QD . . 3.830 2.525 1.972 3.828 . 0 0 "[ . 1 . 2]" 1
59 1 9 MET ME 1 83 LYS HE2 . . 4.530 3.705 1.859 4.403 . 0 0 "[ . 1 . 2]" 1
60 1 9 MET ME 1 83 LYS QE . . 3.850 2.838 1.840 3.851 0.001 18 0 "[ . 1 . 2]" 1
61 1 9 MET ME 1 83 LYS HE3 . . 4.530 3.099 2.103 4.487 . 0 0 "[ . 1 . 2]" 1
62 1 9 MET ME 1 83 LYS HG3 . . 4.720 2.976 2.016 3.978 . 0 0 "[ . 1 . 2]" 1
63 1 9 MET QG 1 10 VAL H . . 4.530 4.145 3.584 4.540 0.010 10 0 "[ . 1 . 2]" 1
64 1 9 MET QG 1 81 ILE MG . . 3.320 2.580 1.780 3.183 . 0 0 "[ . 1 . 2]" 1
65 1 10 VAL H 1 10 VAL HB . . 3.530 2.573 2.476 2.700 . 0 0 "[ . 1 . 2]" 1
66 1 10 VAL H 1 10 VAL MG2 . . 3.500 2.716 2.412 3.171 . 0 0 "[ . 1 . 2]" 1
67 1 10 VAL H 1 81 ILE MG . . 4.150 3.175 2.816 3.625 . 0 0 "[ . 1 . 2]" 1
68 1 10 VAL H 1 82 LEU H . . 4.020 2.426 2.108 2.848 . 0 0 "[ . 1 . 2]" 1
69 1 10 VAL H 1 82 LEU HB2 . . 4.900 3.272 2.850 3.703 . 0 0 "[ . 1 . 2]" 1
70 1 10 VAL H 1 82 LEU QB . . 4.210 3.199 2.809 3.585 . 0 0 "[ . 1 . 2]" 1
71 1 10 VAL H 1 82 LEU HB3 . . 4.900 4.565 4.211 4.902 0.002 6 0 "[ . 1 . 2]" 1
72 1 10 VAL H 1 83 LYS HA . . 4.310 4.107 3.782 4.312 0.002 10 0 "[ . 1 . 2]" 1
73 1 10 VAL H 1 84 ILE QG . . 4.700 4.041 3.539 4.533 . 0 0 "[ . 1 . 2]" 1
74 1 10 VAL HA 1 10 VAL MG1 . . 3.390 2.404 2.287 2.476 . 0 0 "[ . 1 . 2]" 1
75 1 10 VAL HA 1 10 VAL MG2 . . 2.970 2.318 2.234 2.458 . 0 0 "[ . 1 . 2]" 1
76 1 10 VAL HA 1 11 GLY H . . 2.910 2.150 2.144 2.172 . 0 0 "[ . 1 . 2]" 1
77 1 10 VAL HA 1 11 GLY HA2 . . 4.970 4.389 4.375 4.408 . 0 0 "[ . 1 . 2]" 1
78 1 10 VAL HA 1 11 GLY QA . . 4.270 3.905 3.893 3.924 . 0 0 "[ . 1 . 2]" 1
79 1 10 VAL HA 1 11 GLY HA3 . . 4.970 4.377 4.358 4.402 . 0 0 "[ . 1 . 2]" 1
80 1 10 VAL HB 1 11 GLY H . . 4.780 4.252 4.139 4.397 . 0 0 "[ . 1 . 2]" 1
81 1 10 VAL HB 1 82 LEU H . . 4.940 3.494 3.255 3.891 . 0 0 "[ . 1 . 2]" 1
82 1 10 VAL HB 1 82 LEU QB . . 4.200 2.544 2.068 3.127 . 0 0 "[ . 1 . 2]" 1
83 1 10 VAL HB 1 84 ILE QG . . 4.110 3.984 3.662 4.113 0.003 15 0 "[ . 1 . 2]" 1
84 1 10 VAL MG1 1 11 GLY H . . 3.720 2.651 2.422 3.025 . 0 0 "[ . 1 . 2]" 1
85 1 10 VAL MG2 1 11 GLY H . . 4.340 4.049 3.950 4.170 . 0 0 "[ . 1 . 2]" 1
86 1 10 VAL MG2 1 82 LEU H . . 5.500 4.433 4.075 4.765 . 0 0 "[ . 1 . 2]" 1
87 1 10 VAL MG2 1 84 ILE H . . 4.740 4.316 3.747 4.734 . 0 0 "[ . 1 . 2]" 1
88 1 10 VAL MG2 1 84 ILE QG . . 3.120 2.689 2.271 3.092 . 0 0 "[ . 1 . 2]" 1
89 1 11 GLY QA 1 12 ILE H . . 2.950 2.124 2.110 2.171 . 0 0 "[ . 1 . 2]" 1
90 1 11 GLY QA 1 81 ILE MD . . 3.570 2.756 2.071 3.241 . 0 0 "[ . 1 . 2]" 1
91 1 11 GLY QA 1 81 ILE QG . . 5.160 3.459 2.786 4.206 . 0 0 "[ . 1 . 2]" 1
92 1 11 GLY QA 1 82 LEU H . . 4.390 4.150 3.679 4.392 0.002 1 0 "[ . 1 . 2]" 1
93 1 11 GLY HA2 1 12 ILE H . . 3.510 2.159 2.138 2.231 . 0 0 "[ . 1 . 2]" 1
94 1 11 GLY HA2 1 81 ILE MD . . 4.190 2.860 2.189 3.390 . 0 0 "[ . 1 . 2]" 1
95 1 11 GLY HA3 1 12 ILE H . . 3.510 3.183 2.976 3.325 . 0 0 "[ . 1 . 2]" 1
96 1 11 GLY HA3 1 81 ILE MD . . 4.190 3.625 2.556 4.183 . 0 0 "[ . 1 . 2]" 1
97 1 12 ILE H 1 12 ILE HB . . 3.770 2.712 2.531 2.976 . 0 0 "[ . 1 . 2]" 1
98 1 12 ILE H 1 12 ILE HG12 . . 4.370 4.071 2.570 4.371 0.001 4 0 "[ . 1 . 2]" 1
99 1 12 ILE H 1 12 ILE QG . . 3.820 2.980 2.545 3.474 . 0 0 "[ . 1 . 2]" 1
100 1 12 ILE H 1 12 ILE HG13 . . 4.370 3.146 2.584 4.088 . 0 0 "[ . 1 . 2]" 1
101 1 12 ILE H 1 12 ILE MG . . 4.180 3.878 3.801 3.965 . 0 0 "[ . 1 . 2]" 1
102 1 12 ILE H 1 80 VAL H . . 3.850 2.925 2.614 3.450 . 0 0 "[ . 1 . 2]" 1
103 1 12 ILE H 1 80 VAL HB . . 4.370 3.420 3.038 3.667 . 0 0 "[ . 1 . 2]" 1
104 1 12 ILE H 1 80 VAL MG1 . . 5.040 4.371 4.146 4.721 . 0 0 "[ . 1 . 2]" 1
105 1 12 ILE H 1 81 ILE MD . . 4.550 3.866 3.460 4.317 . 0 0 "[ . 1 . 2]" 1
106 1 12 ILE HA 1 12 ILE MD . . 4.600 3.554 2.137 3.949 . 0 0 "[ . 1 . 2]" 1
107 1 12 ILE HA 1 12 ILE QG . . 3.690 2.469 2.286 3.160 . 0 0 "[ . 1 . 2]" 1
108 1 12 ILE HA 1 12 ILE MG . . 3.700 2.350 2.142 2.450 . 0 0 "[ . 1 . 2]" 1
109 1 12 ILE HA 1 13 ARG H . . 3.020 2.198 2.147 2.316 . 0 0 "[ . 1 . 2]" 1
110 1 12 ILE HA 1 13 ARG HA . . 5.100 4.379 4.370 4.418 . 0 0 "[ . 1 . 2]" 1
111 1 12 ILE HA 1 45 GLN QE . . 4.860 4.388 2.492 4.856 . 0 0 "[ . 1 . 2]" 1
112 1 12 ILE HA 1 80 VAL HB . . 5.500 5.272 4.688 5.499 . 0 0 "[ . 1 . 2]" 1
113 1 12 ILE HB 1 12 ILE MD . . 3.620 2.311 2.115 3.216 . 0 0 "[ . 1 . 2]" 1
114 1 12 ILE HB 1 13 ARG H . . 4.020 3.974 3.742 4.030 0.010 18 0 "[ . 1 . 2]" 1
115 1 12 ILE HB 1 14 LYS H . . 4.720 3.531 3.233 4.633 . 0 0 "[ . 1 . 2]" 1
116 1 12 ILE HB 1 80 VAL H . . 5.090 3.612 2.806 4.384 . 0 0 "[ . 1 . 2]" 1
117 1 12 ILE HB 1 80 VAL HB . . 3.730 2.671 2.051 3.003 . 0 0 "[ . 1 . 2]" 1
118 1 12 ILE MD 1 80 VAL HB . . 4.130 3.325 2.305 3.866 . 0 0 "[ . 1 . 2]" 1
119 1 12 ILE MD 1 82 LEU HG . . 3.450 2.994 2.415 3.405 . 0 0 "[ . 1 . 2]" 1
120 1 12 ILE QG 1 12 ILE MG . . 3.280 2.100 1.954 2.327 . 0 0 "[ . 1 . 2]" 1
121 1 12 ILE QG 1 80 VAL HB . . 4.850 4.255 2.178 4.748 . 0 0 "[ . 1 . 2]" 1
122 1 12 ILE MG 1 13 ARG H . . 3.950 2.159 1.888 2.763 . 0 0 "[ . 1 . 2]" 1
123 1 12 ILE MG 1 13 ARG HA . . 4.320 3.810 3.507 4.217 . 0 0 "[ . 1 . 2]" 1
124 1 12 ILE MG 1 14 LYS HA . . 4.870 3.557 3.323 3.926 . 0 0 "[ . 1 . 2]" 1
125 1 12 ILE MG 1 14 LYS HB2 . . 4.590 3.660 3.402 4.120 . 0 0 "[ . 1 . 2]" 1
126 1 12 ILE MG 1 14 LYS QB . . 3.860 2.164 1.912 2.677 . 0 0 "[ . 1 . 2]" 1
127 1 12 ILE MG 1 14 LYS HB3 . . 4.590 2.180 1.922 2.712 . 0 0 "[ . 1 . 2]" 1
128 1 12 ILE MG 1 14 LYS HE2 . . 5.060 4.732 4.277 5.055 . 0 0 "[ . 1 . 2]" 1
129 1 12 ILE MG 1 14 LYS HE3 . . 5.060 4.194 2.993 5.065 0.005 18 0 "[ . 1 . 2]" 1
130 1 12 ILE MG 1 14 LYS QG . . 4.180 2.964 2.218 3.733 . 0 0 "[ . 1 . 2]" 1
131 1 12 ILE MG 1 45 GLN QE . . 4.790 3.382 1.908 4.530 . 0 0 "[ . 1 . 2]" 1
132 1 13 ARG H 1 13 ARG HB2 . . 3.940 3.008 2.298 3.719 . 0 0 "[ . 1 . 2]" 1
133 1 13 ARG H 1 13 ARG QB . . 3.390 2.552 2.271 2.995 . 0 0 "[ . 1 . 2]" 1
134 1 13 ARG H 1 13 ARG HB3 . . 3.940 3.057 2.492 3.697 . 0 0 "[ . 1 . 2]" 1
135 1 13 ARG H 1 13 ARG QG . . 4.570 3.088 1.893 4.131 . 0 0 "[ . 1 . 2]" 1
136 1 13 ARG HA 1 13 ARG QD . . 4.400 3.655 2.253 4.403 0.003 5 0 "[ . 1 . 2]" 1
137 1 13 ARG HA 1 13 ARG QG . . 3.770 2.764 2.196 3.401 . 0 0 "[ . 1 . 2]" 1
138 1 13 ARG HA 1 14 LYS H . . 3.110 2.677 2.240 2.930 . 0 0 "[ . 1 . 2]" 1
139 1 13 ARG HA 1 14 LYS QG . . 5.100 4.365 3.983 4.647 . 0 0 "[ . 1 . 2]" 1
140 1 13 ARG HA 1 79 SER HA . . 4.330 3.282 2.652 3.962 . 0 0 "[ . 1 . 2]" 1
141 1 13 ARG HA 1 80 VAL H . . 4.470 4.022 3.610 4.458 . 0 0 "[ . 1 . 2]" 1
142 1 13 ARG HB2 1 14 LYS H . . 4.740 4.455 4.153 4.649 . 0 0 "[ . 1 . 2]" 1
143 1 13 ARG HB3 1 14 LYS H . . 4.740 4.444 4.090 4.662 . 0 0 "[ . 1 . 2]" 1
144 1 13 ARG QG 1 14 LYS H . . 4.720 4.185 3.587 4.733 0.013 18 0 "[ . 1 . 2]" 1
145 1 14 LYS H 1 14 LYS HG2 . . 4.260 2.368 1.962 2.826 . 0 0 "[ . 1 . 2]" 1
146 1 14 LYS H 1 14 LYS QG . . 3.630 2.299 1.949 2.758 . 0 0 "[ . 1 . 2]" 1
147 1 14 LYS H 1 14 LYS HG3 . . 4.260 3.314 2.625 3.839 . 0 0 "[ . 1 . 2]" 1
148 1 14 LYS H 1 80 VAL MG2 . . 4.460 3.914 3.540 4.346 . 0 0 "[ . 1 . 2]" 1
149 1 14 LYS HA 1 14 LYS HE2 . . 5.500 4.738 4.053 5.554 0.054 15 0 "[ . 1 . 2]" 1
150 1 14 LYS HA 1 14 LYS QE . . 4.640 4.182 3.956 4.568 . 0 0 "[ . 1 . 2]" 1
151 1 14 LYS HA 1 14 LYS HE3 . . 5.500 4.987 4.269 5.546 0.046 18 0 "[ . 1 . 2]" 1
152 1 14 LYS HA 1 14 LYS QG . . 3.680 3.326 3.269 3.343 . 0 0 "[ . 1 . 2]" 1
153 1 14 LYS HA 1 15 THR H . . 3.330 2.493 2.241 2.652 . 0 0 "[ . 1 . 2]" 1
154 1 14 LYS HA 1 41 MET ME . . 4.160 2.840 2.036 3.501 . 0 0 "[ . 1 . 2]" 1
155 1 14 LYS QB 1 14 LYS QE . . 3.140 2.059 1.908 2.364 . 0 0 "[ . 1 . 2]" 1
156 1 14 LYS QB 1 15 THR H . . 3.320 2.323 1.920 2.896 . 0 0 "[ . 1 . 2]" 1
157 1 14 LYS QB 1 18 GLU QB . . 4.450 2.867 2.239 4.103 . 0 0 "[ . 1 . 2]" 1
158 1 14 LYS QB 1 20 LEU QD . . 4.620 3.485 2.785 4.102 . 0 0 "[ . 1 . 2]" 1
159 1 14 LYS QB 1 41 MET ME . . 3.730 2.116 1.787 2.539 . 0 0 "[ . 1 . 2]" 1
160 1 14 LYS HB2 1 14 LYS HE2 . . 4.250 2.502 1.990 3.225 . 0 0 "[ . 1 . 2]" 1
161 1 14 LYS HB2 1 14 LYS HE3 . . 4.250 2.798 2.271 3.268 . 0 0 "[ . 1 . 2]" 1
162 1 14 LYS HB2 1 15 THR H . . 4.170 2.347 1.930 2.954 . 0 0 "[ . 1 . 2]" 1
163 1 14 LYS HB3 1 14 LYS HE2 . . 4.250 3.486 2.705 3.804 . 0 0 "[ . 1 . 2]" 1
164 1 14 LYS HB3 1 14 LYS HE3 . . 4.250 3.183 2.084 4.231 . 0 0 "[ . 1 . 2]" 1
165 1 14 LYS HB3 1 15 THR H . . 4.170 3.762 3.418 4.166 . 0 0 "[ . 1 . 2]" 1
166 1 14 LYS QD 1 20 LEU QD . . 4.170 2.875 1.949 4.057 . 0 0 "[ . 1 . 2]" 1
167 1 14 LYS QD 1 76 ALA MB . . 3.540 3.079 2.353 3.524 . 0 0 "[ . 1 . 2]" 1
168 1 14 LYS QD 1 77 SER HA . . 4.790 4.194 3.362 4.718 . 0 0 "[ . 1 . 2]" 1
169 1 14 LYS QD 1 80 VAL MG2 . . 3.570 2.776 1.998 3.360 . 0 0 "[ . 1 . 2]" 1
170 1 14 LYS QE 1 15 THR H . . 4.950 3.608 2.587 4.469 . 0 0 "[ . 1 . 2]" 1
171 1 14 LYS QE 1 18 GLU QB . . 3.660 2.715 1.886 3.600 . 0 0 "[ . 1 . 2]" 1
172 1 14 LYS QE 1 20 LEU QD . . 3.400 2.300 1.880 2.832 . 0 0 "[ . 1 . 2]" 1
173 1 14 LYS QE 1 74 ARG HA . . 4.290 3.695 2.800 4.288 . 0 0 "[ . 1 . 2]" 1
174 1 14 LYS HE2 1 18 GLU QB . . 4.230 2.931 1.939 4.220 . 0 0 "[ . 1 . 2]" 1
175 1 14 LYS HE2 1 20 LEU MD1 . . 5.200 4.141 2.594 5.201 0.001 3 0 "[ . 1 . 2]" 1
176 1 14 LYS HE2 1 20 LEU MD2 . . 5.200 4.169 2.223 5.200 0.000 14 0 "[ . 1 . 2]" 1
177 1 14 LYS HE3 1 18 GLU QB . . 4.230 3.467 2.578 4.066 . 0 0 "[ . 1 . 2]" 1
178 1 14 LYS HE3 1 20 LEU MD1 . . 5.200 3.188 1.904 4.851 . 0 0 "[ . 1 . 2]" 1
179 1 14 LYS HE3 1 20 LEU MD2 . . 5.200 3.348 2.043 4.725 . 0 0 "[ . 1 . 2]" 1
180 1 14 LYS QG 1 18 GLU QB . . 5.340 4.046 3.136 5.314 . 0 0 "[ . 1 . 2]" 1
181 1 14 LYS QG 1 77 SER HA . . 3.560 3.034 2.646 3.527 . 0 0 "[ . 1 . 2]" 1
182 1 14 LYS QG 1 78 GLY H . . 4.550 3.903 3.466 4.399 . 0 0 "[ . 1 . 2]" 1
183 1 14 LYS QG 1 80 VAL MG2 . . 3.350 2.554 2.230 2.931 . 0 0 "[ . 1 . 2]" 1
184 1 14 LYS HG2 1 78 GLY H . . 5.260 4.799 3.673 5.260 . 3 0 "[ . 1 . 2]" 1
185 1 14 LYS HG2 1 80 VAL MG2 . . 3.860 2.653 2.272 3.109 . 0 0 "[ . 1 . 2]" 1
186 1 14 LYS HG3 1 78 GLY H . . 5.260 4.188 3.640 4.843 . 0 0 "[ . 1 . 2]" 1
187 1 14 LYS HG3 1 80 VAL MG2 . . 3.860 3.419 2.961 3.800 . 0 0 "[ . 1 . 2]" 1
188 1 15 THR H 1 15 THR HB . . 3.950 2.876 2.551 3.852 . 0 0 "[ . 1 . 2]" 1
189 1 15 THR H 1 15 THR MG . . 4.040 3.427 2.146 3.936 . 0 0 "[ . 1 . 2]" 1
190 1 15 THR H 1 18 GLU QB . . 3.990 2.797 2.041 3.921 . 0 0 "[ . 1 . 2]" 1
191 1 15 THR H 1 18 GLU HG2 . . 5.500 3.642 2.225 5.215 . 0 0 "[ . 1 . 2]" 1
192 1 15 THR H 1 18 GLU QG . . 4.840 2.792 1.902 4.028 . 0 0 "[ . 1 . 2]" 1
193 1 15 THR H 1 18 GLU HG3 . . 5.500 3.221 1.922 4.776 . 0 0 "[ . 1 . 2]" 1
194 1 15 THR HB 1 16 ALA MB . . 5.170 4.935 4.134 5.206 0.036 1 0 "[ . 1 . 2]" 1
195 1 15 THR HB 1 18 GLU QB . . 4.660 4.082 1.971 4.660 0.000 3 0 "[ . 1 . 2]" 1
196 1 15 THR HB 1 18 GLU QG . . 4.420 3.315 2.193 4.423 0.003 1 0 "[ . 1 . 2]" 1
197 1 15 THR MG 1 16 ALA H . . 4.090 2.559 1.877 4.045 . 0 0 "[ . 1 . 2]" 1
198 1 15 THR MG 1 18 GLU QB . . 5.500 4.119 1.786 5.252 . 0 0 "[ . 1 . 2]" 1
199 1 15 THR MG 1 18 GLU HG2 . . 5.070 3.966 1.880 5.072 0.002 19 0 "[ . 1 . 2]" 1
200 1 15 THR MG 1 18 GLU HG3 . . 5.070 4.314 2.070 5.073 0.003 19 0 "[ . 1 . 2]" 1
201 1 16 ALA HA 1 17 GLY H . . 3.380 2.188 2.145 2.448 . 0 0 "[ . 1 . 2]" 1
202 1 16 ALA HA 1 18 GLU H . . 4.940 4.154 3.393 4.676 . 0 0 "[ . 1 . 2]" 1
203 1 16 ALA HA 1 75 ASN HA . . 5.000 3.902 3.178 4.481 . 0 0 "[ . 1 . 2]" 1
204 1 16 ALA HA 1 77 SER HA . . 5.310 3.566 3.080 4.164 . 0 0 "[ . 1 . 2]" 1
205 1 16 ALA HA 1 77 SER HB2 . . 4.660 2.743 2.115 3.269 . 0 0 "[ . 1 . 2]" 1
206 1 16 ALA HA 1 77 SER QB . . 3.920 2.717 2.105 3.208 . 0 0 "[ . 1 . 2]" 1
207 1 16 ALA HA 1 77 SER HB3 . . 4.660 4.427 3.804 4.657 . 0 0 "[ . 1 . 2]" 1
208 1 16 ALA MB 1 17 GLY H . . 4.250 3.204 2.305 3.564 . 0 0 "[ . 1 . 2]" 1
209 1 16 ALA MB 1 17 GLY HA2 . . 5.050 4.386 4.093 4.631 . 0 0 "[ . 1 . 2]" 1
210 1 16 ALA MB 1 17 GLY QA . . 4.400 3.713 3.482 3.843 . 0 0 "[ . 1 . 2]" 1
211 1 16 ALA MB 1 17 GLY HA3 . . 5.050 4.013 3.769 4.224 . 0 0 "[ . 1 . 2]" 1
212 1 16 ALA MB 1 75 ASN HA . . 4.330 3.908 2.821 4.331 0.001 1 0 "[ . 1 . 2]" 1
213 1 16 ALA MB 1 77 SER HA . . 4.180 3.923 3.556 4.178 . 0 0 "[ . 1 . 2]" 1
214 1 16 ALA MB 1 77 SER HB2 . . 3.630 2.130 1.984 2.331 . 0 0 "[ . 1 . 2]" 1
215 1 16 ALA MB 1 77 SER QB . . 3.170 2.102 1.956 2.302 . 0 0 "[ . 1 . 2]" 1
216 1 16 ALA MB 1 77 SER HB3 . . 3.630 3.257 2.961 3.582 . 0 0 "[ . 1 . 2]" 1
217 1 17 GLY H 1 18 GLU H . . 4.130 2.905 2.003 3.599 . 0 0 "[ . 1 . 2]" 1
218 1 17 GLY H 1 75 ASN HA . . 4.300 3.520 2.534 4.255 . 0 0 "[ . 1 . 2]" 1
219 1 17 GLY QA 1 74 ARG HG2 . . 3.940 2.953 2.281 3.591 . 0 0 "[ . 1 . 2]" 1
220 1 17 GLY QA 1 74 ARG HG3 . . 4.320 3.251 2.350 3.947 . 0 0 "[ . 1 . 2]" 1
221 1 17 GLY QA 1 75 ASN HA . . 4.940 4.383 3.708 4.942 0.002 12 0 "[ . 1 . 2]" 1
222 1 18 GLU H 1 18 GLU QB . . 3.420 2.403 2.123 2.723 . 0 0 "[ . 1 . 2]" 1
223 1 18 GLU H 1 18 GLU HG2 . . 4.930 3.333 1.993 4.621 . 0 0 "[ . 1 . 2]" 1
224 1 18 GLU H 1 18 GLU QG . . 4.080 3.115 1.975 4.029 . 0 0 "[ . 1 . 2]" 1
225 1 18 GLU H 1 18 GLU HG3 . . 4.930 3.993 2.522 4.625 . 0 0 "[ . 1 . 2]" 1
226 1 18 GLU HA 1 18 GLU HG2 . . 3.920 2.919 2.317 3.826 . 0 0 "[ . 1 . 2]" 1
227 1 18 GLU HA 1 18 GLU HG3 . . 3.920 3.407 2.426 3.802 . 0 0 "[ . 1 . 2]" 1
228 1 18 GLU HA 1 19 HIS QB . . 4.900 4.226 3.955 4.654 . 0 0 "[ . 1 . 2]" 1
229 1 18 GLU QB 1 19 HIS H . . 4.900 3.125 2.169 3.836 . 0 0 "[ . 1 . 2]" 1
230 1 19 HIS HA 1 19 HIS HD2 . . 5.170 4.057 2.998 4.647 . 0 0 "[ . 1 . 2]" 1
231 1 19 HIS HA 1 74 ARG HA . . 4.230 3.526 2.670 3.874 . 0 0 "[ . 1 . 2]" 1
232 1 19 HIS HA 1 74 ARG QB . . 4.450 4.092 3.376 4.368 . 0 0 "[ . 1 . 2]" 1
233 1 19 HIS HA 1 74 ARG HG3 . . 4.280 3.943 2.862 4.278 . 0 0 "[ . 1 . 2]" 1
234 1 19 HIS QB 1 21 GLY H . . 4.490 3.665 2.543 4.428 . 0 0 "[ . 1 . 2]" 1
235 1 19 HIS HE1 1 74 ARG HD2 . . 5.260 3.089 2.047 4.355 . 0 0 "[ . 1 . 2]" 1
236 1 19 HIS HE1 1 74 ARG QD . . 4.530 2.956 2.037 3.745 . 0 0 "[ . 1 . 2]" 1
237 1 19 HIS HE1 1 74 ARG HD3 . . 5.260 4.264 3.491 5.231 . 0 0 "[ . 1 . 2]" 1
238 1 20 LEU H 1 20 LEU HG . . 5.000 3.794 2.365 4.336 . 0 0 "[ . 1 . 2]" 1
239 1 20 LEU HA 1 20 LEU MD1 . . 3.980 2.625 1.962 3.674 . 0 0 "[ . 1 . 2]" 1
240 1 20 LEU HA 1 20 LEU QD . . 3.130 2.352 1.912 2.942 . 0 0 "[ . 1 . 2]" 1
241 1 20 LEU HA 1 20 LEU MD2 . . 3.980 2.992 1.966 3.814 . 0 0 "[ . 1 . 2]" 1
242 1 20 LEU HA 1 20 LEU HG . . 4.190 3.110 2.343 3.717 . 0 0 "[ . 1 . 2]" 1
243 1 20 LEU HA 1 41 MET HB2 . . 3.900 3.232 2.729 3.748 . 0 0 "[ . 1 . 2]" 1
244 1 20 LEU HA 1 41 MET HB3 . . 4.100 2.542 2.146 3.032 . 0 0 "[ . 1 . 2]" 1
245 1 20 LEU HA 1 41 MET ME . . 4.530 4.053 2.907 4.529 . 0 0 "[ . 1 . 2]" 1
246 1 20 LEU HA 1 41 MET HG2 . . 5.170 4.037 3.560 4.512 . 0 0 "[ . 1 . 2]" 1
247 1 20 LEU HA 1 41 MET QG . . 4.410 3.866 3.441 4.242 . 0 0 "[ . 1 . 2]" 1
248 1 20 LEU HA 1 41 MET HG3 . . 5.170 4.978 4.326 5.173 0.003 12 0 "[ . 1 . 2]" 1
249 1 20 LEU HA 1 42 VAL H . . 5.170 3.966 3.506 4.811 . 0 0 "[ . 1 . 2]" 1
250 1 20 LEU HA 1 42 VAL QG . . 4.310 3.986 3.278 4.305 . 0 0 "[ . 1 . 2]" 1
251 1 20 LEU QB 1 22 VAL MG2 . . 3.580 2.575 2.101 2.815 . 0 0 "[ . 1 . 2]" 1
252 1 20 LEU QB 1 42 VAL QG . . 3.260 2.540 1.971 3.067 . 0 0 "[ . 1 . 2]" 1
253 1 20 LEU HB2 1 22 VAL H . . 5.200 3.952 3.392 4.614 . 0 0 "[ . 1 . 2]" 1
254 1 20 LEU HB2 1 22 VAL MG1 . . 4.350 3.767 3.174 4.150 . 0 0 "[ . 1 . 2]" 1
255 1 20 LEU HB2 1 22 VAL MG2 . . 4.080 2.933 2.612 3.361 . 0 0 "[ . 1 . 2]" 1
256 1 20 LEU HB3 1 22 VAL H . . 5.200 4.316 3.295 5.172 . 0 0 "[ . 1 . 2]" 1
257 1 20 LEU HB3 1 22 VAL MG1 . . 4.350 2.874 2.376 3.482 . 0 0 "[ . 1 . 2]" 1
258 1 20 LEU HB3 1 22 VAL MG2 . . 4.080 2.951 2.213 4.069 . 0 0 "[ . 1 . 2]" 1
259 1 20 LEU QD 1 22 VAL MG2 . . 3.760 3.347 2.678 3.761 0.001 8 0 "[ . 1 . 2]" 1
260 1 20 LEU QD 1 24 PHE HZ . . 4.960 4.494 3.652 4.958 . 0 0 "[ . 1 . 2]" 1
261 1 20 LEU QD 1 41 MET HB2 . . 3.980 3.301 2.406 3.981 0.001 18 0 "[ . 1 . 2]" 1
262 1 20 LEU QD 1 41 MET HB3 . . 4.080 2.528 1.781 3.309 . 0 0 "[ . 1 . 2]" 1
263 1 20 LEU QD 1 41 MET ME . . 4.150 2.993 2.319 3.864 . 0 0 "[ . 1 . 2]" 1
264 1 20 LEU QD 1 41 MET QG . . 4.360 2.301 1.848 2.935 . 0 0 "[ . 1 . 2]" 1
265 1 20 LEU MD1 1 41 MET HB2 . . 4.600 3.696 2.486 4.595 . 0 0 "[ . 1 . 2]" 1
266 1 20 LEU MD1 1 41 MET HB3 . . 4.720 2.990 1.784 4.448 . 0 0 "[ . 1 . 2]" 1
267 1 20 LEU MD1 1 41 MET ME . . 4.870 3.316 2.611 4.347 . 0 0 "[ . 1 . 2]" 1
268 1 20 LEU MD2 1 41 MET HB2 . . 4.600 4.169 2.426 4.596 . 0 0 "[ . 1 . 2]" 1
269 1 20 LEU MD2 1 41 MET HB3 . . 4.720 3.472 2.152 4.291 . 0 0 "[ . 1 . 2]" 1
270 1 20 LEU MD2 1 41 MET ME . . 4.870 3.674 2.338 4.328 . 0 0 "[ . 1 . 2]" 1
271 1 20 LEU HG 1 22 VAL MG2 . . 5.200 4.334 3.435 5.202 0.002 18 0 "[ . 1 . 2]" 1
272 1 20 LEU HG 1 42 VAL QG . . 3.980 3.777 3.363 3.979 . 0 0 "[ . 1 . 2]" 1
273 1 21 GLY H 1 22 VAL H . . 3.830 2.523 2.070 2.946 . 0 0 "[ . 1 . 2]" 1
274 1 21 GLY QA 1 22 VAL MG1 . . 4.950 3.599 3.458 3.722 . 0 0 "[ . 1 . 2]" 1
275 1 21 GLY QA 1 37 LEU HB3 . . 4.470 3.675 3.118 4.259 . 0 0 "[ . 1 . 2]" 1
276 1 21 GLY QA 1 37 LEU QD . . 3.600 2.858 1.994 3.567 . 0 0 "[ . 1 . 2]" 1
277 1 21 GLY HA2 1 37 LEU H . . 5.190 4.621 4.245 5.003 . 0 0 "[ . 1 . 2]" 1
278 1 21 GLY HA2 1 37 LEU HB2 . . 4.200 3.330 2.646 4.025 . 0 0 "[ . 1 . 2]" 1
279 1 21 GLY HA3 1 37 LEU H . . 5.190 4.252 3.911 4.604 . 0 0 "[ . 1 . 2]" 1
280 1 21 GLY HA3 1 37 LEU HB2 . . 4.200 2.845 2.304 3.626 . 0 0 "[ . 1 . 2]" 1
281 1 22 VAL H 1 22 VAL HB . . 4.180 3.893 3.815 3.983 . 0 0 "[ . 1 . 2]" 1
282 1 22 VAL H 1 22 VAL MG1 . . 4.250 3.141 2.935 3.276 . 0 0 "[ . 1 . 2]" 1
283 1 22 VAL H 1 22 VAL MG2 . . 3.760 2.392 2.237 2.515 . 0 0 "[ . 1 . 2]" 1
284 1 22 VAL H 1 23 THR H . . 4.940 4.392 4.290 4.464 . 0 0 "[ . 1 . 2]" 1
285 1 22 VAL H 1 23 THR MG . . 4.780 4.381 3.985 4.721 . 0 0 "[ . 1 . 2]" 1
286 1 22 VAL H 1 37 LEU QD . . 4.400 3.674 3.225 4.269 . 0 0 "[ . 1 . 2]" 1
287 1 22 VAL HA 1 22 VAL MG1 . . 3.380 2.263 2.160 2.395 . 0 0 "[ . 1 . 2]" 1
288 1 22 VAL HA 1 22 VAL MG2 . . 3.650 3.196 3.180 3.202 . 0 0 "[ . 1 . 2]" 1
289 1 22 VAL HA 1 23 THR H . . 3.030 2.368 2.209 2.557 . 0 0 "[ . 1 . 2]" 1
290 1 22 VAL HA 1 23 THR MG . . 4.950 3.782 3.366 4.196 . 0 0 "[ . 1 . 2]" 1
291 1 22 VAL HA 1 35 ARG H . . 5.030 4.954 4.828 5.037 0.007 12 0 "[ . 1 . 2]" 1
292 1 22 VAL HA 1 36 ILE HA . . 3.490 2.270 2.026 2.470 . 0 0 "[ . 1 . 2]" 1
293 1 22 VAL HA 1 36 ILE MD . . 5.500 5.225 4.917 5.370 . 0 0 "[ . 1 . 2]" 1
294 1 22 VAL HA 1 37 LEU H . . 3.530 2.522 1.939 2.836 . 0 0 "[ . 1 . 2]" 1
295 1 22 VAL HA 1 37 LEU QD . . 3.930 2.849 2.427 3.546 . 0 0 "[ . 1 . 2]" 1
296 1 22 VAL HB 1 23 THR H . . 3.600 2.490 2.083 2.937 . 0 0 "[ . 1 . 2]" 1
297 1 22 VAL HB 1 24 PHE QE . . 5.080 4.106 3.679 4.625 . 0 0 "[ . 1 . 2]" 1
298 1 22 VAL HB 1 24 PHE HZ . . 5.020 4.257 3.804 4.852 . 0 0 "[ . 1 . 2]" 1
299 1 22 VAL HB 1 33 ILE HG12 . . 4.210 3.336 2.987 3.605 . 0 0 "[ . 1 . 2]" 1
300 1 22 VAL HB 1 33 ILE MG . . 3.680 2.784 2.412 3.003 . 0 0 "[ . 1 . 2]" 1
301 1 22 VAL HB 1 36 ILE HA . . 4.800 3.378 2.876 3.752 . 0 0 "[ . 1 . 2]" 1
302 1 22 VAL HB 1 36 ILE MG . . 4.300 4.139 3.774 4.304 0.004 18 0 "[ . 1 . 2]" 1
303 1 22 VAL HB 1 42 VAL MG1 . . 5.230 4.519 4.046 4.969 . 0 0 "[ . 1 . 2]" 1
304 1 22 VAL HB 1 42 VAL QG . . 4.450 3.927 3.666 4.220 . 0 0 "[ . 1 . 2]" 1
305 1 22 VAL HB 1 42 VAL MG2 . . 5.230 4.441 3.839 5.183 . 0 0 "[ . 1 . 2]" 1
306 1 22 VAL MG1 1 23 THR H . . 4.280 3.672 3.556 3.777 . 0 0 "[ . 1 . 2]" 1
307 1 22 VAL MG1 1 23 THR HA . . 5.500 5.467 5.388 5.510 0.010 19 0 "[ . 1 . 2]" 1
308 1 22 VAL MG1 1 24 PHE QD . . 5.500 5.467 5.361 5.502 0.002 16 0 "[ . 1 . 2]" 1
309 1 22 VAL MG1 1 24 PHE QE . . 4.460 4.352 4.260 4.446 . 0 0 "[ . 1 . 2]" 1
310 1 22 VAL MG1 1 24 PHE HZ . . 4.680 4.190 4.063 4.336 . 0 0 "[ . 1 . 2]" 1
311 1 22 VAL MG1 1 33 ILE HA . . 5.500 5.366 5.250 5.502 0.002 18 0 "[ . 1 . 2]" 1
312 1 22 VAL MG1 1 35 ARG H . . 5.500 5.404 5.261 5.495 . 0 0 "[ . 1 . 2]" 1
313 1 22 VAL MG1 1 36 ILE HA . . 3.470 2.312 2.012 2.697 . 0 0 "[ . 1 . 2]" 1
314 1 22 VAL MG1 1 36 ILE HG13 . . 4.110 3.278 2.900 3.594 . 0 0 "[ . 1 . 2]" 1
315 1 22 VAL MG1 1 37 LEU H . . 4.100 3.199 2.752 3.531 . 0 0 "[ . 1 . 2]" 1
316 1 22 VAL MG1 1 42 VAL HA . . 5.500 4.841 4.443 5.314 . 0 0 "[ . 1 . 2]" 1
317 1 22 VAL MG1 1 42 VAL HB . . 3.820 2.824 2.090 3.611 . 0 0 "[ . 1 . 2]" 1
318 1 22 VAL MG2 1 23 THR H . . 3.980 3.512 2.998 3.862 . 0 0 "[ . 1 . 2]" 1
319 1 22 VAL MG2 1 23 THR HA . . 4.960 3.814 3.549 4.067 . 0 0 "[ . 1 . 2]" 1
320 1 22 VAL MG2 1 24 PHE QD . . 4.680 3.441 3.233 3.652 . 0 0 "[ . 1 . 2]" 1
321 1 22 VAL MG2 1 24 PHE QE . . 3.860 2.223 1.928 2.503 . 0 0 "[ . 1 . 2]" 1
322 1 22 VAL MG2 1 24 PHE HZ . . 3.850 2.201 2.036 2.576 . 0 0 "[ . 1 . 2]" 1
323 1 22 VAL MG2 1 33 ILE HA . . 4.910 4.672 3.951 4.912 0.002 19 0 "[ . 1 . 2]" 1
324 1 22 VAL MG2 1 33 ILE MD . . 3.830 3.486 3.118 3.809 . 0 0 "[ . 1 . 2]" 1
325 1 22 VAL MG2 1 33 ILE HG12 . . 4.340 3.273 2.679 3.564 . 0 0 "[ . 1 . 2]" 1
326 1 22 VAL MG2 1 33 ILE HG13 . . 4.920 4.653 4.131 4.919 . 0 0 "[ . 1 . 2]" 1
327 1 22 VAL MG2 1 36 ILE HA . . 4.740 4.530 4.299 4.741 0.001 14 0 "[ . 1 . 2]" 1
328 1 22 VAL MG2 1 36 ILE HG12 . . 4.580 4.225 3.916 4.495 . 0 0 "[ . 1 . 2]" 1
329 1 22 VAL MG2 1 36 ILE HG13 . . 5.500 5.163 4.688 5.492 . 0 0 "[ . 1 . 2]" 1
330 1 22 VAL MG2 1 42 VAL MG1 . . 4.700 4.158 3.318 4.641 . 0 0 "[ . 1 . 2]" 1
331 1 22 VAL MG2 1 42 VAL QG . . 3.590 3.151 2.767 3.540 . 0 0 "[ . 1 . 2]" 1
332 1 22 VAL MG2 1 42 VAL MG2 . . 4.700 3.493 2.800 4.690 . 0 0 "[ . 1 . 2]" 1
333 1 23 THR H 1 23 THR HB . . 3.990 3.743 3.588 3.885 . 0 0 "[ . 1 . 2]" 1
334 1 23 THR H 1 23 THR MG . . 3.920 3.132 2.775 3.389 . 0 0 "[ . 1 . 2]" 1
335 1 23 THR H 1 33 ILE MG . . 4.340 3.240 2.860 3.532 . 0 0 "[ . 1 . 2]" 1
336 1 23 THR H 1 35 ARG H . . 3.600 2.958 2.803 3.079 . 0 0 "[ . 1 . 2]" 1
337 1 23 THR H 1 35 ARG QB . . 4.500 4.033 3.801 4.430 . 0 0 "[ . 1 . 2]" 1
338 1 23 THR H 1 36 ILE HA . . 4.760 3.372 3.210 3.541 . 0 0 "[ . 1 . 2]" 1
339 1 23 THR HA 1 23 THR MG . . 3.370 2.205 2.001 2.355 . 0 0 "[ . 1 . 2]" 1
340 1 23 THR HA 1 24 PHE H . . 3.060 2.146 2.141 2.185 . 0 0 "[ . 1 . 2]" 1
341 1 23 THR HA 1 24 PHE HA . . 5.140 4.391 4.386 4.397 . 0 0 "[ . 1 . 2]" 1
342 1 23 THR HA 1 24 PHE HB2 . . 4.700 4.663 4.592 4.700 0.000 17 0 "[ . 1 . 2]" 1
343 1 23 THR HA 1 24 PHE QD . . 4.270 3.647 3.166 3.976 . 0 0 "[ . 1 . 2]" 1
344 1 23 THR HA 1 24 PHE QE . . 5.100 4.766 4.360 5.047 . 0 0 "[ . 1 . 2]" 1
345 1 23 THR HA 1 33 ILE MG . . 5.500 5.240 5.048 5.469 . 0 0 "[ . 1 . 2]" 1
346 1 23 THR HA 1 70 GLN HE21 . . 4.750 3.219 1.989 4.459 . 0 0 "[ . 1 . 2]" 1
347 1 23 THR HA 1 70 GLN QE . . 4.180 2.510 1.780 3.322 . 0 0 "[ . 1 . 2]" 1
348 1 23 THR HA 1 70 GLN HE22 . . 4.750 2.632 1.900 3.480 . 0 0 "[ . 1 . 2]" 1
349 1 23 THR HB 1 24 PHE H . . 3.680 3.412 3.106 3.517 . 0 0 "[ . 1 . 2]" 1
350 1 23 THR HB 1 34 ALA MB . . 4.050 3.181 2.811 3.706 . 0 0 "[ . 1 . 2]" 1
351 1 23 THR HB 1 35 ARG H . . 4.240 3.874 3.597 4.227 . 0 0 "[ . 1 . 2]" 1
352 1 23 THR HB 1 35 ARG QB . . 4.230 3.997 3.743 4.170 . 0 0 "[ . 1 . 2]" 1
353 1 23 THR HB 1 35 ARG QD . . 5.500 5.218 4.850 5.446 . 0 0 "[ . 1 . 2]" 1
354 1 23 THR HB 1 35 ARG QG . . 5.340 5.223 4.879 5.341 0.001 10 0 "[ . 1 . 2]" 1
355 1 23 THR MG 1 24 PHE H . . 4.100 3.848 3.542 4.081 . 0 0 "[ . 1 . 2]" 1
356 1 23 THR MG 1 24 PHE QD . . 5.500 5.150 4.778 5.473 . 0 0 "[ . 1 . 2]" 1
357 1 23 THR MG 1 35 ARG H . . 4.920 4.330 4.036 4.573 . 0 0 "[ . 1 . 2]" 1
358 1 23 THR MG 1 35 ARG QB . . 3.790 3.609 3.129 3.790 . 0 0 "[ . 1 . 2]" 1
359 1 23 THR MG 1 35 ARG QD . . 4.300 3.718 3.465 4.109 . 0 0 "[ . 1 . 2]" 1
360 1 23 THR MG 1 37 LEU QD . . 3.510 2.531 1.893 3.110 . 0 0 "[ . 1 . 2]" 1
361 1 24 PHE H 1 24 PHE HB2 . . 3.720 2.576 2.528 2.641 . 0 0 "[ . 1 . 2]" 1
362 1 24 PHE H 1 24 PHE QD . . 4.020 2.454 2.183 2.639 . 0 0 "[ . 1 . 2]" 1
363 1 24 PHE H 1 34 ALA MB . . 4.900 4.432 4.097 4.820 . 0 0 "[ . 1 . 2]" 1
364 1 24 PHE H 1 66 PRO HB2 . . 5.110 3.217 2.867 3.568 . 0 0 "[ . 1 . 2]" 1
365 1 24 PHE H 1 66 PRO HB3 . . 5.450 3.942 3.410 4.487 . 0 0 "[ . 1 . 2]" 1
366 1 24 PHE HA 1 24 PHE QD . . 3.610 2.930 2.768 3.098 . 0 0 "[ . 1 . 2]" 1
367 1 24 PHE HA 1 24 PHE QE . . 4.880 4.703 4.642 4.766 . 0 0 "[ . 1 . 2]" 1
368 1 24 PHE HA 1 25 ARG H . . 3.080 2.293 2.207 2.498 . 0 0 "[ . 1 . 2]" 1
369 1 24 PHE HA 1 25 ARG QG . . 5.080 4.030 3.573 4.616 . 0 0 "[ . 1 . 2]" 1
370 1 24 PHE HA 1 31 LEU MD2 . . 5.340 4.026 3.835 4.189 . 0 0 "[ . 1 . 2]" 1
371 1 24 PHE HA 1 33 ILE HA . . 3.570 2.416 2.258 2.686 . 0 0 "[ . 1 . 2]" 1
372 1 24 PHE HA 1 33 ILE MG . . 4.720 4.156 3.980 4.393 . 0 0 "[ . 1 . 2]" 1
373 1 24 PHE HA 1 34 ALA H . . 3.310 2.139 1.903 2.467 . 0 0 "[ . 1 . 2]" 1
374 1 24 PHE HA 1 34 ALA HA . . 5.120 4.785 4.565 5.105 . 0 0 "[ . 1 . 2]" 1
375 1 24 PHE HA 1 34 ALA MB . . 3.890 3.227 2.896 3.580 . 0 0 "[ . 1 . 2]" 1
376 1 24 PHE HA 1 35 ARG H . . 4.670 4.313 4.100 4.461 . 0 0 "[ . 1 . 2]" 1
377 1 24 PHE HB2 1 25 ARG H . . 4.110 3.772 3.339 4.009 . 0 0 "[ . 1 . 2]" 1
378 1 24 PHE HB2 1 31 LEU HB3 . . 4.960 4.048 3.628 4.430 . 0 0 "[ . 1 . 2]" 1
379 1 24 PHE HB2 1 31 LEU MD1 . . 4.730 3.552 2.948 3.980 . 0 0 "[ . 1 . 2]" 1
380 1 24 PHE HB2 1 31 LEU MD2 . . 4.180 2.545 2.166 2.858 . 0 0 "[ . 1 . 2]" 1
381 1 24 PHE HB2 1 33 ILE HA . . 5.020 4.900 4.744 5.028 0.008 2 0 "[ . 1 . 2]" 1
382 1 24 PHE HB2 1 34 ALA H . . 5.440 5.140 4.923 5.437 . 0 0 "[ . 1 . 2]" 1
383 1 24 PHE HB2 1 66 PRO HA . . 4.200 2.797 2.349 3.269 . 0 0 "[ . 1 . 2]" 1
384 1 24 PHE HB2 1 66 PRO HB2 . . 3.810 2.643 2.249 2.842 . 0 0 "[ . 1 . 2]" 1
385 1 24 PHE HB2 1 66 PRO HB3 . . 3.790 2.235 1.999 2.754 . 0 0 "[ . 1 . 2]" 1
386 1 24 PHE HB2 1 66 PRO HG2 . . 5.060 4.773 4.481 5.022 . 0 0 "[ . 1 . 2]" 1
387 1 24 PHE HB2 1 66 PRO HG3 . . 5.040 4.411 4.210 4.883 . 0 0 "[ . 1 . 2]" 1
388 1 24 PHE HB2 1 69 LEU MD2 . . 5.110 3.036 2.589 3.454 . 0 0 "[ . 1 . 2]" 1
389 1 24 PHE HB2 1 69 LEU HG . . 5.500 5.066 4.685 5.490 . 0 0 "[ . 1 . 2]" 1
390 1 24 PHE HB3 1 25 ARG H . . 3.610 2.750 2.273 3.009 . 0 0 "[ . 1 . 2]" 1
391 1 24 PHE HB3 1 31 LEU HB3 . . 4.410 2.869 2.471 3.152 . 0 0 "[ . 1 . 2]" 1
392 1 24 PHE HB3 1 31 LEU MD1 . . 4.740 3.598 3.112 4.139 . 0 0 "[ . 1 . 2]" 1
393 1 24 PHE HB3 1 31 LEU MD2 . . 3.890 2.093 1.986 2.317 . 0 0 "[ . 1 . 2]" 1
394 1 24 PHE HB3 1 32 VAL H . . 4.700 3.369 2.779 3.869 . 0 0 "[ . 1 . 2]" 1
395 1 24 PHE HB3 1 33 ILE HA . . 5.000 3.960 3.846 4.132 . 0 0 "[ . 1 . 2]" 1
396 1 24 PHE HB3 1 34 ALA H . . 5.250 4.454 4.174 4.831 . 0 0 "[ . 1 . 2]" 1
397 1 24 PHE HB3 1 66 PRO HA . . 4.530 3.932 3.349 4.481 . 0 0 "[ . 1 . 2]" 1
398 1 24 PHE HB3 1 66 PRO HB2 . . 4.340 4.140 3.765 4.345 0.005 17 0 "[ . 1 . 2]" 1
399 1 24 PHE HB3 1 66 PRO HB3 . . 4.170 3.116 2.866 3.360 . 0 0 "[ . 1 . 2]" 1
400 1 24 PHE HB3 1 66 PRO HG3 . . 5.500 5.195 4.974 5.502 0.002 19 0 "[ . 1 . 2]" 1
401 1 24 PHE HB3 1 69 LEU MD2 . . 5.150 3.355 2.896 3.856 . 0 0 "[ . 1 . 2]" 1
402 1 24 PHE QD 1 25 ARG H . . 4.540 4.009 3.891 4.160 . 0 0 "[ . 1 . 2]" 1
403 1 24 PHE QD 1 31 LEU HB3 . . 4.740 3.381 2.843 3.749 . 0 0 "[ . 1 . 2]" 1
404 1 24 PHE QD 1 31 LEU MD1 . . 5.030 4.066 3.695 4.376 . 0 0 "[ . 1 . 2]" 1
405 1 24 PHE QD 1 31 LEU MD2 . . 5.030 3.682 3.569 3.823 . 0 0 "[ . 1 . 2]" 1
406 1 24 PHE QD 1 32 VAL HA . . 5.390 3.636 3.258 4.001 . 0 0 "[ . 1 . 2]" 1
407 1 24 PHE QD 1 33 ILE H . . 5.050 3.310 3.017 3.561 . 0 0 "[ . 1 . 2]" 1
408 1 24 PHE QD 1 33 ILE HA . . 3.790 2.688 2.409 3.051 . 0 0 "[ . 1 . 2]" 1
409 1 24 PHE QD 1 33 ILE MD . . 4.370 4.153 3.848 4.370 0.000 2 0 "[ . 1 . 2]" 1
410 1 24 PHE QD 1 33 ILE HG12 . . 4.510 3.105 2.777 3.479 . 0 0 "[ . 1 . 2]" 1
411 1 24 PHE QD 1 33 ILE HG13 . . 4.550 2.787 2.386 3.087 . 0 0 "[ . 1 . 2]" 1
412 1 24 PHE QD 1 33 ILE MG . . 4.650 4.285 4.073 4.590 . 0 0 "[ . 1 . 2]" 1
413 1 24 PHE QD 1 34 ALA H . . 5.000 4.214 3.949 4.460 . 0 0 "[ . 1 . 2]" 1
414 1 24 PHE QD 1 54 ILE MD . . 4.490 2.700 2.246 3.333 . 0 0 "[ . 1 . 2]" 1
415 1 24 PHE QD 1 66 PRO HA . . 4.780 3.824 3.349 4.257 . 0 0 "[ . 1 . 2]" 1
416 1 24 PHE QD 1 66 PRO HB2 . . 4.840 3.773 3.483 4.230 . 0 0 "[ . 1 . 2]" 1
417 1 24 PHE QD 1 66 PRO HB3 . . 4.850 4.137 3.850 4.673 . 0 0 "[ . 1 . 2]" 1
418 1 24 PHE QD 1 67 ARG HA . . 5.420 5.271 4.714 5.427 0.007 17 0 "[ . 1 . 2]" 1
419 1 24 PHE QD 1 69 LEU HB3 . . 4.470 3.923 3.352 4.308 . 0 0 "[ . 1 . 2]" 1
420 1 24 PHE QD 1 69 LEU MD2 . . 4.320 2.733 2.385 3.046 . 0 0 "[ . 1 . 2]" 1
421 1 24 PHE QD 1 69 LEU HG . . 4.880 3.707 3.227 4.156 . 0 0 "[ . 1 . 2]" 1
422 1 24 PHE QD 1 70 GLN H . . 5.100 3.733 3.308 4.039 . 0 0 "[ . 1 . 2]" 1
423 1 24 PHE QD 1 70 GLN HA . . 4.790 4.423 4.186 4.752 . 0 0 "[ . 1 . 2]" 1
424 1 24 PHE QD 1 70 GLN QB . . 4.450 4.130 3.933 4.339 . 0 0 "[ . 1 . 2]" 1
425 1 24 PHE QD 1 70 GLN HG2 . . 4.420 2.871 2.244 3.741 . 0 0 "[ . 1 . 2]" 1
426 1 24 PHE QD 1 70 GLN HG3 . . 4.420 2.104 1.999 2.341 . 0 0 "[ . 1 . 2]" 1
427 1 24 PHE QD 1 73 LEU MD1 . . 5.240 4.935 4.562 5.163 . 0 0 "[ . 1 . 2]" 1
428 1 24 PHE QE 1 33 ILE HA . . 4.640 3.776 3.424 4.029 . 0 0 "[ . 1 . 2]" 1
429 1 24 PHE QE 1 33 ILE MD . . 3.770 2.778 2.487 2.976 . 0 0 "[ . 1 . 2]" 1
430 1 24 PHE QE 1 33 ILE HG12 . . 3.910 2.227 2.015 2.790 . 0 0 "[ . 1 . 2]" 1
431 1 24 PHE QE 1 33 ILE HG13 . . 4.120 2.189 2.042 2.385 . 0 0 "[ . 1 . 2]" 1
432 1 24 PHE QE 1 33 ILE MG . . 4.950 4.106 3.791 4.484 . 0 0 "[ . 1 . 2]" 1
433 1 24 PHE QE 1 52 ASP HB3 . . 5.500 5.227 4.999 5.505 0.005 17 0 "[ . 1 . 2]" 1
434 1 24 PHE QE 1 54 ILE HB . . 5.230 5.039 4.599 5.238 0.008 19 0 "[ . 1 . 2]" 1
435 1 24 PHE QE 1 54 ILE MD . . 3.550 2.005 1.870 2.102 . 0 0 "[ . 1 . 2]" 1
436 1 24 PHE QE 1 54 ILE HG12 . . 4.480 3.775 3.242 4.358 . 0 0 "[ . 1 . 2]" 1
437 1 24 PHE QE 1 54 ILE HG13 . . 4.480 3.634 3.059 4.207 . 0 0 "[ . 1 . 2]" 1
438 1 24 PHE QE 1 69 LEU HB3 . . 5.110 4.752 4.260 5.053 . 0 0 "[ . 1 . 2]" 1
439 1 24 PHE QE 1 69 LEU MD2 . . 4.050 2.860 2.639 3.042 . 0 0 "[ . 1 . 2]" 1
440 1 24 PHE QE 1 69 LEU HG . . 4.370 3.170 2.514 3.531 . 0 0 "[ . 1 . 2]" 1
441 1 24 PHE QE 1 70 GLN H . . 5.270 4.122 3.642 4.393 . 0 0 "[ . 1 . 2]" 1
442 1 24 PHE QE 1 70 GLN HA . . 3.680 3.193 2.849 3.485 . 0 0 "[ . 1 . 2]" 1
443 1 24 PHE QE 1 70 GLN QB . . 4.630 3.924 3.725 4.156 . 0 0 "[ . 1 . 2]" 1
444 1 24 PHE QE 1 70 GLN HG2 . . 4.530 2.227 1.999 2.640 . 0 0 "[ . 1 . 2]" 1
445 1 24 PHE QE 1 70 GLN HG3 . . 4.530 2.631 2.183 2.956 . 0 0 "[ . 1 . 2]" 1
446 1 24 PHE QE 1 73 LEU MD1 . . 3.580 3.303 2.904 3.580 . 0 0 "[ . 1 . 2]" 1
447 1 24 PHE HZ 1 33 ILE MD . . 4.040 3.683 3.252 4.025 . 0 0 "[ . 1 . 2]" 1
448 1 24 PHE HZ 1 33 ILE MG . . 5.260 4.958 4.590 5.199 . 0 0 "[ . 1 . 2]" 1
449 1 24 PHE HZ 1 54 ILE MD . . 3.890 3.177 2.672 3.883 . 0 0 "[ . 1 . 2]" 1
450 1 24 PHE HZ 1 69 LEU MD1 . . 4.890 4.385 4.111 4.600 . 0 0 "[ . 1 . 2]" 1
451 1 24 PHE HZ 1 69 LEU MD2 . . 4.270 3.208 2.915 3.534 . 0 0 "[ . 1 . 2]" 1
452 1 24 PHE HZ 1 69 LEU HG . . 4.850 4.366 4.069 4.633 . 0 0 "[ . 1 . 2]" 1
453 1 24 PHE HZ 1 70 GLN HA . . 5.440 5.069 4.851 5.350 . 0 0 "[ . 1 . 2]" 1
454 1 24 PHE HZ 1 73 LEU MD1 . . 3.700 3.323 2.943 3.673 . 0 0 "[ . 1 . 2]" 1
455 1 25 ARG H 1 25 ARG QG . . 3.690 2.321 2.079 2.642 . 0 0 "[ . 1 . 2]" 1
456 1 25 ARG H 1 31 LEU MD2 . . 4.910 3.271 2.798 3.720 . 0 0 "[ . 1 . 2]" 1
457 1 25 ARG H 1 32 VAL H . . 3.750 2.683 2.399 3.124 . 0 0 "[ . 1 . 2]" 1
458 1 25 ARG H 1 32 VAL HB . . 5.040 4.509 3.706 5.047 0.007 5 0 "[ . 1 . 2]" 1
459 1 25 ARG H 1 32 VAL MG1 . . 5.500 3.740 2.463 5.167 . 0 0 "[ . 1 . 2]" 1
460 1 25 ARG H 1 32 VAL QG . . 4.620 3.370 2.455 4.271 . 0 0 "[ . 1 . 2]" 1
461 1 25 ARG H 1 32 VAL MG2 . . 5.500 4.593 3.040 4.858 . 0 0 "[ . 1 . 2]" 1
462 1 25 ARG H 1 34 ALA MB . . 3.980 3.271 2.925 3.581 . 0 0 "[ . 1 . 2]" 1
463 1 25 ARG HA 1 26 VAL H . . 3.160 2.250 2.145 2.416 . 0 0 "[ . 1 . 2]" 1
464 1 25 ARG QB 1 25 ARG QD . . 3.100 2.180 2.061 2.430 . 0 0 "[ . 1 . 2]" 1
465 1 25 ARG QB 1 26 VAL H . . 3.570 2.866 2.462 3.299 . 0 0 "[ . 1 . 2]" 1
466 1 25 ARG QB 1 27 GLU QG . . 5.180 3.950 2.987 5.119 . 0 0 "[ . 1 . 2]" 1
467 1 25 ARG QB 1 34 ALA MB . . 3.190 2.152 1.986 2.397 . 0 0 "[ . 1 . 2]" 1
468 1 25 ARG HB2 1 25 ARG HD2 . . 4.100 3.013 2.437 3.661 . 0 0 "[ . 1 . 2]" 1
469 1 25 ARG HB2 1 25 ARG HD3 . . 4.100 3.253 2.215 3.939 . 0 0 "[ . 1 . 2]" 1
470 1 25 ARG HB2 1 34 ALA MB . . 3.870 3.612 3.439 3.780 . 0 0 "[ . 1 . 2]" 1
471 1 25 ARG HB3 1 25 ARG HD2 . . 4.100 2.864 2.124 3.851 . 0 0 "[ . 1 . 2]" 1
472 1 25 ARG HB3 1 25 ARG HD3 . . 4.100 2.971 2.269 3.805 . 0 0 "[ . 1 . 2]" 1
473 1 25 ARG HB3 1 34 ALA MB . . 3.870 2.169 1.997 2.424 . 0 0 "[ . 1 . 2]" 1
474 1 25 ARG QD 1 32 VAL QG . . 4.330 3.077 2.139 4.001 . 0 0 "[ . 1 . 2]" 1
475 1 25 ARG QD 1 34 ALA HA . . 4.750 3.042 2.457 4.107 . 0 0 "[ . 1 . 2]" 1
476 1 25 ARG QD 1 34 ALA MB . . 3.330 2.391 1.829 3.330 0.000 3 0 "[ . 1 . 2]" 1
477 1 25 ARG HD2 1 32 VAL MG1 . . 5.500 4.018 2.571 5.328 . 0 0 "[ . 1 . 2]" 1
478 1 25 ARG HD2 1 32 VAL MG2 . . 5.500 5.047 2.629 5.504 0.004 2 0 "[ . 1 . 2]" 1
479 1 25 ARG HD2 1 34 ALA MB . . 3.860 2.986 1.840 3.876 0.016 12 0 "[ . 1 . 2]" 1
480 1 25 ARG HD3 1 32 VAL MG1 . . 5.500 3.791 2.191 5.483 . 0 0 "[ . 1 . 2]" 1
481 1 25 ARG HD3 1 32 VAL MG2 . . 5.500 4.682 2.530 5.500 0.000 10 0 "[ . 1 . 2]" 1
482 1 25 ARG HD3 1 34 ALA MB . . 3.860 3.014 1.982 3.853 . 0 0 "[ . 1 . 2]" 1
483 1 25 ARG QG 1 26 VAL H . . 4.280 3.709 3.195 4.080 . 0 0 "[ . 1 . 2]" 1
484 1 25 ARG QG 1 27 GLU HB2 . . 5.090 4.321 2.852 5.087 . 0 0 "[ . 1 . 2]" 1
485 1 25 ARG QG 1 27 GLU QB . . 4.270 3.669 2.814 4.248 . 0 0 "[ . 1 . 2]" 1
486 1 25 ARG QG 1 27 GLU HB3 . . 5.090 4.335 3.026 5.087 . 0 0 "[ . 1 . 2]" 1
487 1 25 ARG QG 1 27 GLU HG2 . . 4.930 2.939 2.040 4.519 . 0 0 "[ . 1 . 2]" 1
488 1 25 ARG QG 1 27 GLU QG . . 4.320 2.533 1.983 4.085 . 0 0 "[ . 1 . 2]" 1
489 1 25 ARG QG 1 27 GLU HG3 . . 4.930 3.147 2.010 4.807 . 0 0 "[ . 1 . 2]" 1
490 1 25 ARG QG 1 32 VAL HB . . 4.070 3.423 2.275 4.090 0.020 17 0 "[ . 1 . 2]" 1
491 1 25 ARG QG 1 32 VAL QG . . 4.100 2.418 1.696 3.377 . 0 0 "[ . 1 . 2]" 1
492 1 25 ARG QG 1 34 ALA HA . . 4.570 3.758 2.812 4.519 . 0 0 "[ . 1 . 2]" 1
493 1 26 VAL H 1 26 VAL HB . . 3.080 2.672 2.505 3.027 . 0 0 "[ . 1 . 2]" 1
494 1 26 VAL H 1 26 VAL MG1 . . 4.190 3.349 1.880 3.863 . 0 0 "[ . 1 . 2]" 1
495 1 26 VAL H 1 26 VAL QG . . 3.280 2.266 1.875 2.598 . 0 0 "[ . 1 . 2]" 1
496 1 26 VAL H 1 26 VAL MG2 . . 4.190 2.741 2.100 3.793 . 0 0 "[ . 1 . 2]" 1
497 1 26 VAL H 1 27 GLU H . . 4.780 4.253 4.140 4.411 . 0 0 "[ . 1 . 2]" 1
498 1 26 VAL H 1 66 PRO HG2 . . 5.500 5.157 4.489 5.503 0.003 2 0 "[ . 1 . 2]" 1
499 1 26 VAL H 1 66 PRO HG3 . . 5.340 3.433 2.741 3.781 . 0 0 "[ . 1 . 2]" 1
500 1 26 VAL HA 1 26 VAL MG1 . . 3.720 2.541 2.170 3.185 . 0 0 "[ . 1 . 2]" 1
501 1 26 VAL HA 1 26 VAL QG . . 2.960 2.167 2.043 2.405 . 0 0 "[ . 1 . 2]" 1
502 1 26 VAL HA 1 26 VAL MG2 . . 3.720 2.415 2.265 2.559 . 0 0 "[ . 1 . 2]" 1
503 1 26 VAL HA 1 27 GLU H . . 2.980 2.167 2.141 2.207 . 0 0 "[ . 1 . 2]" 1
504 1 26 VAL HA 1 27 GLU QB . . 4.730 4.504 4.143 4.720 . 0 0 "[ . 1 . 2]" 1
505 1 26 VAL HA 1 30 GLU H . . 5.040 4.221 3.679 5.021 . 0 0 "[ . 1 . 2]" 1
506 1 26 VAL HA 1 31 LEU MD2 . . 3.640 2.839 2.342 3.378 . 0 0 "[ . 1 . 2]" 1
507 1 26 VAL HA 1 32 VAL H . . 4.490 4.088 3.826 4.409 . 0 0 "[ . 1 . 2]" 1
508 1 26 VAL HB 1 31 LEU MD2 . . 4.570 3.929 2.009 4.573 0.003 4 0 "[ . 1 . 2]" 1
509 1 26 VAL HB 1 66 PRO QD . . 4.520 3.730 1.992 4.412 . 0 0 "[ . 1 . 2]" 1
510 1 26 VAL QG 1 27 GLU H . . 3.610 2.937 2.737 3.103 . 0 0 "[ . 1 . 2]" 1
511 1 26 VAL QG 1 27 GLU HA . . 4.610 3.675 3.337 4.054 . 0 0 "[ . 1 . 2]" 1
512 1 26 VAL QG 1 28 GLY QA . . 4.820 4.241 3.485 4.820 0.000 20 0 "[ . 1 . 2]" 1
513 1 26 VAL QG 1 29 GLY H . . 4.640 3.499 2.365 4.576 . 0 0 "[ . 1 . 2]" 1
514 1 26 VAL QG 1 29 GLY QA . . 3.780 3.297 2.736 3.744 . 0 0 "[ . 1 . 2]" 1
515 1 26 VAL QG 1 30 GLU H . . 4.200 3.364 2.851 4.065 . 0 0 "[ . 1 . 2]" 1
516 1 26 VAL QG 1 31 LEU MD2 . . 3.030 2.305 1.947 3.033 0.003 12 0 "[ . 1 . 2]" 1
517 1 26 VAL QG 1 64 SER HA . . 4.220 3.251 2.741 3.681 . 0 0 "[ . 1 . 2]" 1
518 1 26 VAL QG 1 65 ASP HA . . 4.430 3.226 2.713 3.618 . 0 0 "[ . 1 . 2]" 1
519 1 26 VAL QG 1 66 PRO HA . . 5.440 4.512 4.223 5.013 . 0 0 "[ . 1 . 2]" 1
520 1 26 VAL QG 1 66 PRO HB2 . . 4.710 4.457 4.023 4.713 0.003 18 0 "[ . 1 . 2]" 1
521 1 26 VAL QG 1 66 PRO QD . . 3.090 1.942 1.803 2.191 . 0 0 "[ . 1 . 2]" 1
522 1 26 VAL QG 1 66 PRO HG2 . . 3.770 3.664 3.296 3.771 0.001 15 0 "[ . 1 . 2]" 1
523 1 26 VAL QG 1 66 PRO HG3 . . 3.900 2.443 1.976 2.751 . 0 0 "[ . 1 . 2]" 1
524 1 26 VAL MG1 1 27 GLU H . . 4.600 3.286 2.772 4.239 . 0 0 "[ . 1 . 2]" 1
525 1 26 VAL MG2 1 27 GLU H . . 4.600 3.923 2.781 4.262 . 0 0 "[ . 1 . 2]" 1
526 1 27 GLU H 1 27 GLU HB2 . . 4.190 3.017 2.359 3.867 . 0 0 "[ . 1 . 2]" 1
527 1 27 GLU H 1 27 GLU QB . . 3.630 2.726 2.329 3.253 . 0 0 "[ . 1 . 2]" 1
528 1 27 GLU H 1 27 GLU HB3 . . 4.190 3.508 2.921 3.865 . 0 0 "[ . 1 . 2]" 1
529 1 27 GLU H 1 30 GLU H . . 4.090 3.464 2.981 4.086 . 0 0 "[ . 1 . 2]" 1
530 1 27 GLU H 1 32 VAL H . . 4.790 4.474 3.887 4.783 . 0 0 "[ . 1 . 2]" 1
531 1 27 GLU H 1 32 VAL QG . . 4.240 3.842 3.327 4.183 . 0 0 "[ . 1 . 2]" 1
532 1 27 GLU HA 1 27 GLU HG2 . . 4.190 3.213 2.306 4.216 0.026 20 0 "[ . 1 . 2]" 1
533 1 27 GLU HA 1 27 GLU QG . . 3.470 2.860 2.263 3.426 . 0 0 "[ . 1 . 2]" 1
534 1 27 GLU HA 1 27 GLU HG3 . . 4.190 3.511 2.753 3.911 . 0 0 "[ . 1 . 2]" 1
535 1 27 GLU QB 1 32 VAL QG . . 4.220 3.596 2.176 4.204 . 0 0 "[ . 1 . 2]" 1
536 1 27 GLU QG 1 32 VAL QG . . 3.370 2.841 2.109 3.362 . 0 0 "[ . 1 . 2]" 1
537 1 28 GLY QA 1 30 GLU H . . 4.790 3.778 3.254 4.233 . 0 0 "[ . 1 . 2]" 1
538 1 28 GLY QA 1 30 GLU HG2 . . 5.460 4.609 3.401 5.445 . 0 0 "[ . 1 . 2]" 1
539 1 28 GLY QA 1 30 GLU QG . . 4.620 4.069 3.343 4.581 . 0 0 "[ . 1 . 2]" 1
540 1 28 GLY QA 1 30 GLU HG3 . . 5.460 4.944 3.974 5.457 . 0 0 "[ . 1 . 2]" 1
541 1 29 GLY H 1 30 GLU H . . 4.780 2.435 1.800 3.002 . 0 0 "[ . 1 . 2]" 1
542 1 30 GLU H 1 30 GLU QB . . 3.360 2.953 2.516 3.257 . 0 0 "[ . 1 . 2]" 1
543 1 30 GLU H 1 30 GLU HG2 . . 4.210 2.935 1.997 3.960 . 0 0 "[ . 1 . 2]" 1
544 1 30 GLU H 1 30 GLU HG3 . . 4.210 3.283 2.294 4.038 . 0 0 "[ . 1 . 2]" 1
545 1 30 GLU HA 1 30 GLU QG . . 3.690 3.151 2.280 3.446 . 0 0 "[ . 1 . 2]" 1
546 1 30 GLU HA 1 31 LEU H . . 3.180 2.382 2.160 2.499 . 0 0 "[ . 1 . 2]" 1
547 1 30 GLU QB 1 31 LEU H . . 3.510 2.489 2.220 3.129 . 0 0 "[ . 1 . 2]" 1
548 1 30 GLU QB 1 53 ILE MG . . 3.080 2.176 1.909 2.475 . 0 0 "[ . 1 . 2]" 1
549 1 30 GLU HB2 1 31 LEU H . . 4.380 2.804 2.239 4.222 . 0 0 "[ . 1 . 2]" 1
550 1 30 GLU HB2 1 53 ILE MG . . 3.660 2.501 2.000 3.564 . 0 0 "[ . 1 . 2]" 1
551 1 30 GLU HB3 1 31 LEU H . . 4.380 3.506 2.306 4.021 . 0 0 "[ . 1 . 2]" 1
552 1 30 GLU HB3 1 53 ILE MG . . 3.660 3.052 1.928 3.570 . 0 0 "[ . 1 . 2]" 1
553 1 30 GLU QG 1 31 LEU H . . 4.480 3.758 3.030 4.420 . 0 0 "[ . 1 . 2]" 1
554 1 30 GLU QG 1 53 ILE MG . . 3.450 3.021 2.136 3.447 . 0 0 "[ . 1 . 2]" 1
555 1 30 GLU HG2 1 31 LEU H . . 5.260 4.472 3.991 5.210 . 0 0 "[ . 1 . 2]" 1
556 1 30 GLU HG2 1 53 ILE MG . . 4.210 3.802 3.080 4.212 0.002 12 0 "[ . 1 . 2]" 1
557 1 30 GLU HG3 1 31 LEU H . . 5.260 4.208 3.139 5.242 . 0 0 "[ . 1 . 2]" 1
558 1 30 GLU HG3 1 53 ILE MG . . 4.210 3.364 2.151 4.207 . 0 0 "[ . 1 . 2]" 1
559 1 31 LEU H 1 31 LEU HB2 . . 3.580 2.330 2.175 2.461 . 0 0 "[ . 1 . 2]" 1
560 1 31 LEU H 1 31 LEU MD1 . . 4.690 4.104 3.875 4.345 . 0 0 "[ . 1 . 2]" 1
561 1 31 LEU H 1 31 LEU MD2 . . 4.780 4.126 3.887 4.316 . 0 0 "[ . 1 . 2]" 1
562 1 31 LEU H 1 31 LEU HG . . 3.890 3.447 3.120 3.682 . 0 0 "[ . 1 . 2]" 1
563 1 31 LEU H 1 53 ILE MG . . 3.930 3.080 2.677 3.588 . 0 0 "[ . 1 . 2]" 1
564 1 31 LEU H 1 54 ILE H . . 4.820 3.799 3.525 4.038 . 0 0 "[ . 1 . 2]" 1
565 1 31 LEU H 1 54 ILE HB . . 5.460 4.573 4.135 5.172 . 0 0 "[ . 1 . 2]" 1
566 1 31 LEU HA 1 31 LEU MD1 . . 4.300 3.806 3.771 3.832 . 0 0 "[ . 1 . 2]" 1
567 1 31 LEU HA 1 31 LEU MD2 . . 3.170 2.091 1.967 2.322 . 0 0 "[ . 1 . 2]" 1
568 1 31 LEU HA 1 31 LEU HG . . 4.090 2.804 2.687 2.920 . 0 0 "[ . 1 . 2]" 1
569 1 31 LEU HA 1 32 VAL H . . 3.030 2.165 2.139 2.323 . 0 0 "[ . 1 . 2]" 1
570 1 31 LEU HA 1 64 SER HA . . 5.340 5.150 4.643 5.343 0.003 19 0 "[ . 1 . 2]" 1
571 1 31 LEU HB2 1 31 LEU MD1 . . 3.440 2.268 2.142 2.443 . 0 0 "[ . 1 . 2]" 1
572 1 31 LEU HB2 1 32 VAL H . . 4.920 4.390 4.007 4.528 . 0 0 "[ . 1 . 2]" 1
573 1 31 LEU HB2 1 62 VAL HB . . 4.970 4.448 4.063 4.851 . 0 0 "[ . 1 . 2]" 1
574 1 31 LEU HB2 1 62 VAL MG2 . . 3.650 2.974 2.394 3.295 . 0 0 "[ . 1 . 2]" 1
575 1 31 LEU HB2 1 69 LEU MD2 . . 4.170 3.674 3.226 3.997 . 0 0 "[ . 1 . 2]" 1
576 1 31 LEU HB3 1 31 LEU MD1 . . 3.300 2.385 2.249 2.515 . 0 0 "[ . 1 . 2]" 1
577 1 31 LEU HB3 1 32 VAL H . . 4.800 3.405 2.693 3.733 . 0 0 "[ . 1 . 2]" 1
578 1 31 LEU HB3 1 62 VAL HB . . 5.480 5.129 4.696 5.339 . 0 0 "[ . 1 . 2]" 1
579 1 31 LEU HB3 1 66 PRO HA . . 4.850 4.606 4.289 4.845 . 0 0 "[ . 1 . 2]" 1
580 1 31 LEU HB3 1 66 PRO HB3 . . 5.500 4.679 4.442 4.868 . 0 0 "[ . 1 . 2]" 1
581 1 31 LEU HB3 1 69 LEU MD2 . . 4.190 3.083 2.630 3.297 . 0 0 "[ . 1 . 2]" 1
582 1 31 LEU MD1 1 32 VAL H . . 5.250 4.959 4.507 5.193 . 0 0 "[ . 1 . 2]" 1
583 1 31 LEU MD1 1 62 VAL HB . . 3.700 2.600 1.931 2.946 . 0 0 "[ . 1 . 2]" 1
584 1 31 LEU MD1 1 62 VAL MG2 . . 3.260 2.286 1.843 2.938 . 0 0 "[ . 1 . 2]" 1
585 1 31 LEU MD1 1 64 SER HA . . 3.890 3.289 2.503 3.888 . 0 0 "[ . 1 . 2]" 1
586 1 31 LEU MD1 1 65 ASP H . . 4.670 3.450 2.172 4.596 . 0 0 "[ . 1 . 2]" 1
587 1 31 LEU MD1 1 65 ASP HA . . 5.230 4.337 3.479 5.012 . 0 0 "[ . 1 . 2]" 1
588 1 31 LEU MD1 1 65 ASP QB . . 5.110 4.382 3.746 4.844 . 0 0 "[ . 1 . 2]" 1
589 1 31 LEU MD1 1 66 PRO HA . . 3.470 2.292 1.943 2.553 . 0 0 "[ . 1 . 2]" 1
590 1 31 LEU MD1 1 66 PRO HB2 . . 4.730 4.495 4.054 4.731 0.001 2 0 "[ . 1 . 2]" 1
591 1 31 LEU MD1 1 66 PRO QD . . 4.690 3.782 3.405 4.158 . 0 0 "[ . 1 . 2]" 1
592 1 31 LEU MD1 1 69 LEU H . . 4.520 3.976 3.626 4.186 . 0 0 "[ . 1 . 2]" 1
593 1 31 LEU MD1 1 69 LEU HA . . 4.790 4.521 4.131 4.789 . 0 0 "[ . 1 . 2]" 1
594 1 31 LEU MD1 1 69 LEU HB2 . . 3.620 2.685 2.300 2.962 . 0 0 "[ . 1 . 2]" 1
595 1 31 LEU MD1 1 69 LEU HB3 . . 3.960 2.769 2.311 3.135 . 0 0 "[ . 1 . 2]" 1
596 1 31 LEU MD1 1 69 LEU MD1 . . 3.740 3.439 3.115 3.644 . 0 0 "[ . 1 . 2]" 1
597 1 31 LEU MD1 1 69 LEU MD2 . . 3.090 1.950 1.709 2.323 . 0 0 "[ . 1 . 2]" 1
598 1 31 LEU MD2 1 32 VAL H . . 4.140 2.997 2.476 3.301 . 0 0 "[ . 1 . 2]" 1
599 1 31 LEU MD2 1 33 ILE HA . . 5.500 5.495 5.465 5.511 0.011 2 0 "[ . 1 . 2]" 1
600 1 31 LEU MD2 1 64 SER HA . . 3.900 3.772 3.422 3.902 0.002 2 0 "[ . 1 . 2]" 1
601 1 31 LEU MD2 1 65 ASP H . . 5.420 4.410 3.814 5.089 . 0 0 "[ . 1 . 2]" 1
602 1 31 LEU MD2 1 65 ASP HA . . 4.520 3.954 3.318 4.412 . 0 0 "[ . 1 . 2]" 1
603 1 31 LEU MD2 1 66 PRO HA . . 3.420 2.198 1.978 2.661 . 0 0 "[ . 1 . 2]" 1
604 1 31 LEU MD2 1 66 PRO HB2 . . 4.160 3.353 3.119 3.538 . 0 0 "[ . 1 . 2]" 1
605 1 31 LEU MD2 1 66 PRO HB3 . . 3.460 1.987 1.829 2.218 . 0 0 "[ . 1 . 2]" 1
606 1 31 LEU MD2 1 66 PRO QD . . 3.440 2.453 2.123 2.768 . 0 0 "[ . 1 . 2]" 1
607 1 31 LEU MD2 1 66 PRO HG2 . . 4.290 4.029 3.823 4.200 . 0 0 "[ . 1 . 2]" 1
608 1 31 LEU MD2 1 66 PRO HG3 . . 4.430 3.240 2.985 3.463 . 0 0 "[ . 1 . 2]" 1
609 1 31 LEU MD2 1 69 LEU MD2 . . 4.140 3.183 2.902 3.541 . 0 0 "[ . 1 . 2]" 1
610 1 31 LEU HG 1 64 SER HA . . 3.660 2.808 2.095 3.171 . 0 0 "[ . 1 . 2]" 1
611 1 31 LEU HG 1 69 LEU MD2 . . 4.910 4.357 4.014 4.682 . 0 0 "[ . 1 . 2]" 1
612 1 32 VAL H 1 32 VAL HB . . 3.750 2.999 2.721 3.760 0.010 18 0 "[ . 1 . 2]" 1
613 1 32 VAL H 1 32 VAL QG . . 3.510 2.393 1.858 2.836 . 0 0 "[ . 1 . 2]" 1
614 1 32 VAL HA 1 32 VAL QG . . 3.080 2.150 2.020 2.287 . 0 0 "[ . 1 . 2]" 1
615 1 32 VAL HA 1 33 ILE H . . 3.100 2.206 2.160 2.333 . 0 0 "[ . 1 . 2]" 1
616 1 32 VAL HA 1 33 ILE HB . . 4.820 4.602 4.511 4.708 . 0 0 "[ . 1 . 2]" 1
617 1 32 VAL HA 1 33 ILE HG13 . . 5.080 3.918 3.665 4.090 . 0 0 "[ . 1 . 2]" 1
618 1 32 VAL HA 1 53 ILE HA . . 3.550 2.647 2.404 2.997 . 0 0 "[ . 1 . 2]" 1
619 1 32 VAL HA 1 53 ILE HG12 . . 5.500 4.167 3.166 5.341 . 0 0 "[ . 1 . 2]" 1
620 1 32 VAL HA 1 53 ILE QG . . 4.650 3.572 3.085 4.366 . 0 0 "[ . 1 . 2]" 1
621 1 32 VAL HA 1 53 ILE HG13 . . 5.500 4.268 3.169 5.381 . 0 0 "[ . 1 . 2]" 1
622 1 32 VAL HA 1 54 ILE H . . 4.300 3.736 3.306 4.164 . 0 0 "[ . 1 . 2]" 1
623 1 32 VAL HB 1 33 ILE H . . 4.210 3.970 2.864 4.169 . 0 0 "[ . 1 . 2]" 1
624 1 32 VAL HB 1 51 GLY HA2 . . 5.080 4.522 2.300 5.068 . 0 0 "[ . 1 . 2]" 1
625 1 32 VAL QG 1 33 ILE H . . 3.400 2.246 1.876 3.388 . 0 0 "[ . 1 . 2]" 1
626 1 32 VAL QG 1 33 ILE HA . . 4.460 3.940 3.570 4.331 . 0 0 "[ . 1 . 2]" 1
627 1 32 VAL QG 1 51 GLY H . . 4.070 2.710 2.345 3.811 . 0 0 "[ . 1 . 2]" 1
628 1 32 VAL QG 1 51 GLY HA2 . . 3.460 2.156 1.821 2.861 . 0 0 "[ . 1 . 2]" 1
629 1 32 VAL QG 1 51 GLY HA3 . . 3.970 3.456 3.149 3.961 . 0 0 "[ . 1 . 2]" 1
630 1 32 VAL QG 1 52 ASP H . . 4.380 2.905 2.154 4.053 . 0 0 "[ . 1 . 2]" 1
631 1 32 VAL QG 1 53 ILE HA . . 4.600 3.025 2.271 3.666 . 0 0 "[ . 1 . 2]" 1
632 1 33 ILE H 1 33 ILE HB . . 3.360 2.419 2.354 2.521 . 0 0 "[ . 1 . 2]" 1
633 1 33 ILE H 1 33 ILE MD . . 4.080 3.583 3.266 3.812 . 0 0 "[ . 1 . 2]" 1
634 1 33 ILE H 1 33 ILE HG12 . . 4.030 3.657 3.520 3.852 . 0 0 "[ . 1 . 2]" 1
635 1 33 ILE H 1 33 ILE HG13 . . 3.420 2.352 2.162 2.662 . 0 0 "[ . 1 . 2]" 1
636 1 33 ILE H 1 33 ILE MG . . 4.340 3.739 3.713 3.766 . 0 0 "[ . 1 . 2]" 1
637 1 33 ILE H 1 52 ASP HB2 . . 5.150 3.714 3.418 4.197 . 0 0 "[ . 1 . 2]" 1
638 1 33 ILE H 1 53 ILE HA . . 4.550 4.169 3.689 4.547 . 0 0 "[ . 1 . 2]" 1
639 1 33 ILE HA 1 33 ILE MD . . 3.960 3.813 3.763 3.886 . 0 0 "[ . 1 . 2]" 1
640 1 33 ILE HA 1 33 ILE HG12 . . 3.480 2.522 2.397 2.770 . 0 0 "[ . 1 . 2]" 1
641 1 33 ILE HA 1 33 ILE HG13 . . 3.850 2.817 2.730 2.891 . 0 0 "[ . 1 . 2]" 1
642 1 33 ILE HA 1 33 ILE MG . . 3.310 2.436 2.351 2.489 . 0 0 "[ . 1 . 2]" 1
643 1 33 ILE HA 1 34 ALA H . . 2.930 2.193 2.142 2.250 . 0 0 "[ . 1 . 2]" 1
644 1 33 ILE HA 1 34 ALA HA . . 4.790 4.461 4.403 4.510 . 0 0 "[ . 1 . 2]" 1
645 1 33 ILE HA 1 34 ALA MB . . 4.090 4.023 3.964 4.061 . 0 0 "[ . 1 . 2]" 1
646 1 33 ILE HA 1 35 ARG H . . 4.320 3.905 3.652 4.283 . 0 0 "[ . 1 . 2]" 1
647 1 33 ILE HB 1 33 ILE MD . . 3.360 2.314 2.131 2.395 . 0 0 "[ . 1 . 2]" 1
648 1 33 ILE HB 1 36 ILE MD . . 4.820 3.939 3.552 4.544 . 0 0 "[ . 1 . 2]" 1
649 1 33 ILE HB 1 50 VAL HA . . 3.500 2.736 2.245 3.131 . 0 0 "[ . 1 . 2]" 1
650 1 33 ILE HB 1 51 GLY H . . 3.600 2.578 2.266 2.931 . 0 0 "[ . 1 . 2]" 1
651 1 33 ILE HB 1 52 ASP H . . 3.730 2.739 2.165 3.359 . 0 0 "[ . 1 . 2]" 1
652 1 33 ILE HB 1 52 ASP HB2 . . 4.290 3.046 2.573 3.390 . 0 0 "[ . 1 . 2]" 1
653 1 33 ILE HB 1 52 ASP HB3 . . 4.890 4.602 4.152 4.860 . 0 0 "[ . 1 . 2]" 1
654 1 33 ILE MD 1 36 ILE HG12 . . 4.680 3.469 2.988 4.063 . 0 0 "[ . 1 . 2]" 1
655 1 33 ILE MD 1 48 LEU HA . . 4.700 4.027 3.473 4.448 . 0 0 "[ . 1 . 2]" 1
656 1 33 ILE MD 1 48 LEU HB3 . . 3.420 2.424 2.046 2.882 . 0 0 "[ . 1 . 2]" 1
657 1 33 ILE MD 1 49 HIS H . . 3.840 3.085 2.668 3.798 . 0 0 "[ . 1 . 2]" 1
658 1 33 ILE MD 1 49 HIS QB . . 5.340 4.883 4.530 5.273 . 0 0 "[ . 1 . 2]" 1
659 1 33 ILE MD 1 50 VAL HA . . 4.750 3.957 3.477 4.335 . 0 0 "[ . 1 . 2]" 1
660 1 33 ILE MD 1 51 GLY H . . 4.640 4.253 3.787 4.625 . 0 0 "[ . 1 . 2]" 1
661 1 33 ILE MD 1 52 ASP H . . 4.250 3.559 3.073 4.060 . 0 0 "[ . 1 . 2]" 1
662 1 33 ILE MD 1 52 ASP HB2 . . 3.360 2.195 1.854 2.589 . 0 0 "[ . 1 . 2]" 1
663 1 33 ILE MD 1 52 ASP HB3 . . 3.850 2.971 2.564 3.434 . 0 0 "[ . 1 . 2]" 1
664 1 33 ILE HG12 1 33 ILE MG . . 3.460 2.359 2.086 2.428 . 0 0 "[ . 1 . 2]" 1
665 1 33 ILE HG12 1 34 ALA H . . 5.150 4.580 4.415 4.766 . 0 0 "[ . 1 . 2]" 1
666 1 33 ILE HG12 1 52 ASP HB2 . . 4.960 4.526 3.969 4.754 . 0 0 "[ . 1 . 2]" 1
667 1 33 ILE HG13 1 33 ILE MG . . 3.580 3.190 3.146 3.200 . 0 0 "[ . 1 . 2]" 1
668 1 33 ILE HG13 1 34 ALA H . . 5.150 4.965 4.869 5.046 . 0 0 "[ . 1 . 2]" 1
669 1 33 ILE HG13 1 52 ASP HB2 . . 4.310 3.310 2.662 3.612 . 0 0 "[ . 1 . 2]" 1
670 1 33 ILE HG13 1 52 ASP HB3 . . 4.290 4.067 3.720 4.273 . 0 0 "[ . 1 . 2]" 1
671 1 33 ILE HG13 1 54 ILE MD . . 3.620 3.147 2.237 3.577 . 0 0 "[ . 1 . 2]" 1
672 1 33 ILE HG13 1 54 ILE HG12 . . 5.080 4.782 4.386 5.074 . 0 0 "[ . 1 . 2]" 1
673 1 33 ILE HG13 1 54 ILE QG . . 4.260 3.879 3.447 4.260 0.000 8 0 "[ . 1 . 2]" 1
674 1 33 ILE HG13 1 54 ILE HG13 . . 5.080 4.135 3.599 4.763 . 0 0 "[ . 1 . 2]" 1
675 1 33 ILE MG 1 34 ALA H . . 3.660 3.165 2.884 3.363 . 0 0 "[ . 1 . 2]" 1
676 1 33 ILE MG 1 34 ALA HA . . 4.540 4.150 3.964 4.294 . 0 0 "[ . 1 . 2]" 1
677 1 33 ILE MG 1 35 ARG H . . 3.500 2.835 2.419 3.319 . 0 0 "[ . 1 . 2]" 1
678 1 33 ILE MG 1 35 ARG HA . . 4.250 3.488 3.379 3.726 . 0 0 "[ . 1 . 2]" 1
679 1 33 ILE MG 1 36 ILE H . . 4.800 4.100 3.797 4.344 . 0 0 "[ . 1 . 2]" 1
680 1 33 ILE MG 1 36 ILE HG12 . . 3.170 2.441 2.049 2.789 . 0 0 "[ . 1 . 2]" 1
681 1 33 ILE MG 1 36 ILE HG13 . . 3.150 2.101 1.856 2.412 . 0 0 "[ . 1 . 2]" 1
682 1 33 ILE MG 1 50 VAL H . . 4.850 3.647 3.317 3.969 . 0 0 "[ . 1 . 2]" 1
683 1 33 ILE MG 1 50 VAL HA . . 3.060 2.184 1.994 2.488 . 0 0 "[ . 1 . 2]" 1
684 1 33 ILE MG 1 50 VAL QG . . 3.240 2.530 2.221 2.782 . 0 0 "[ . 1 . 2]" 1
685 1 33 ILE MG 1 51 GLY H . . 3.640 3.394 2.999 3.640 0.000 18 0 "[ . 1 . 2]" 1
686 1 33 ILE MG 1 52 ASP H . . 4.650 4.151 3.785 4.503 . 0 0 "[ . 1 . 2]" 1
687 1 33 ILE MG 1 52 ASP HB2 . . 5.080 4.168 3.654 4.364 . 0 0 "[ . 1 . 2]" 1
688 1 34 ALA H 1 34 ALA MB . . 3.130 2.170 2.036 2.273 . 0 0 "[ . 1 . 2]" 1
689 1 34 ALA H 1 35 ARG H . . 3.230 2.699 2.348 3.010 . 0 0 "[ . 1 . 2]" 1
690 1 34 ALA HA 1 50 VAL QG . . 3.530 3.118 2.424 3.532 0.002 1 0 "[ . 1 . 2]" 1
691 1 34 ALA HA 1 51 GLY H . . 4.950 4.692 4.207 4.949 . 0 0 "[ . 1 . 2]" 1
692 1 34 ALA MB 1 35 ARG H . . 3.330 2.409 2.045 2.699 . 0 0 "[ . 1 . 2]" 1
693 1 34 ALA MB 1 35 ARG HA . . 4.860 4.189 4.058 4.277 . 0 0 "[ . 1 . 2]" 1
694 1 35 ARG H 1 35 ARG QB . . 3.860 2.661 2.542 2.721 . 0 0 "[ . 1 . 2]" 1
695 1 35 ARG H 1 35 ARG HG2 . . 4.880 4.110 3.996 4.227 . 0 0 "[ . 1 . 2]" 1
696 1 35 ARG H 1 35 ARG HG3 . . 4.880 4.691 4.572 4.777 . 0 0 "[ . 1 . 2]" 1
697 1 35 ARG H 1 36 ILE H . . 4.890 4.387 4.338 4.439 . 0 0 "[ . 1 . 2]" 1
698 1 35 ARG H 1 50 VAL HA . . 5.470 5.256 4.953 5.467 . 0 0 "[ . 1 . 2]" 1
699 1 35 ARG H 1 50 VAL MG1 . . 5.430 4.709 4.208 5.156 . 0 0 "[ . 1 . 2]" 1
700 1 35 ARG H 1 50 VAL QG . . 4.430 3.912 3.559 4.166 . 0 0 "[ . 1 . 2]" 1
701 1 35 ARG H 1 50 VAL MG2 . . 5.430 4.201 3.761 4.651 . 0 0 "[ . 1 . 2]" 1
702 1 35 ARG HA 1 35 ARG QD . . 4.710 4.234 3.881 4.406 . 0 0 "[ . 1 . 2]" 1
703 1 35 ARG HA 1 35 ARG HG2 . . 4.100 3.464 3.327 3.625 . 0 0 "[ . 1 . 2]" 1
704 1 35 ARG HA 1 35 ARG HG3 . . 4.100 2.843 2.740 2.924 . 0 0 "[ . 1 . 2]" 1
705 1 35 ARG HA 1 36 ILE H . . 2.880 2.348 2.269 2.416 . 0 0 "[ . 1 . 2]" 1
706 1 35 ARG HA 1 50 VAL QG . . 4.440 2.392 2.080 2.686 . 0 0 "[ . 1 . 2]" 1
707 1 35 ARG QB 1 36 ILE H . . 4.150 3.325 3.232 3.425 . 0 0 "[ . 1 . 2]" 1
708 1 35 ARG QB 1 37 LEU QD . . 4.410 3.997 3.702 4.331 . 0 0 "[ . 1 . 2]" 1
709 1 35 ARG QB 1 50 VAL MG1 . . 5.500 4.642 4.364 5.022 . 0 0 "[ . 1 . 2]" 1
710 1 35 ARG QB 1 50 VAL QG . . 4.580 3.672 3.361 3.954 . 0 0 "[ . 1 . 2]" 1
711 1 35 ARG QB 1 50 VAL MG2 . . 5.500 3.858 3.474 4.336 . 0 0 "[ . 1 . 2]" 1
712 1 35 ARG QD 1 36 ILE H . . 5.230 4.072 3.884 4.391 . 0 0 "[ . 1 . 2]" 1
713 1 35 ARG QD 1 37 LEU HA . . 5.230 4.160 3.614 4.783 . 0 0 "[ . 1 . 2]" 1
714 1 35 ARG QD 1 37 LEU QD . . 3.950 2.934 2.548 3.576 . 0 0 "[ . 1 . 2]" 1
715 1 35 ARG QG 1 36 ILE H . . 3.730 1.967 1.847 2.273 . 0 0 "[ . 1 . 2]" 1
716 1 35 ARG HG2 1 36 ILE H . . 4.290 2.733 2.411 3.129 . 0 0 "[ . 1 . 2]" 1
717 1 35 ARG HG3 1 36 ILE H . . 4.290 2.023 1.900 2.366 . 0 0 "[ . 1 . 2]" 1
718 1 36 ILE H 1 36 ILE HB . . 3.410 2.651 2.502 2.739 . 0 0 "[ . 1 . 2]" 1
719 1 36 ILE H 1 36 ILE MD . . 4.520 3.945 3.730 4.319 . 0 0 "[ . 1 . 2]" 1
720 1 36 ILE H 1 36 ILE HG12 . . 4.650 4.246 3.898 4.483 . 0 0 "[ . 1 . 2]" 1
721 1 36 ILE H 1 36 ILE HG13 . . 4.060 3.047 2.908 3.305 . 0 0 "[ . 1 . 2]" 1
722 1 36 ILE H 1 36 ILE MG . . 4.250 3.825 3.712 3.886 . 0 0 "[ . 1 . 2]" 1
723 1 36 ILE H 1 50 VAL QG . . 3.710 3.287 2.932 3.676 . 0 0 "[ . 1 . 2]" 1
724 1 36 ILE HA 1 36 ILE MD . . 4.030 3.839 3.733 3.886 . 0 0 "[ . 1 . 2]" 1
725 1 36 ILE HA 1 36 ILE HG12 . . 3.820 2.645 2.421 2.798 . 0 0 "[ . 1 . 2]" 1
726 1 36 ILE HA 1 36 ILE HG13 . . 3.720 2.773 2.494 3.176 . 0 0 "[ . 1 . 2]" 1
727 1 36 ILE HA 1 36 ILE MG . . 3.180 2.430 2.309 2.561 . 0 0 "[ . 1 . 2]" 1
728 1 36 ILE HA 1 37 LEU H . . 3.010 2.163 2.140 2.196 . 0 0 "[ . 1 . 2]" 1
729 1 36 ILE HA 1 37 LEU HB2 . . 4.540 4.305 4.243 4.539 . 0 0 "[ . 1 . 2]" 1
730 1 36 ILE HA 1 37 LEU QD . . 4.070 3.467 3.080 3.953 . 0 0 "[ . 1 . 2]" 1
731 1 36 ILE HB 1 36 ILE MD . . 3.250 2.260 2.120 2.490 . 0 0 "[ . 1 . 2]" 1
732 1 36 ILE HB 1 37 LEU H . . 5.330 4.393 4.133 4.500 . 0 0 "[ . 1 . 2]" 1
733 1 36 ILE HB 1 50 VAL QG . . 4.090 3.659 2.849 4.089 . 0 0 "[ . 1 . 2]" 1
734 1 36 ILE MD 1 37 LEU H . . 5.480 5.370 4.886 5.480 0.000 17 0 "[ . 1 . 2]" 1
735 1 36 ILE MD 1 42 VAL HA . . 5.500 5.113 4.874 5.423 . 0 0 "[ . 1 . 2]" 1
736 1 36 ILE MD 1 42 VAL HB . . 5.180 3.941 3.486 4.632 . 0 0 "[ . 1 . 2]" 1
737 1 36 ILE MD 1 42 VAL QG . . 3.140 2.001 1.783 2.345 . 0 0 "[ . 1 . 2]" 1
738 1 36 ILE MD 1 43 ALA HA . . 4.700 4.152 3.391 4.665 . 0 0 "[ . 1 . 2]" 1
739 1 36 ILE MD 1 48 LEU H . . 5.200 5.004 4.765 5.154 . 0 0 "[ . 1 . 2]" 1
740 1 36 ILE MD 1 48 LEU HA . . 5.070 4.832 4.401 5.066 . 0 0 "[ . 1 . 2]" 1
741 1 36 ILE MD 1 48 LEU HB2 . . 3.970 3.504 3.043 3.792 . 0 0 "[ . 1 . 2]" 1
742 1 36 ILE MD 1 48 LEU HB3 . . 4.540 3.908 3.048 4.208 . 0 0 "[ . 1 . 2]" 1
743 1 36 ILE MD 1 49 HIS H . . 4.640 3.654 3.358 4.128 . 0 0 "[ . 1 . 2]" 1
744 1 36 ILE MD 1 49 HIS HA . . 4.080 2.013 1.853 2.423 . 0 0 "[ . 1 . 2]" 1
745 1 36 ILE MD 1 49 HIS HB2 . . 4.950 4.032 3.405 4.772 . 0 0 "[ . 1 . 2]" 1
746 1 36 ILE MD 1 49 HIS QB . . 4.340 3.518 3.118 3.978 . 0 0 "[ . 1 . 2]" 1
747 1 36 ILE MD 1 49 HIS HB3 . . 4.950 3.938 3.618 4.527 . 0 0 "[ . 1 . 2]" 1
748 1 36 ILE MD 1 50 VAL H . . 3.740 2.584 2.227 3.500 . 0 0 "[ . 1 . 2]" 1
749 1 36 ILE MD 1 50 VAL HA . . 4.490 3.435 3.052 4.005 . 0 0 "[ . 1 . 2]" 1
750 1 36 ILE MD 1 50 VAL HB . . 5.500 4.527 3.991 5.354 . 0 0 "[ . 1 . 2]" 1
751 1 36 ILE MD 1 50 VAL QG . . 3.410 2.666 2.035 3.368 . 0 0 "[ . 1 . 2]" 1
752 1 36 ILE MD 1 52 ASP HB2 . . 5.500 4.875 4.498 5.405 . 0 0 "[ . 1 . 2]" 1
753 1 36 ILE HG12 1 37 LEU H . . 5.180 4.601 4.298 4.791 . 0 0 "[ . 1 . 2]" 1
754 1 36 ILE HG12 1 42 VAL QG . . 4.810 2.654 2.197 3.310 . 0 0 "[ . 1 . 2]" 1
755 1 36 ILE HG13 1 37 LEU H . . 5.330 4.891 4.640 5.147 . 0 0 "[ . 1 . 2]" 1
756 1 36 ILE HG13 1 50 VAL H . . 5.180 4.237 3.717 4.823 . 0 0 "[ . 1 . 2]" 1
757 1 36 ILE HG13 1 50 VAL QG . . 3.490 2.904 2.426 3.494 0.004 18 0 "[ . 1 . 2]" 1
758 1 36 ILE MG 1 37 LEU H . . 3.710 3.004 2.553 3.291 . 0 0 "[ . 1 . 2]" 1
759 1 36 ILE MG 1 38 HIS HA . . 4.900 3.789 2.623 4.126 . 0 0 "[ . 1 . 2]" 1
760 1 36 ILE MG 1 38 HIS QB . . 5.340 5.051 4.187 5.370 0.030 18 0 "[ . 1 . 2]" 1
761 1 36 ILE MG 1 40 GLY QA . . 5.340 4.825 4.344 5.351 0.011 18 0 "[ . 1 . 2]" 1
762 1 36 ILE MG 1 42 VAL HB . . 4.440 2.821 1.991 4.409 . 0 0 "[ . 1 . 2]" 1
763 1 36 ILE MG 1 42 VAL QG . . 2.860 2.071 1.777 2.419 . 0 0 "[ . 1 . 2]" 1
764 1 36 ILE MG 1 43 ALA H . . 3.940 3.013 2.394 3.827 . 0 0 "[ . 1 . 2]" 1
765 1 36 ILE MG 1 43 ALA HA . . 3.490 2.844 1.913 3.474 . 0 0 "[ . 1 . 2]" 1
766 1 36 ILE MG 1 43 ALA MB . . 3.040 2.647 2.036 3.040 . 0 0 "[ . 1 . 2]" 1
767 1 37 LEU H 1 37 LEU HB2 . . 3.430 2.261 2.176 2.632 . 0 0 "[ . 1 . 2]" 1
768 1 37 LEU H 1 37 LEU HB3 . . 3.740 3.529 3.485 3.599 . 0 0 "[ . 1 . 2]" 1
769 1 37 LEU H 1 37 LEU MD1 . . 4.360 2.472 1.875 3.820 . 0 0 "[ . 1 . 2]" 1
770 1 37 LEU H 1 37 LEU QD . . 3.570 2.058 1.871 2.472 . 0 0 "[ . 1 . 2]" 1
771 1 37 LEU H 1 37 LEU MD2 . . 4.360 3.524 1.958 4.253 . 0 0 "[ . 1 . 2]" 1
772 1 37 LEU H 1 37 LEU HG . . 4.160 3.717 2.266 4.027 . 0 0 "[ . 1 . 2]" 1
773 1 37 LEU HA 1 37 LEU QD . . 3.180 2.528 1.975 2.927 . 0 0 "[ . 1 . 2]" 1
774 1 37 LEU HA 1 37 LEU HG . . 4.230 2.703 2.255 3.691 . 0 0 "[ . 1 . 2]" 1
775 1 37 LEU HA 1 38 HIS QB . . 5.340 4.200 4.023 4.550 . 0 0 "[ . 1 . 2]" 1
776 1 37 LEU QD 1 38 HIS QB . . 5.280 5.015 4.199 5.281 0.001 1 0 "[ . 1 . 2]" 1
777 1 38 HIS HA 1 43 ALA MB . . 3.610 2.608 1.899 3.513 . 0 0 "[ . 1 . 2]" 1
778 1 38 HIS QB 1 43 ALA MB . . 4.820 4.004 3.128 4.647 . 0 0 "[ . 1 . 2]" 1
779 1 38 HIS HB2 1 43 ALA MB . . 5.500 4.473 3.552 5.125 . 0 0 "[ . 1 . 2]" 1
780 1 38 HIS HB3 1 43 ALA MB . . 5.500 4.634 3.204 5.426 . 0 0 "[ . 1 . 2]" 1
781 1 39 GLY QA 1 43 ALA MB . . 4.700 3.410 2.693 4.463 . 0 0 "[ . 1 . 2]" 1
782 1 40 GLY H 1 43 ALA MB . . 3.770 2.170 1.863 2.877 . 0 0 "[ . 1 . 2]" 1
783 1 40 GLY QA 1 41 MET HB3 . . 5.290 4.411 4.114 4.946 . 0 0 "[ . 1 . 2]" 1
784 1 40 GLY QA 1 42 VAL H . . 4.740 4.137 3.870 4.694 . 0 0 "[ . 1 . 2]" 1
785 1 40 GLY QA 1 42 VAL QG . . 5.280 4.722 3.483 5.249 . 0 0 "[ . 1 . 2]" 1
786 1 40 GLY QA 1 43 ALA MB . . 4.150 3.068 2.149 3.873 . 0 0 "[ . 1 . 2]" 1
787 1 40 GLY QA 1 44 GLN QG . . 4.960 3.714 2.128 4.887 . 0 0 "[ . 1 . 2]" 1
788 1 40 GLY HA2 1 42 VAL H . . 5.380 5.211 4.599 5.380 0.000 20 0 "[ . 1 . 2]" 1
789 1 40 GLY HA2 1 43 ALA MB . . 5.000 3.853 2.163 4.994 . 0 0 "[ . 1 . 2]" 1
790 1 40 GLY HA3 1 42 VAL H . . 5.380 4.394 3.976 5.383 0.003 18 0 "[ . 1 . 2]" 1
791 1 40 GLY HA3 1 43 ALA MB . . 5.000 3.466 2.957 4.035 . 0 0 "[ . 1 . 2]" 1
792 1 41 MET H 1 41 MET HB2 . . 3.920 2.678 2.380 3.202 . 0 0 "[ . 1 . 2]" 1
793 1 41 MET H 1 41 MET HB3 . . 3.890 2.490 2.241 2.748 . 0 0 "[ . 1 . 2]" 1
794 1 41 MET H 1 41 MET HG2 . . 4.730 4.545 4.033 4.690 . 0 0 "[ . 1 . 2]" 1
795 1 41 MET H 1 41 MET QG . . 4.150 3.974 3.732 4.065 . 0 0 "[ . 1 . 2]" 1
796 1 41 MET H 1 41 MET HG3 . . 4.730 4.397 4.220 4.488 . 0 0 "[ . 1 . 2]" 1
797 1 41 MET H 1 42 VAL H . . 4.210 2.864 2.114 3.344 . 0 0 "[ . 1 . 2]" 1
798 1 41 MET HA 1 41 MET HG2 . . 4.030 3.805 3.583 3.908 . 0 0 "[ . 1 . 2]" 1
799 1 41 MET HA 1 41 MET HG3 . . 4.030 2.882 2.577 3.270 . 0 0 "[ . 1 . 2]" 1
800 1 41 MET HA 1 44 GLN H . . 4.470 3.997 3.591 4.394 . 0 0 "[ . 1 . 2]" 1
801 1 41 MET HA 1 44 GLN QB . . 3.770 3.466 2.902 3.784 0.014 12 0 "[ . 1 . 2]" 1
802 1 41 MET HA 1 44 GLN HG2 . . 5.090 4.665 1.994 5.054 . 0 0 "[ . 1 . 2]" 1
803 1 41 MET HA 1 44 GLN QG . . 4.450 3.956 1.981 4.446 . 0 0 "[ . 1 . 2]" 1
804 1 41 MET HA 1 44 GLN HG3 . . 5.090 4.397 3.352 4.996 . 0 0 "[ . 1 . 2]" 1
805 1 41 MET HB2 1 42 VAL H . . 4.080 3.666 3.479 3.974 . 0 0 "[ . 1 . 2]" 1
806 1 41 MET HB2 1 42 VAL QG . . 4.950 4.615 4.230 4.925 . 0 0 "[ . 1 . 2]" 1
807 1 41 MET HB3 1 42 VAL H . . 4.390 2.201 1.947 2.624 . 0 0 "[ . 1 . 2]" 1
808 1 41 MET HB3 1 42 VAL HA . . 4.940 4.365 4.156 4.763 . 0 0 "[ . 1 . 2]" 1
809 1 41 MET HB3 1 42 VAL QG . . 4.460 3.217 2.849 3.657 . 0 0 "[ . 1 . 2]" 1
810 1 41 MET ME 1 42 VAL QG . . 5.440 5.060 4.587 5.440 . 0 0 "[ . 1 . 2]" 1
811 1 41 MET QG 1 42 VAL HA . . 5.090 3.306 2.814 3.648 . 0 0 "[ . 1 . 2]" 1
812 1 41 MET QG 1 42 VAL QG . . 3.980 3.268 2.681 3.916 . 0 0 "[ . 1 . 2]" 1
813 1 41 MET HG2 1 42 VAL H . . 5.060 3.645 2.766 4.483 . 0 0 "[ . 1 . 2]" 1
814 1 41 MET HG2 1 48 LEU MD1 . . 5.090 4.888 3.994 5.091 0.001 12 0 "[ . 1 . 2]" 1
815 1 41 MET HG3 1 42 VAL H . . 5.060 3.257 2.429 4.001 . 0 0 "[ . 1 . 2]" 1
816 1 41 MET HG3 1 48 LEU MD1 . . 5.090 4.767 4.392 5.092 0.002 5 0 "[ . 1 . 2]" 1
817 1 42 VAL H 1 42 VAL HB . . 3.350 2.580 2.344 2.869 . 0 0 "[ . 1 . 2]" 1
818 1 42 VAL H 1 42 VAL MG1 . . 4.130 3.310 1.905 3.795 . 0 0 "[ . 1 . 2]" 1
819 1 42 VAL H 1 42 VAL QG . . 3.180 2.155 1.892 2.554 . 0 0 "[ . 1 . 2]" 1
820 1 42 VAL H 1 42 VAL MG2 . . 4.130 2.619 1.897 3.769 . 0 0 "[ . 1 . 2]" 1
821 1 42 VAL H 1 43 ALA H . . 3.840 2.742 2.428 3.193 . 0 0 "[ . 1 . 2]" 1
822 1 42 VAL H 1 43 ALA MB . . 5.040 4.308 4.001 4.689 . 0 0 "[ . 1 . 2]" 1
823 1 42 VAL HA 1 42 VAL MG1 . . 3.360 2.590 2.225 3.198 . 0 0 "[ . 1 . 2]" 1
824 1 42 VAL HA 1 42 VAL MG2 . . 3.360 2.320 2.171 2.498 . 0 0 "[ . 1 . 2]" 1
825 1 42 VAL HA 1 45 GLN H . . 4.740 3.544 3.126 3.969 . 0 0 "[ . 1 . 2]" 1
826 1 42 VAL HA 1 45 GLN HB2 . . 4.580 2.662 2.029 4.596 0.016 20 0 "[ . 1 . 2]" 1
827 1 42 VAL HA 1 45 GLN QB . . 3.970 2.581 2.008 3.591 . 0 0 "[ . 1 . 2]" 1
828 1 42 VAL HA 1 45 GLN HB3 . . 4.580 3.914 3.226 4.436 . 0 0 "[ . 1 . 2]" 1
829 1 42 VAL HA 1 45 GLN HG2 . . 5.500 4.868 1.994 5.487 . 0 0 "[ . 1 . 2]" 1
830 1 42 VAL HA 1 45 GLN QG . . 4.700 4.102 1.978 4.563 . 0 0 "[ . 1 . 2]" 1
831 1 42 VAL HA 1 45 GLN HG3 . . 5.500 4.475 3.287 4.910 . 0 0 "[ . 1 . 2]" 1
832 1 42 VAL HA 1 47 LEU HB2 . . 5.450 5.204 4.278 5.451 0.001 20 0 "[ . 1 . 2]" 1
833 1 42 VAL HA 1 47 LEU MD1 . . 5.390 5.075 3.838 5.389 . 0 0 "[ . 1 . 2]" 1
834 1 42 VAL HA 1 48 LEU HB2 . . 5.330 4.119 3.603 4.776 . 0 0 "[ . 1 . 2]" 1
835 1 42 VAL HA 1 48 LEU MD1 . . 4.400 3.323 2.815 4.295 . 0 0 "[ . 1 . 2]" 1
836 1 42 VAL HB 1 43 ALA H . . 4.210 2.866 2.149 4.196 . 0 0 "[ . 1 . 2]" 1
837 1 42 VAL QG 1 43 ALA H . . 3.980 2.798 1.827 3.300 . 0 0 "[ . 1 . 2]" 1
838 1 42 VAL QG 1 43 ALA HA . . 4.270 3.257 2.915 3.596 . 0 0 "[ . 1 . 2]" 1
839 1 42 VAL QG 1 48 LEU H . . 3.680 2.988 2.372 3.405 . 0 0 "[ . 1 . 2]" 1
840 1 42 VAL QG 1 48 LEU HB2 . . 2.880 1.913 1.763 2.083 . 0 0 "[ . 1 . 2]" 1
841 1 42 VAL QG 1 48 LEU HB3 . . 3.780 3.053 2.334 3.387 . 0 0 "[ . 1 . 2]" 1
842 1 42 VAL MG1 1 43 ALA H . . 4.570 2.936 1.838 3.566 . 0 0 "[ . 1 . 2]" 1
843 1 42 VAL MG2 1 43 ALA H . . 4.570 3.719 3.221 3.989 . 0 0 "[ . 1 . 2]" 1
844 1 43 ALA H 1 43 ALA MB . . 3.210 2.162 2.045 2.260 . 0 0 "[ . 1 . 2]" 1
845 1 43 ALA H 1 44 GLN H . . 3.920 2.878 2.542 3.193 . 0 0 "[ . 1 . 2]" 1
846 1 43 ALA MB 1 44 GLN H . . 3.660 2.489 2.076 2.960 . 0 0 "[ . 1 . 2]" 1
847 1 43 ALA MB 1 44 GLN HA . . 4.570 3.786 3.563 3.982 . 0 0 "[ . 1 . 2]" 1
848 1 43 ALA MB 1 44 GLN QB . . 4.710 4.154 3.751 4.356 . 0 0 "[ . 1 . 2]" 1
849 1 43 ALA MB 1 44 GLN HG2 . . 4.810 3.271 2.785 4.601 . 0 0 "[ . 1 . 2]" 1
850 1 43 ALA MB 1 44 GLN HG3 . . 4.810 4.383 3.195 4.815 0.005 12 0 "[ . 1 . 2]" 1
851 1 44 GLN H 1 44 GLN QB . . 3.410 2.405 2.287 2.524 . 0 0 "[ . 1 . 2]" 1
852 1 44 GLN H 1 44 GLN HG2 . . 4.130 2.569 2.052 3.947 . 0 0 "[ . 1 . 2]" 1
853 1 44 GLN H 1 44 GLN QG . . 3.610 2.380 2.037 2.649 . 0 0 "[ . 1 . 2]" 1
854 1 44 GLN H 1 44 GLN HG3 . . 4.130 3.426 2.248 3.889 . 0 0 "[ . 1 . 2]" 1
855 1 44 GLN H 1 45 GLN H . . 3.850 2.662 2.263 3.099 . 0 0 "[ . 1 . 2]" 1
856 1 44 GLN HA 1 44 GLN HG2 . . 3.900 2.895 2.427 3.929 0.029 12 0 "[ . 1 . 2]" 1
857 1 44 GLN HA 1 44 GLN QG . . 3.260 2.767 2.359 3.339 0.079 12 0 "[ . 1 . 2]" 1
858 1 44 GLN HA 1 44 GLN HG3 . . 3.900 3.647 2.669 3.800 . 0 0 "[ . 1 . 2]" 1
859 1 44 GLN QB 1 45 GLN H . . 4.060 2.539 2.105 3.673 . 0 0 "[ . 1 . 2]" 1
860 1 44 GLN QB 1 45 GLN QE . . 5.150 4.797 3.881 5.148 . 0 0 "[ . 1 . 2]" 1
861 1 44 GLN QB 1 45 GLN QG . . 4.310 3.583 2.700 4.320 0.010 20 0 "[ . 1 . 2]" 1
862 1 45 GLN H 1 45 GLN HB2 . . 3.850 2.360 2.183 3.551 . 0 0 "[ . 1 . 2]" 1
863 1 45 GLN H 1 45 GLN QB . . 3.260 2.269 2.162 2.580 . 0 0 "[ . 1 . 2]" 1
864 1 45 GLN H 1 45 GLN HB3 . . 3.850 3.483 2.295 3.680 . 0 0 "[ . 1 . 2]" 1
865 1 45 GLN H 1 45 GLN HG2 . . 4.740 3.530 2.065 4.573 . 0 0 "[ . 1 . 2]" 1
866 1 45 GLN H 1 45 GLN QG . . 3.960 2.815 2.045 3.531 . 0 0 "[ . 1 . 2]" 1
867 1 45 GLN H 1 45 GLN HG3 . . 4.740 3.387 2.654 4.364 . 0 0 "[ . 1 . 2]" 1
868 1 45 GLN HA 1 45 GLN HG2 . . 3.870 2.737 2.504 3.663 . 0 0 "[ . 1 . 2]" 1
869 1 45 GLN HA 1 45 GLN QG . . 3.370 2.508 2.276 3.317 . 0 0 "[ . 1 . 2]" 1
870 1 45 GLN HA 1 45 GLN HG3 . . 3.870 3.063 2.420 3.885 0.015 9 0 "[ . 1 . 2]" 1
871 1 45 GLN QB 1 47 LEU H . . 4.790 2.575 2.148 2.896 . 0 0 "[ . 1 . 2]" 1
872 1 45 GLN QB 1 47 LEU HB2 . . 4.760 3.228 2.761 3.649 . 0 0 "[ . 1 . 2]" 1
873 1 45 GLN QB 1 47 LEU HG . . 4.000 2.438 1.906 3.172 . 0 0 "[ . 1 . 2]" 1
874 1 45 GLN QB 1 48 LEU H . . 4.890 3.737 3.374 4.323 . 0 0 "[ . 1 . 2]" 1
875 1 45 GLN HB2 1 46 GLY H . . 4.700 3.624 2.371 4.549 . 0 0 "[ . 1 . 2]" 1
876 1 45 GLN HB2 1 47 LEU MD1 . . 4.260 3.637 2.162 4.174 . 0 0 "[ . 1 . 2]" 1
877 1 45 GLN HB3 1 46 GLY H . . 4.700 3.334 2.661 4.480 . 0 0 "[ . 1 . 2]" 1
878 1 45 GLN HB3 1 47 LEU MD1 . . 4.260 2.578 2.042 3.393 . 0 0 "[ . 1 . 2]" 1
879 1 45 GLN HE21 1 47 LEU MD1 . . 4.880 4.223 2.933 4.827 . 0 0 "[ . 1 . 2]" 1
880 1 45 GLN HE22 1 47 LEU MD1 . . 4.880 4.155 3.159 4.708 . 0 0 "[ . 1 . 2]" 1
881 1 45 GLN QG 1 47 LEU H . . 4.760 4.387 2.674 4.731 . 0 0 "[ . 1 . 2]" 1
882 1 45 GLN QG 1 47 LEU MD1 . . 3.900 2.793 2.428 3.151 . 0 0 "[ . 1 . 2]" 1
883 1 45 GLN QG 1 47 LEU HG . . 3.770 3.715 3.495 3.770 . 0 0 "[ . 1 . 2]" 1
884 1 45 GLN HG2 1 47 LEU MD1 . . 4.550 3.403 2.504 4.455 . 0 0 "[ . 1 . 2]" 1
885 1 45 GLN HG3 1 47 LEU MD1 . . 4.550 3.583 2.460 4.433 . 0 0 "[ . 1 . 2]" 1
886 1 46 GLY H 1 47 LEU H . . 4.080 2.909 2.275 3.384 . 0 0 "[ . 1 . 2]" 1
887 1 46 GLY QA 1 47 LEU HB2 . . 5.340 5.030 4.906 5.211 . 0 0 "[ . 1 . 2]" 1
888 1 46 GLY QA 1 47 LEU MD2 . . 5.250 4.380 3.678 5.003 . 0 0 "[ . 1 . 2]" 1
889 1 46 GLY QA 1 47 LEU HG . . 5.050 4.180 3.854 4.455 . 0 0 "[ . 1 . 2]" 1
890 1 47 LEU H 1 47 LEU HB2 . . 3.670 2.654 2.469 2.843 . 0 0 "[ . 1 . 2]" 1
891 1 47 LEU H 1 47 LEU HB3 . . 3.990 3.657 3.577 3.778 . 0 0 "[ . 1 . 2]" 1
892 1 47 LEU H 1 47 LEU MD1 . . 5.070 3.494 3.123 3.816 . 0 0 "[ . 1 . 2]" 1
893 1 47 LEU H 1 47 LEU MD2 . . 4.190 3.479 3.058 3.883 . 0 0 "[ . 1 . 2]" 1
894 1 47 LEU H 1 47 LEU HG . . 3.790 2.262 1.927 2.728 . 0 0 "[ . 1 . 2]" 1
895 1 47 LEU H 1 48 LEU H . . 3.310 2.530 2.054 3.175 . 0 0 "[ . 1 . 2]" 1
896 1 47 LEU HA 1 47 LEU MD1 . . 4.320 3.952 3.914 4.037 . 0 0 "[ . 1 . 2]" 1
897 1 47 LEU HA 1 47 LEU MD2 . . 2.900 2.334 2.017 2.588 . 0 0 "[ . 1 . 2]" 1
898 1 47 LEU HA 1 47 LEU HG . . 3.810 3.115 2.820 3.405 . 0 0 "[ . 1 . 2]" 1
899 1 47 LEU HB2 1 47 LEU MD1 . . 3.380 2.209 2.054 2.360 . 0 0 "[ . 1 . 2]" 1
900 1 47 LEU HB2 1 47 LEU MD2 . . 3.670 3.164 3.121 3.188 . 0 0 "[ . 1 . 2]" 1
901 1 47 LEU HB2 1 48 LEU H . . 4.320 2.314 1.927 2.659 . 0 0 "[ . 1 . 2]" 1
902 1 47 LEU HB2 1 48 LEU MD1 . . 4.620 3.749 3.531 3.931 . 0 0 "[ . 1 . 2]" 1
903 1 47 LEU HB3 1 47 LEU MD1 . . 3.330 2.503 2.317 2.683 . 0 0 "[ . 1 . 2]" 1
904 1 48 LEU H 1 48 LEU HB2 . . 3.560 2.649 2.470 2.762 . 0 0 "[ . 1 . 2]" 1
905 1 48 LEU H 1 48 LEU HB3 . . 4.120 3.672 3.585 3.740 . 0 0 "[ . 1 . 2]" 1
906 1 48 LEU H 1 48 LEU MD1 . . 4.530 3.335 3.118 3.624 . 0 0 "[ . 1 . 2]" 1
907 1 48 LEU H 1 48 LEU MD2 . . 4.630 3.686 3.409 3.890 . 0 0 "[ . 1 . 2]" 1
908 1 48 LEU H 1 48 LEU HG . . 3.590 2.315 1.921 2.556 . 0 0 "[ . 1 . 2]" 1
909 1 48 LEU H 1 49 HIS QB . . 5.340 5.198 4.895 5.343 0.003 10 0 "[ . 1 . 2]" 1
910 1 48 LEU HA 1 48 LEU MD1 . . 4.000 3.982 3.929 4.022 0.022 18 0 "[ . 1 . 2]" 1
911 1 48 LEU HA 1 48 LEU MD2 . . 2.990 2.523 2.362 2.664 . 0 0 "[ . 1 . 2]" 1
912 1 48 LEU HA 1 48 LEU HG . . 3.800 3.036 2.853 3.154 . 0 0 "[ . 1 . 2]" 1
913 1 48 LEU HA 1 49 HIS H . . 3.090 2.305 2.201 2.486 . 0 0 "[ . 1 . 2]" 1
914 1 48 LEU HA 1 49 HIS HD2 . . 5.500 4.551 3.185 5.483 . 0 0 "[ . 1 . 2]" 1
915 1 48 LEU HA 1 52 ASP HB2 . . 5.150 4.360 4.126 4.627 . 0 0 "[ . 1 . 2]" 1
916 1 48 LEU HB2 1 48 LEU MD1 . . 3.190 2.155 1.997 2.254 . 0 0 "[ . 1 . 2]" 1
917 1 48 LEU HB2 1 49 HIS H . . 4.320 3.642 3.206 3.982 . 0 0 "[ . 1 . 2]" 1
918 1 48 LEU HB3 1 48 LEU MD1 . . 3.250 2.577 2.454 2.672 . 0 0 "[ . 1 . 2]" 1
919 1 48 LEU HB3 1 48 LEU MD2 . . 3.160 2.125 2.029 2.225 . 0 0 "[ . 1 . 2]" 1
920 1 48 LEU HB3 1 49 HIS H . . 3.790 2.735 2.319 3.065 . 0 0 "[ . 1 . 2]" 1
921 1 48 LEU HB3 1 52 ASP HB2 . . 5.150 3.633 3.286 3.967 . 0 0 "[ . 1 . 2]" 1
922 1 48 LEU HB3 1 52 ASP HB3 . . 5.320 4.078 3.731 4.502 . 0 0 "[ . 1 . 2]" 1
923 1 48 LEU MD1 1 49 HIS H . . 5.080 4.838 4.483 5.078 . 0 0 "[ . 1 . 2]" 1
924 1 48 LEU MD2 1 49 HIS H . . 4.310 3.760 3.455 4.131 . 0 0 "[ . 1 . 2]" 1
925 1 48 LEU MD2 1 52 ASP HB2 . . 4.460 3.770 3.282 4.135 . 0 0 "[ . 1 . 2]" 1
926 1 48 LEU MD2 1 52 ASP HB3 . . 4.470 3.263 2.867 3.591 . 0 0 "[ . 1 . 2]" 1
927 1 48 LEU MD2 1 84 ILE HB . . 4.170 4.108 3.954 4.170 . 0 0 "[ . 1 . 2]" 1
928 1 48 LEU MD2 1 84 ILE QG . . 3.020 2.239 2.032 2.476 . 0 0 "[ . 1 . 2]" 1
929 1 49 HIS H 1 49 HIS QB . . 3.470 3.010 2.713 3.347 . 0 0 "[ . 1 . 2]" 1
930 1 49 HIS H 1 49 HIS HD2 . . 5.170 3.950 2.517 5.042 . 0 0 "[ . 1 . 2]" 1
931 1 49 HIS H 1 52 ASP H . . 4.830 4.274 3.749 4.777 . 0 0 "[ . 1 . 2]" 1
932 1 49 HIS H 1 52 ASP HB2 . . 4.260 3.100 2.819 3.383 . 0 0 "[ . 1 . 2]" 1
933 1 49 HIS H 1 52 ASP HB3 . . 4.780 4.116 3.901 4.368 . 0 0 "[ . 1 . 2]" 1
934 1 49 HIS HA 1 50 VAL H . . 3.130 2.435 2.271 2.629 . 0 0 "[ . 1 . 2]" 1
935 1 49 HIS QB 1 50 VAL H . . 3.480 2.419 2.054 2.821 . 0 0 "[ . 1 . 2]" 1
936 1 49 HIS QB 1 50 VAL HB . . 5.110 4.025 3.795 4.454 . 0 0 "[ . 1 . 2]" 1
937 1 49 HIS QB 1 50 VAL QG . . 4.750 3.856 3.694 4.115 . 0 0 "[ . 1 . 2]" 1
938 1 49 HIS HB2 1 50 VAL H . . 4.210 3.071 2.068 4.122 . 0 0 "[ . 1 . 2]" 1
939 1 49 HIS HB3 1 50 VAL H . . 4.210 3.195 2.211 4.060 . 0 0 "[ . 1 . 2]" 1
940 1 50 VAL H 1 50 VAL HB . . 3.200 2.582 2.497 2.716 . 0 0 "[ . 1 . 2]" 1
941 1 50 VAL H 1 50 VAL QG . . 3.150 2.173 1.909 2.326 . 0 0 "[ . 1 . 2]" 1
942 1 50 VAL HA 1 50 VAL MG1 . . 3.330 2.401 2.301 2.471 . 0 0 "[ . 1 . 2]" 1
943 1 50 VAL HA 1 50 VAL QG . . 2.850 2.089 2.039 2.167 . 0 0 "[ . 1 . 2]" 1
944 1 50 VAL HA 1 50 VAL MG2 . . 3.330 2.300 2.184 2.402 . 0 0 "[ . 1 . 2]" 1
945 1 50 VAL HA 1 51 GLY H . . 2.910 2.157 2.144 2.183 . 0 0 "[ . 1 . 2]" 1
946 1 50 VAL HA 1 51 GLY HA3 . . 4.910 4.398 4.390 4.415 . 0 0 "[ . 1 . 2]" 1
947 1 50 VAL HA 1 52 ASP H . . 4.240 3.646 3.377 4.013 . 0 0 "[ . 1 . 2]" 1
948 1 50 VAL HA 1 52 ASP HB2 . . 5.470 4.783 4.568 5.105 . 0 0 "[ . 1 . 2]" 1
949 1 50 VAL HB 1 51 GLY H . . 4.860 4.287 4.138 4.433 . 0 0 "[ . 1 . 2]" 1
950 1 50 VAL QG 1 51 GLY H . . 3.350 2.670 2.192 3.017 . 0 0 "[ . 1 . 2]" 1
951 1 50 VAL QG 1 51 GLY HA2 . . 4.300 3.448 3.163 3.663 . 0 0 "[ . 1 . 2]" 1
952 1 50 VAL MG1 1 51 GLY H . . 4.230 2.712 2.205 3.105 . 0 0 "[ . 1 . 2]" 1
953 1 50 VAL MG2 1 51 GLY H . . 4.230 4.044 3.846 4.187 . 0 0 "[ . 1 . 2]" 1
954 1 51 GLY H 1 52 ASP H . . 3.740 2.237 1.860 2.785 . 0 0 "[ . 1 . 2]" 1
955 1 51 GLY H 1 52 ASP HB2 . . 5.500 4.089 3.795 4.462 . 0 0 "[ . 1 . 2]" 1
956 1 52 ASP H 1 52 ASP HB2 . . 3.500 2.322 2.209 2.451 . 0 0 "[ . 1 . 2]" 1
957 1 52 ASP H 1 52 ASP HB3 . . 3.990 3.557 3.510 3.637 . 0 0 "[ . 1 . 2]" 1
958 1 52 ASP HB2 1 53 ILE H . . 4.720 4.430 4.247 4.558 . 0 0 "[ . 1 . 2]" 1
959 1 52 ASP HB2 1 84 ILE MD . . 4.490 3.997 3.567 4.468 . 0 0 "[ . 1 . 2]" 1
960 1 52 ASP HB2 1 84 ILE MG . . 4.100 3.438 3.299 3.572 . 0 0 "[ . 1 . 2]" 1
961 1 52 ASP HB3 1 53 ILE H . . 4.090 3.497 3.155 3.821 . 0 0 "[ . 1 . 2]" 1
962 1 52 ASP HB3 1 84 ILE HB . . 4.790 4.681 4.433 4.789 . 0 0 "[ . 1 . 2]" 1
963 1 52 ASP HB3 1 84 ILE MD . . 4.000 2.720 2.245 3.160 . 0 0 "[ . 1 . 2]" 1
964 1 52 ASP HB3 1 84 ILE QG . . 5.500 3.966 3.286 4.300 . 0 0 "[ . 1 . 2]" 1
965 1 52 ASP HB3 1 84 ILE MG . . 3.400 2.038 1.925 2.197 . 0 0 "[ . 1 . 2]" 1
966 1 53 ILE H 1 53 ILE HB . . 3.400 2.592 2.455 2.724 . 0 0 "[ . 1 . 2]" 1
967 1 53 ILE H 1 53 ILE MD . . 4.110 3.183 1.874 4.005 . 0 0 "[ . 1 . 2]" 1
968 1 53 ILE H 1 53 ILE QG . . 3.550 2.494 1.980 3.244 . 0 0 "[ . 1 . 2]" 1
969 1 53 ILE H 1 84 ILE MG . . 4.100 2.675 2.265 3.263 . 0 0 "[ . 1 . 2]" 1
970 1 53 ILE H 1 85 LEU H . . 4.060 2.958 2.712 3.145 . 0 0 "[ . 1 . 2]" 1
971 1 53 ILE H 1 85 LEU HB2 . . 4.820 4.661 4.041 4.820 . 0 0 "[ . 1 . 2]" 1
972 1 53 ILE H 1 85 LEU HB3 . . 5.500 5.217 4.666 5.388 . 0 0 "[ . 1 . 2]" 1
973 1 53 ILE HA 1 53 ILE HG12 . . 3.840 2.921 2.470 3.650 . 0 0 "[ . 1 . 2]" 1
974 1 53 ILE HA 1 53 ILE QG . . 3.350 2.483 2.322 2.922 . 0 0 "[ . 1 . 2]" 1
975 1 53 ILE HA 1 53 ILE HG13 . . 3.840 2.911 2.353 3.785 . 0 0 "[ . 1 . 2]" 1
976 1 53 ILE HA 1 53 ILE MG . . 3.250 2.297 2.192 2.427 . 0 0 "[ . 1 . 2]" 1
977 1 53 ILE HA 1 54 ILE H . . 3.150 2.153 2.140 2.192 . 0 0 "[ . 1 . 2]" 1
978 1 53 ILE HB 1 53 ILE MD . . 3.440 2.359 2.168 3.216 . 0 0 "[ . 1 . 2]" 1
979 1 53 ILE HB 1 85 LEU H . . 3.960 3.061 2.860 3.295 . 0 0 "[ . 1 . 2]" 1
980 1 53 ILE HB 1 85 LEU HB2 . . 3.310 2.941 2.185 3.133 . 0 0 "[ . 1 . 2]" 1
981 1 53 ILE HB 1 85 LEU HB3 . . 3.780 3.583 2.988 3.781 0.001 16 0 "[ . 1 . 2]" 1
982 1 53 ILE HB 1 87 GLY QA . . 5.340 4.562 3.202 5.253 . 0 0 "[ . 1 . 2]" 1
983 1 53 ILE MD 1 87 GLY HA2 . . 4.410 3.218 1.935 4.200 . 0 0 "[ . 1 . 2]" 1
984 1 53 ILE MD 1 87 GLY QA . . 3.810 2.253 1.851 3.218 . 0 0 "[ . 1 . 2]" 1
985 1 53 ILE MD 1 87 GLY HA3 . . 4.410 2.358 1.951 3.353 . 0 0 "[ . 1 . 2]" 1
986 1 53 ILE MD 1 88 PRO QD . . 4.320 3.009 2.296 3.965 . 0 0 "[ . 1 . 2]" 1
987 1 53 ILE QG 1 85 LEU HB2 . . 5.070 4.891 4.329 5.073 0.003 12 0 "[ . 1 . 2]" 1
988 1 53 ILE QG 1 87 GLY QA . . 4.630 3.642 2.453 4.473 . 0 0 "[ . 1 . 2]" 1
989 1 53 ILE MG 1 54 ILE H . . 3.550 2.422 2.053 2.725 . 0 0 "[ . 1 . 2]" 1
990 1 53 ILE MG 1 85 LEU HB2 . . 3.530 3.352 2.871 3.535 0.005 13 0 "[ . 1 . 2]" 1
991 1 54 ILE H 1 54 ILE HB . . 3.660 2.610 2.481 2.716 . 0 0 "[ . 1 . 2]" 1
992 1 54 ILE H 1 54 ILE HG12 . . 4.310 3.767 3.421 4.124 . 0 0 "[ . 1 . 2]" 1
993 1 54 ILE H 1 54 ILE QG . . 3.730 2.516 2.023 3.197 . 0 0 "[ . 1 . 2]" 1
994 1 54 ILE H 1 54 ILE HG13 . . 4.310 2.567 2.038 3.330 . 0 0 "[ . 1 . 2]" 1
995 1 54 ILE H 1 54 ILE MG . . 3.980 3.817 3.776 3.846 . 0 0 "[ . 1 . 2]" 1
996 1 54 ILE HA 1 54 ILE HG12 . . 3.830 2.970 2.490 3.592 . 0 0 "[ . 1 . 2]" 1
997 1 54 ILE HA 1 54 ILE HG13 . . 3.830 2.816 2.307 3.126 . 0 0 "[ . 1 . 2]" 1
998 1 54 ILE HA 1 54 ILE MG . . 3.160 2.347 2.151 2.452 . 0 0 "[ . 1 . 2]" 1
999 1 54 ILE HA 1 55 LYS H . . 3.030 2.177 2.138 2.327 . 0 0 "[ . 1 . 2]" 1
1000 1 54 ILE HA 1 55 LYS QB . . 5.340 4.115 4.007 4.365 . 0 0 "[ . 1 . 2]" 1
1001 1 54 ILE HA 1 56 GLU H . . 4.560 4.360 4.071 4.536 . 0 0 "[ . 1 . 2]" 1
1002 1 54 ILE HA 1 84 ILE HA . . 3.660 2.563 2.374 2.721 . 0 0 "[ . 1 . 2]" 1
1003 1 54 ILE HA 1 84 ILE HB . . 5.500 5.438 5.275 5.506 0.006 13 0 "[ . 1 . 2]" 1
1004 1 54 ILE HA 1 84 ILE MD . . 3.610 2.740 2.372 3.111 . 0 0 "[ . 1 . 2]" 1
1005 1 54 ILE HA 1 84 ILE MG . . 3.680 3.465 3.316 3.635 . 0 0 "[ . 1 . 2]" 1
1006 1 54 ILE HA 1 85 LEU H . . 4.710 4.024 3.783 4.210 . 0 0 "[ . 1 . 2]" 1
1007 1 54 ILE HB 1 54 ILE MD . . 3.460 2.271 2.087 2.516 . 0 0 "[ . 1 . 2]" 1
1008 1 54 ILE HB 1 55 LYS H . . 5.500 4.060 3.535 4.348 . 0 0 "[ . 1 . 2]" 1
1009 1 54 ILE HB 1 62 VAL MG2 . . 3.980 3.062 2.641 3.732 . 0 0 "[ . 1 . 2]" 1
1010 1 54 ILE HB 1 69 LEU MD2 . . 3.770 3.520 3.208 3.717 . 0 0 "[ . 1 . 2]" 1
1011 1 54 ILE HB 1 84 ILE MD . . 5.500 4.505 4.187 4.841 . 0 0 "[ . 1 . 2]" 1
1012 1 54 ILE MD 1 69 LEU MD2 . . 2.970 2.268 1.745 2.972 0.002 13 0 "[ . 1 . 2]" 1
1013 1 54 ILE QG 1 54 ILE MG . . 3.150 2.172 1.971 2.292 . 0 0 "[ . 1 . 2]" 1
1014 1 54 ILE QG 1 55 LYS H . . 4.380 4.210 4.031 4.374 . 0 0 "[ . 1 . 2]" 1
1015 1 54 ILE QG 1 69 LEU MD2 . . 4.240 3.699 3.197 4.146 . 0 0 "[ . 1 . 2]" 1
1016 1 54 ILE QG 1 84 ILE HA . . 4.400 3.790 3.525 4.198 . 0 0 "[ . 1 . 2]" 1
1017 1 54 ILE HG12 1 54 ILE MG . . 3.610 2.231 2.030 2.349 . 0 0 "[ . 1 . 2]" 1
1018 1 54 ILE HG12 1 69 LEU MD2 . . 4.940 4.155 3.272 4.938 . 0 0 "[ . 1 . 2]" 1
1019 1 54 ILE HG12 1 84 ILE MD . . 3.810 2.569 1.901 3.346 . 0 0 "[ . 1 . 2]" 1
1020 1 54 ILE HG13 1 54 ILE MG . . 3.610 3.026 2.627 3.202 . 0 0 "[ . 1 . 2]" 1
1021 1 54 ILE HG13 1 69 LEU MD2 . . 4.940 4.370 3.834 4.875 . 0 0 "[ . 1 . 2]" 1
1022 1 54 ILE HG13 1 84 ILE MD . . 3.810 2.931 1.906 3.676 . 0 0 "[ . 1 . 2]" 1
1023 1 54 ILE MG 1 55 LYS H . . 3.740 2.511 1.963 3.104 . 0 0 "[ . 1 . 2]" 1
1024 1 54 ILE MG 1 56 GLU H . . 3.870 3.111 2.868 3.442 . 0 0 "[ . 1 . 2]" 1
1025 1 54 ILE MG 1 69 LEU MD2 . . 3.760 3.407 2.832 3.740 . 0 0 "[ . 1 . 2]" 1
1026 1 55 LYS H 1 55 LYS HB2 . . 3.980 2.628 2.176 3.143 . 0 0 "[ . 1 . 2]" 1
1027 1 55 LYS H 1 55 LYS QB . . 3.320 2.314 2.156 2.462 . 0 0 "[ . 1 . 2]" 1
1028 1 55 LYS H 1 55 LYS HB3 . . 3.980 3.016 2.364 3.681 . 0 0 "[ . 1 . 2]" 1
1029 1 55 LYS H 1 55 LYS QD . . 4.620 4.470 4.207 4.620 . 0 0 "[ . 1 . 2]" 1
1030 1 55 LYS H 1 55 LYS HG2 . . 4.800 3.900 2.721 4.663 . 0 0 "[ . 1 . 2]" 1
1031 1 55 LYS H 1 55 LYS QG . . 3.940 3.524 2.645 3.953 0.013 3 0 "[ . 1 . 2]" 1
1032 1 55 LYS H 1 55 LYS HG3 . . 4.800 4.171 3.600 4.567 . 0 0 "[ . 1 . 2]" 1
1033 1 55 LYS H 1 56 GLU H . . 3.290 2.448 2.232 2.872 . 0 0 "[ . 1 . 2]" 1
1034 1 55 LYS H 1 83 LYS QB . . 4.830 3.147 2.624 3.630 . 0 0 "[ . 1 . 2]" 1
1035 1 55 LYS H 1 84 ILE HA . . 3.810 3.464 3.068 3.811 0.001 4 0 "[ . 1 . 2]" 1
1036 1 55 LYS H 1 84 ILE MD . . 4.450 4.137 3.777 4.341 . 0 0 "[ . 1 . 2]" 1
1037 1 55 LYS H 1 85 LEU QD . . 4.380 3.597 2.669 4.386 0.006 19 0 "[ . 1 . 2]" 1
1038 1 55 LYS HA 1 55 LYS QD . . 3.250 2.495 2.126 3.099 . 0 0 "[ . 1 . 2]" 1
1039 1 55 LYS HA 1 55 LYS QE . . 5.030 4.268 3.705 4.614 . 0 0 "[ . 1 . 2]" 1
1040 1 55 LYS HA 1 55 LYS QG . . 3.520 2.653 2.167 2.953 . 0 0 "[ . 1 . 2]" 1
1041 1 55 LYS HA 1 62 VAL MG1 . . 4.700 4.463 4.026 4.700 0.000 5 0 "[ . 1 . 2]" 1
1042 1 55 LYS HA 1 62 VAL MG2 . . 4.300 3.754 3.199 4.214 . 0 0 "[ . 1 . 2]" 1
1043 1 55 LYS QB 1 55 LYS QE . . 3.440 3.000 2.010 3.439 . 0 0 "[ . 1 . 2]" 1
1044 1 55 LYS QB 1 56 GLU H . . 3.480 2.290 2.091 2.417 . 0 0 "[ . 1 . 2]" 1
1045 1 55 LYS QB 1 83 LYS QE . . 5.180 3.742 2.434 4.765 . 0 0 "[ . 1 . 2]" 1
1046 1 55 LYS QB 1 83 LYS HG2 . . 3.810 2.596 1.996 3.261 . 0 0 "[ . 1 . 2]" 1
1047 1 55 LYS QB 1 85 LEU QD . . 3.850 2.400 1.688 3.532 . 0 0 "[ . 1 . 2]" 1
1048 1 55 LYS HB2 1 55 LYS HE2 . . 5.090 4.046 2.242 5.043 . 0 0 "[ . 1 . 2]" 1
1049 1 55 LYS HB2 1 55 LYS HE3 . . 5.090 4.112 2.042 5.125 0.035 9 0 "[ . 1 . 2]" 1
1050 1 55 LYS HB2 1 56 GLU H . . 4.140 3.069 2.216 3.845 . 0 0 "[ . 1 . 2]" 1
1051 1 55 LYS HB2 1 83 LYS HG2 . . 4.490 3.198 2.035 4.261 . 0 0 "[ . 1 . 2]" 1
1052 1 55 LYS HB3 1 55 LYS HE2 . . 5.090 4.190 2.447 5.125 0.035 5 0 "[ . 1 . 2]" 1
1053 1 55 LYS HB3 1 55 LYS HE3 . . 5.090 3.926 2.520 4.560 . 0 0 "[ . 1 . 2]" 1
1054 1 55 LYS HB3 1 56 GLU H . . 4.140 2.630 2.104 3.260 . 0 0 "[ . 1 . 2]" 1
1055 1 55 LYS HB3 1 83 LYS HG2 . . 4.490 3.330 2.008 4.475 . 0 0 "[ . 1 . 2]" 1
1056 1 55 LYS QE 1 55 LYS QG . . 3.220 2.160 2.030 2.637 . 0 0 "[ . 1 . 2]" 1
1057 1 55 LYS QE 1 85 LEU QD . . 3.480 2.680 1.867 3.396 . 0 0 "[ . 1 . 2]" 1
1058 1 55 LYS HE2 1 85 LEU MD1 . . 5.070 3.649 1.885 4.872 . 0 0 "[ . 1 . 2]" 1
1059 1 55 LYS HE2 1 85 LEU MD2 . . 5.070 3.504 2.234 5.030 . 0 0 "[ . 1 . 2]" 1
1060 1 55 LYS HE3 1 85 LEU MD1 . . 5.070 3.752 2.260 4.891 . 0 0 "[ . 1 . 2]" 1
1061 1 55 LYS HE3 1 85 LEU MD2 . . 5.070 3.897 2.475 5.073 0.003 13 0 "[ . 1 . 2]" 1
1062 1 55 LYS QG 1 85 LEU QD . . 3.300 2.442 1.657 3.301 0.001 12 0 "[ . 1 . 2]" 1
1063 1 56 GLU H 1 56 GLU QG . . 4.860 3.935 2.638 4.283 . 0 0 "[ . 1 . 2]" 1
1064 1 56 GLU H 1 62 VAL MG1 . . 4.410 4.020 3.493 4.343 . 0 0 "[ . 1 . 2]" 1
1065 1 56 GLU H 1 62 VAL MG2 . . 5.220 4.822 4.224 5.203 . 0 0 "[ . 1 . 2]" 1
1066 1 56 GLU H 1 82 LEU HA . . 5.500 5.316 4.986 5.497 . 0 0 "[ . 1 . 2]" 1
1067 1 56 GLU H 1 83 LYS H . . 3.700 3.492 3.177 3.700 . 0 0 "[ . 1 . 2]" 1
1068 1 56 GLU H 1 83 LYS QB . . 3.570 2.020 1.870 2.360 . 0 0 "[ . 1 . 2]" 1
1069 1 56 GLU H 1 84 ILE HA . . 5.500 5.370 4.955 5.510 0.010 19 0 "[ . 1 . 2]" 1
1070 1 56 GLU HA 1 56 GLU QG . . 3.530 2.500 2.154 3.502 . 0 0 "[ . 1 . 2]" 1
1071 1 56 GLU HA 1 57 VAL H . . 2.990 2.345 2.205 2.574 . 0 0 "[ . 1 . 2]" 1
1072 1 56 GLU HA 1 57 VAL HB . . 4.970 4.462 4.312 4.674 . 0 0 "[ . 1 . 2]" 1
1073 1 56 GLU HA 1 60 GLN H . . 4.730 4.209 3.649 4.458 . 0 0 "[ . 1 . 2]" 1
1074 1 56 GLU HA 1 61 PRO QB . . 5.340 5.191 4.889 5.345 0.005 19 0 "[ . 1 . 2]" 1
1075 1 56 GLU HA 1 62 VAL H . . 4.130 3.314 2.749 3.788 . 0 0 "[ . 1 . 2]" 1
1076 1 56 GLU HA 1 62 VAL MG1 . . 3.420 2.740 2.011 3.286 . 0 0 "[ . 1 . 2]" 1
1077 1 56 GLU HA 1 62 VAL MG2 . . 4.300 3.786 3.232 4.168 . 0 0 "[ . 1 . 2]" 1
1078 1 56 GLU QB 1 57 VAL H . . 3.710 3.168 2.493 3.524 . 0 0 "[ . 1 . 2]" 1
1079 1 56 GLU QB 1 60 GLN H . . 4.500 3.793 2.647 4.419 . 0 0 "[ . 1 . 2]" 1
1080 1 56 GLU QB 1 62 VAL H . . 5.340 4.905 3.867 5.343 0.003 16 0 "[ . 1 . 2]" 1
1081 1 56 GLU QB 1 83 LYS QB . . 3.390 3.094 2.615 3.398 0.008 13 0 "[ . 1 . 2]" 1
1082 1 56 GLU QB 1 83 LYS QD . . 4.080 2.978 2.330 4.072 . 0 0 "[ . 1 . 2]" 1
1083 1 56 GLU QB 1 83 LYS HG2 . . 5.200 4.741 4.104 5.189 . 0 0 "[ . 1 . 2]" 1
1084 1 56 GLU HB2 1 57 VAL H . . 4.300 3.778 2.524 4.261 . 0 0 "[ . 1 . 2]" 1
1085 1 56 GLU HB2 1 59 GLY H . . 5.500 5.092 4.007 5.494 . 0 0 "[ . 1 . 2]" 1
1086 1 56 GLU HB2 1 59 GLY HA2 . . 5.160 4.831 3.838 5.159 . 0 0 "[ . 1 . 2]" 1
1087 1 56 GLU HB2 1 60 GLN H . . 5.380 4.532 2.671 5.092 . 0 0 "[ . 1 . 2]" 1
1088 1 56 GLU HB3 1 57 VAL H . . 4.300 3.590 2.855 4.116 . 0 0 "[ . 1 . 2]" 1
1089 1 56 GLU HB3 1 59 GLY H . . 5.500 4.212 2.880 5.447 . 0 0 "[ . 1 . 2]" 1
1090 1 56 GLU HB3 1 59 GLY HA2 . . 5.160 4.338 3.148 5.135 . 0 0 "[ . 1 . 2]" 1
1091 1 56 GLU HB3 1 60 GLN H . . 5.380 4.320 2.981 5.009 . 0 0 "[ . 1 . 2]" 1
1092 1 56 GLU QG 1 57 VAL H . . 3.810 2.307 1.851 3.786 . 0 0 "[ . 1 . 2]" 1
1093 1 56 GLU QG 1 59 GLY H . . 4.460 2.819 2.327 4.227 . 0 0 "[ . 1 . 2]" 1
1094 1 56 GLU QG 1 59 GLY HA2 . . 4.630 2.780 2.309 3.537 . 0 0 "[ . 1 . 2]" 1
1095 1 56 GLU QG 1 59 GLY HA3 . . 5.050 4.184 3.769 5.075 0.025 16 0 "[ . 1 . 2]" 1
1096 1 56 GLU QG 1 60 GLN H . . 4.210 2.249 1.879 3.960 . 0 0 "[ . 1 . 2]" 1
1097 1 57 VAL H 1 57 VAL HB . . 3.560 2.871 2.448 3.450 . 0 0 "[ . 1 . 2]" 1
1098 1 57 VAL H 1 57 VAL MG1 . . 4.000 3.305 1.908 3.960 . 0 0 "[ . 1 . 2]" 1
1099 1 57 VAL H 1 57 VAL QG . . 3.480 2.637 1.903 3.118 . 0 0 "[ . 1 . 2]" 1
1100 1 57 VAL H 1 57 VAL MG2 . . 4.000 3.270 2.674 3.919 . 0 0 "[ . 1 . 2]" 1
1101 1 57 VAL H 1 60 GLN H . . 3.560 2.446 2.182 2.732 . 0 0 "[ . 1 . 2]" 1
1102 1 57 VAL H 1 60 GLN HB2 . . 5.380 4.329 3.460 5.377 . 0 0 "[ . 1 . 2]" 1
1103 1 57 VAL H 1 60 GLN QB . . 4.560 3.691 3.345 3.917 . 0 0 "[ . 1 . 2]" 1
1104 1 57 VAL H 1 60 GLN HB3 . . 5.380 4.371 3.648 4.950 . 0 0 "[ . 1 . 2]" 1
1105 1 57 VAL H 1 62 VAL MG1 . . 3.770 3.189 2.546 3.639 . 0 0 "[ . 1 . 2]" 1
1106 1 57 VAL HA 1 57 VAL MG1 . . 3.490 2.637 2.352 3.203 . 0 0 "[ . 1 . 2]" 1
1107 1 57 VAL HA 1 57 VAL QG . . 3.050 2.160 2.016 2.372 . 0 0 "[ . 1 . 2]" 1
1108 1 57 VAL HA 1 57 VAL MG2 . . 3.490 2.336 2.134 2.476 . 0 0 "[ . 1 . 2]" 1
1109 1 57 VAL HA 1 58 ASN H . . 3.080 2.149 2.140 2.169 . 0 0 "[ . 1 . 2]" 1
1110 1 57 VAL HA 1 81 ILE MG . . 3.910 3.846 3.606 3.914 0.004 19 0 "[ . 1 . 2]" 1
1111 1 57 VAL HA 1 82 LEU HA . . 3.640 2.780 2.351 3.124 . 0 0 "[ . 1 . 2]" 1
1112 1 57 VAL HA 1 82 LEU MD2 . . 3.980 3.269 2.559 3.962 . 0 0 "[ . 1 . 2]" 1
1113 1 57 VAL HA 1 83 LYS H . . 4.270 3.186 2.754 3.626 . 0 0 "[ . 1 . 2]" 1
1114 1 57 VAL HB 1 58 ASN H . . 4.560 4.304 4.058 4.493 . 0 0 "[ . 1 . 2]" 1
1115 1 57 VAL HB 1 58 ASN QD . . 5.340 4.714 3.417 5.340 . 0 0 "[ . 1 . 2]" 1
1116 1 57 VAL HB 1 60 GLN H . . 5.500 4.460 3.612 5.499 . 0 0 "[ . 1 . 2]" 1
1117 1 57 VAL HB 1 72 LEU MD1 . . 4.550 3.403 2.571 4.119 . 0 0 "[ . 1 . 2]" 1
1118 1 57 VAL QG 1 58 ASN H . . 3.610 2.648 2.205 2.941 . 0 0 "[ . 1 . 2]" 1
1119 1 57 VAL QG 1 58 ASN QB . . 3.760 2.721 2.386 3.039 . 0 0 "[ . 1 . 2]" 1
1120 1 57 VAL QG 1 58 ASN QD . . 4.160 2.466 1.758 3.199 . 0 0 "[ . 1 . 2]" 1
1121 1 57 VAL QG 1 76 ALA MB . . 4.370 3.705 3.278 4.261 . 0 0 "[ . 1 . 2]" 1
1122 1 57 VAL QG 1 82 LEU HA . . 4.430 2.695 2.171 3.490 . 0 0 "[ . 1 . 2]" 1
1123 1 57 VAL MG1 1 58 ASN H . . 4.710 3.126 2.398 4.152 . 0 0 "[ . 1 . 2]" 1
1124 1 57 VAL MG2 1 58 ASN H . . 4.710 3.602 2.217 4.138 . 0 0 "[ . 1 . 2]" 1
1125 1 58 ASN H 1 59 GLY H . . 3.970 2.779 2.626 3.003 . 0 0 "[ . 1 . 2]" 1
1126 1 58 ASN H 1 80 VAL MG1 . . 5.110 4.200 3.549 4.598 . 0 0 "[ . 1 . 2]" 1
1127 1 58 ASN H 1 81 ILE H . . 4.290 3.594 2.904 4.119 . 0 0 "[ . 1 . 2]" 1
1128 1 58 ASN H 1 81 ILE HB . . 4.270 2.877 2.368 3.179 . 0 0 "[ . 1 . 2]" 1
1129 1 58 ASN H 1 81 ILE MG . . 4.420 3.074 2.565 3.511 . 0 0 "[ . 1 . 2]" 1
1130 1 58 ASN H 1 82 LEU HA . . 4.570 3.870 3.301 4.401 . 0 0 "[ . 1 . 2]" 1
1131 1 58 ASN HA 1 58 ASN QD . . 4.610 3.926 2.414 4.249 . 0 0 "[ . 1 . 2]" 1
1132 1 58 ASN HA 1 58 ASN HD22 . . 5.350 4.711 3.899 5.316 . 0 0 "[ . 1 . 2]" 1
1133 1 58 ASN HA 1 60 GLN H . . 5.500 4.805 4.513 5.114 . 0 0 "[ . 1 . 2]" 1
1134 1 58 ASN HA 1 80 VAL MG1 . . 5.280 4.742 4.122 5.116 . 0 0 "[ . 1 . 2]" 1
1135 1 58 ASN HA 1 81 ILE H . . 4.400 3.667 2.996 4.052 . 0 0 "[ . 1 . 2]" 1
1136 1 58 ASN HA 1 81 ILE HB . . 3.660 2.753 1.999 3.310 . 0 0 "[ . 1 . 2]" 1
1137 1 58 ASN HA 1 81 ILE MG . . 4.410 3.825 2.980 4.405 . 0 0 "[ . 1 . 2]" 1
1138 1 58 ASN QB 1 58 ASN QD . . 3.030 2.120 2.066 2.423 . 0 0 "[ . 1 . 2]" 1
1139 1 58 ASN QB 1 80 VAL MG1 . . 4.350 3.570 2.285 4.330 . 0 0 "[ . 1 . 2]" 1
1140 1 58 ASN QB 1 80 VAL MG2 . . 5.340 4.713 3.749 5.343 0.003 3 0 "[ . 1 . 2]" 1
1141 1 58 ASN HB2 1 80 VAL MG1 . . 5.160 4.203 3.608 4.933 . 0 0 "[ . 1 . 2]" 1
1142 1 58 ASN HB3 1 80 VAL MG1 . . 5.160 4.196 2.303 5.105 . 0 0 "[ . 1 . 2]" 1
1143 1 58 ASN QD 1 76 ALA MB . . 4.280 2.892 1.796 3.624 . 0 0 "[ . 1 . 2]" 1
1144 1 58 ASN QD 1 80 VAL HA . . 3.680 2.743 1.983 3.682 0.002 11 0 "[ . 1 . 2]" 1
1145 1 58 ASN QD 1 80 VAL MG1 . . 3.660 2.024 1.740 2.533 . 0 0 "[ . 1 . 2]" 1
1146 1 58 ASN QD 1 80 VAL MG2 . . 4.090 2.830 2.159 3.787 . 0 0 "[ . 1 . 2]" 1
1147 1 58 ASN HD21 1 76 ALA MB . . 5.120 3.317 1.884 4.706 . 0 0 "[ . 1 . 2]" 1
1148 1 58 ASN HD21 1 80 VAL MG1 . . 4.240 2.686 1.944 3.526 . 0 0 "[ . 1 . 2]" 1
1149 1 58 ASN HD22 1 76 ALA MB . . 5.120 3.245 2.266 4.041 . 0 0 "[ . 1 . 2]" 1
1150 1 58 ASN HD22 1 80 VAL MG1 . . 4.240 2.438 1.800 3.923 . 0 0 "[ . 1 . 2]" 1
1151 1 59 GLY H 1 60 GLN H . . 3.900 2.515 2.261 2.790 . 0 0 "[ . 1 . 2]" 1
1152 1 59 GLY H 1 81 ILE HB . . 5.360 4.732 4.285 5.185 . 0 0 "[ . 1 . 2]" 1
1153 1 60 GLN H 1 60 GLN HB2 . . 4.040 3.014 2.587 3.666 . 0 0 "[ . 1 . 2]" 1
1154 1 60 GLN H 1 60 GLN QB . . 3.210 2.626 2.526 2.791 . 0 0 "[ . 1 . 2]" 1
1155 1 60 GLN H 1 60 GLN HB3 . . 4.040 3.376 2.586 3.825 . 0 0 "[ . 1 . 2]" 1
1156 1 60 GLN H 1 60 GLN QG . . 3.950 3.595 3.239 3.905 . 0 0 "[ . 1 . 2]" 1
1157 1 60 GLN HA 1 60 GLN QG . . 3.590 2.524 2.145 2.830 . 0 0 "[ . 1 . 2]" 1
1158 1 60 GLN HA 1 61 PRO HD2 . . 3.220 2.245 2.168 2.463 . 0 0 "[ . 1 . 2]" 1
1159 1 60 GLN HA 1 61 PRO HD3 . . 3.060 2.262 2.251 2.324 . 0 0 "[ . 1 . 2]" 1
1160 1 60 GLN HA 1 61 PRO QG . . 4.940 3.910 3.866 4.042 . 0 0 "[ . 1 . 2]" 1
1161 1 60 GLN QB 1 61 PRO HD2 . . 3.380 2.645 2.054 3.096 . 0 0 "[ . 1 . 2]" 1
1162 1 60 GLN QB 1 61 PRO HD3 . . 4.280 3.796 3.413 4.025 . 0 0 "[ . 1 . 2]" 1
1163 1 60 GLN HB2 1 61 PRO HD2 . . 4.200 3.654 3.148 4.046 . 0 0 "[ . 1 . 2]" 1
1164 1 60 GLN HB3 1 61 PRO HD2 . . 4.200 3.031 2.065 4.145 . 0 0 "[ . 1 . 2]" 1
1165 1 60 GLN HG2 1 61 PRO HD2 . . 4.550 3.415 2.572 4.437 . 0 0 "[ . 1 . 2]" 1
1166 1 60 GLN HG3 1 61 PRO HD2 . . 4.550 3.319 1.992 4.487 . 0 0 "[ . 1 . 2]" 1
1167 1 61 PRO QB 1 62 VAL H . . 3.770 3.355 2.893 3.632 . 0 0 "[ . 1 . 2]" 1
1168 1 61 PRO QB 1 62 VAL MG2 . . 5.060 4.257 3.843 4.582 . 0 0 "[ . 1 . 2]" 1
1169 1 61 PRO QB 1 63 GLY H . . 4.460 2.903 2.366 3.426 . 0 0 "[ . 1 . 2]" 1
1170 1 61 PRO HB2 1 62 VAL H . . 4.290 3.586 3.025 3.926 . 0 0 "[ . 1 . 2]" 1
1171 1 61 PRO HB3 1 62 VAL H . . 4.290 4.041 3.680 4.280 . 0 0 "[ . 1 . 2]" 1
1172 1 62 VAL H 1 62 VAL HB . . 4.160 3.634 3.597 3.731 . 0 0 "[ . 1 . 2]" 1
1173 1 62 VAL H 1 62 VAL MG1 . . 3.410 2.391 2.135 2.677 . 0 0 "[ . 1 . 2]" 1
1174 1 62 VAL H 1 62 VAL MG2 . . 3.210 2.042 1.891 2.316 . 0 0 "[ . 1 . 2]" 1
1175 1 62 VAL H 1 63 GLY H . . 3.720 2.568 2.134 3.632 . 0 0 "[ . 1 . 2]" 1
1176 1 62 VAL HA 1 62 VAL MG1 . . 3.080 2.319 2.197 2.458 . 0 0 "[ . 1 . 2]" 1
1177 1 62 VAL HA 1 62 VAL MG2 . . 3.750 3.193 3.183 3.203 . 0 0 "[ . 1 . 2]" 1
1178 1 62 VAL HA 1 63 GLY H . . 3.560 3.379 2.425 3.525 . 0 0 "[ . 1 . 2]" 1
1179 1 62 VAL HA 1 69 LEU MD2 . . 5.050 4.824 4.199 5.051 0.001 3 0 "[ . 1 . 2]" 1
1180 1 62 VAL HB 1 63 GLY H . . 4.220 4.040 3.763 4.242 0.022 6 0 "[ . 1 . 2]" 1
1181 1 62 VAL HB 1 69 LEU HA . . 4.850 4.534 3.979 4.841 . 0 0 "[ . 1 . 2]" 1
1182 1 62 VAL HB 1 69 LEU HB2 . . 4.510 2.967 2.556 3.180 . 0 0 "[ . 1 . 2]" 1
1183 1 62 VAL HB 1 69 LEU HB3 . . 4.710 4.499 4.129 4.703 . 0 0 "[ . 1 . 2]" 1
1184 1 62 VAL HB 1 69 LEU MD2 . . 3.690 2.955 2.350 3.255 . 0 0 "[ . 1 . 2]" 1
1185 1 62 VAL MG1 1 63 GLY H . . 4.350 4.055 3.838 4.335 . 0 0 "[ . 1 . 2]" 1
1186 1 62 VAL MG2 1 63 GLY H . . 3.970 2.461 1.986 4.000 0.030 6 0 "[ . 1 . 2]" 1
1187 1 62 VAL MG2 1 69 LEU HB2 . . 4.310 4.234 3.823 4.314 0.004 5 0 "[ . 1 . 2]" 1
1188 1 62 VAL MG2 1 69 LEU HB3 . . 5.500 5.334 5.067 5.485 . 0 0 "[ . 1 . 2]" 1
1189 1 62 VAL MG2 1 69 LEU MD2 . . 3.920 3.580 3.314 3.919 . 0 0 "[ . 1 . 2]" 1
1190 1 63 GLY QA 1 65 ASP H . . 5.050 3.307 2.938 3.788 . 0 0 "[ . 1 . 2]" 1
1191 1 64 SER H 1 65 ASP H . . 4.060 2.837 1.976 3.278 . 0 0 "[ . 1 . 2]" 1
1192 1 65 ASP H 1 65 ASP HB2 . . 4.070 2.612 2.205 3.678 . 0 0 "[ . 1 . 2]" 1
1193 1 65 ASP H 1 65 ASP QB . . 3.460 2.525 2.143 3.104 . 0 0 "[ . 1 . 2]" 1
1194 1 65 ASP H 1 65 ASP HB3 . . 4.070 3.549 2.896 3.865 . 0 0 "[ . 1 . 2]" 1
1195 1 65 ASP H 1 68 ALA MB . . 4.480 4.273 3.753 4.493 0.013 3 0 "[ . 1 . 2]" 1
1196 1 65 ASP HA 1 66 PRO HD2 . . 3.060 1.950 1.913 2.031 . 0 0 "[ . 1 . 2]" 1
1197 1 65 ASP HA 1 66 PRO HD3 . . 3.060 2.395 2.284 2.589 . 0 0 "[ . 1 . 2]" 1
1198 1 65 ASP HA 1 66 PRO HG2 . . 4.540 4.150 4.115 4.218 . 0 0 "[ . 1 . 2]" 1
1199 1 65 ASP HA 1 66 PRO HG3 . . 4.520 4.343 4.315 4.431 . 0 0 "[ . 1 . 2]" 1
1200 1 65 ASP HA 1 67 ARG H . . 4.650 3.969 3.582 4.194 . 0 0 "[ . 1 . 2]" 1
1201 1 65 ASP HA 1 68 ALA H . . 5.330 4.267 4.047 4.467 . 0 0 "[ . 1 . 2]" 1
1202 1 65 ASP HA 1 68 ALA MB . . 4.940 4.215 3.992 4.441 . 0 0 "[ . 1 . 2]" 1
1203 1 65 ASP QB 1 66 PRO QD . . 4.100 3.233 2.860 3.732 . 0 0 "[ . 1 . 2]" 1
1204 1 65 ASP QB 1 68 ALA H . . 4.020 2.687 2.362 3.184 . 0 0 "[ . 1 . 2]" 1
1205 1 65 ASP QB 1 68 ALA MB . . 3.030 1.927 1.792 2.057 . 0 0 "[ . 1 . 2]" 1
1206 1 65 ASP HB2 1 68 ALA MB . . 3.760 2.371 1.959 3.373 . 0 0 "[ . 1 . 2]" 1
1207 1 65 ASP HB3 1 68 ALA MB . . 3.760 2.198 1.966 3.345 . 0 0 "[ . 1 . 2]" 1
1208 1 66 PRO HA 1 69 LEU H . . 4.060 3.341 3.237 3.439 . 0 0 "[ . 1 . 2]" 1
1209 1 66 PRO HA 1 69 LEU HB2 . . 4.070 3.736 3.406 3.933 . 0 0 "[ . 1 . 2]" 1
1210 1 66 PRO HA 1 69 LEU HB3 . . 3.530 2.520 2.374 2.624 . 0 0 "[ . 1 . 2]" 1
1211 1 66 PRO HA 1 69 LEU MD2 . . 4.510 2.924 2.660 3.130 . 0 0 "[ . 1 . 2]" 1
1212 1 66 PRO HA 1 70 GLN H . . 4.830 4.097 3.794 4.394 . 0 0 "[ . 1 . 2]" 1
1213 1 66 PRO HB2 1 67 ARG H . . 3.730 3.004 2.863 3.270 . 0 0 "[ . 1 . 2]" 1
1214 1 66 PRO HB2 1 67 ARG QD . . 5.500 5.402 4.977 5.506 0.006 1 0 "[ . 1 . 2]" 1
1215 1 66 PRO HB2 1 67 ARG HG2 . . 4.680 4.454 3.818 4.681 0.001 20 0 "[ . 1 . 2]" 1
1216 1 66 PRO HB2 1 67 ARG QG . . 4.060 3.582 3.239 3.712 . 0 0 "[ . 1 . 2]" 1
1217 1 66 PRO HB2 1 67 ARG HG3 . . 4.680 3.866 3.308 4.594 . 0 0 "[ . 1 . 2]" 1
1218 1 66 PRO HB3 1 67 ARG H . . 4.560 3.950 3.870 4.104 . 0 0 "[ . 1 . 2]" 1
1219 1 66 PRO HB3 1 69 LEU H . . 5.500 5.480 5.406 5.523 0.023 17 0 "[ . 1 . 2]" 1
1220 1 66 PRO HB3 1 69 LEU HB3 . . 5.500 4.706 4.583 4.845 . 0 0 "[ . 1 . 2]" 1
1221 1 66 PRO QD 1 67 ARG H . . 3.500 2.665 2.603 2.715 . 0 0 "[ . 1 . 2]" 1
1222 1 66 PRO QD 1 68 ALA H . . 4.980 4.045 3.923 4.145 . 0 0 "[ . 1 . 2]" 1
1223 1 66 PRO QD 1 68 ALA MB . . 5.350 4.621 4.434 4.771 . 0 0 "[ . 1 . 2]" 1
1224 1 66 PRO HD2 1 67 ARG H . . 4.280 2.716 2.648 2.773 . 0 0 "[ . 1 . 2]" 1
1225 1 66 PRO HD3 1 67 ARG H . . 4.280 3.859 3.837 3.881 . 0 0 "[ . 1 . 2]" 1
1226 1 66 PRO HG2 1 67 ARG H . . 4.890 2.017 1.891 2.291 . 0 0 "[ . 1 . 2]" 1
1227 1 66 PRO HG3 1 67 ARG H . . 3.830 3.618 3.522 3.822 . 0 0 "[ . 1 . 2]" 1
1228 1 67 ARG H 1 67 ARG QB . . 3.030 2.549 2.458 2.640 . 0 0 "[ . 1 . 2]" 1
1229 1 67 ARG H 1 67 ARG QD . . 5.140 3.636 3.105 4.091 . 0 0 "[ . 1 . 2]" 1
1230 1 67 ARG H 1 67 ARG HG2 . . 4.260 3.209 2.541 3.496 . 0 0 "[ . 1 . 2]" 1
1231 1 67 ARG H 1 67 ARG QG . . 3.660 2.012 1.885 2.163 . 0 0 "[ . 1 . 2]" 1
1232 1 67 ARG H 1 67 ARG HG3 . . 4.260 2.046 1.903 2.260 . 0 0 "[ . 1 . 2]" 1
1233 1 67 ARG H 1 68 ALA H . . 3.200 2.659 2.537 2.741 . 0 0 "[ . 1 . 2]" 1
1234 1 67 ARG H 1 68 ALA MB . . 4.330 4.263 4.131 4.337 0.007 17 0 "[ . 1 . 2]" 1
1235 1 67 ARG HA 1 67 ARG QD . . 4.230 4.096 3.678 4.239 0.009 20 0 "[ . 1 . 2]" 1
1236 1 67 ARG HA 1 67 ARG HG2 . . 3.800 2.679 2.526 2.948 . 0 0 "[ . 1 . 2]" 1
1237 1 67 ARG HA 1 67 ARG HG3 . . 3.800 3.132 2.881 3.578 . 0 0 "[ . 1 . 2]" 1
1238 1 67 ARG HA 1 68 ALA MB . . 5.460 4.975 4.877 5.004 . 0 0 "[ . 1 . 2]" 1
1239 1 67 ARG HA 1 69 LEU H . . 5.000 4.186 3.990 4.315 . 0 0 "[ . 1 . 2]" 1
1240 1 67 ARG HA 1 69 LEU HB3 . . 5.500 5.176 5.009 5.393 . 0 0 "[ . 1 . 2]" 1
1241 1 67 ARG HA 1 70 GLN QB . . 3.520 3.346 3.014 3.520 0.000 10 0 "[ . 1 . 2]" 1
1242 1 67 ARG QB 1 67 ARG QD . . 3.340 2.190 2.102 2.507 . 0 0 "[ . 1 . 2]" 1
1243 1 67 ARG QB 1 68 ALA H . . 3.380 2.795 2.598 3.204 . 0 0 "[ . 1 . 2]" 1
1244 1 67 ARG QB 1 68 ALA MB . . 4.020 3.764 3.638 3.844 . 0 0 "[ . 1 . 2]" 1
1245 1 67 ARG QD 1 68 ALA H . . 5.500 4.906 4.505 5.484 . 0 0 "[ . 1 . 2]" 1
1246 1 67 ARG QG 1 68 ALA H . . 4.560 4.009 3.857 4.175 . 0 0 "[ . 1 . 2]" 1
1247 1 67 ARG HG2 1 68 ALA H . . 5.430 5.010 4.621 5.335 . 0 0 "[ . 1 . 2]" 1
1248 1 67 ARG HG3 1 68 ALA H . . 5.430 4.220 4.122 4.412 . 0 0 "[ . 1 . 2]" 1
1249 1 68 ALA H 1 68 ALA MB . . 2.910 2.098 2.045 2.310 . 0 0 "[ . 1 . 2]" 1
1250 1 68 ALA H 1 69 LEU H . . 3.390 2.392 2.113 2.515 . 0 0 "[ . 1 . 2]" 1
1251 1 68 ALA HA 1 71 GLU H . . 3.910 3.735 3.537 3.842 . 0 0 "[ . 1 . 2]" 1
1252 1 68 ALA HA 1 71 GLU QB . . 3.440 2.866 2.709 3.434 . 0 0 "[ . 1 . 2]" 1
1253 1 68 ALA HA 1 71 GLU QG . . 4.680 4.368 2.770 4.682 0.002 12 0 "[ . 1 . 2]" 1
1254 1 68 ALA HA 1 72 LEU H . . 4.710 4.682 4.597 4.713 0.003 9 0 "[ . 1 . 2]" 1
1255 1 68 ALA MB 1 69 LEU H . . 3.370 2.922 2.779 3.112 . 0 0 "[ . 1 . 2]" 1
1256 1 68 ALA MB 1 70 GLN H . . 5.030 4.953 4.774 5.045 0.015 19 0 "[ . 1 . 2]" 1
1257 1 68 ALA MB 1 71 GLU QG . . 5.300 5.048 3.735 5.295 . 0 0 "[ . 1 . 2]" 1
1258 1 69 LEU H 1 69 LEU HB2 . . 3.400 2.944 2.753 3.037 . 0 0 "[ . 1 . 2]" 1
1259 1 69 LEU H 1 69 LEU HB3 . . 3.130 2.178 2.148 2.277 . 0 0 "[ . 1 . 2]" 1
1260 1 69 LEU H 1 69 LEU MD1 . . 4.370 4.308 4.221 4.362 . 0 0 "[ . 1 . 2]" 1
1261 1 69 LEU H 1 69 LEU MD2 . . 4.680 4.084 3.996 4.175 . 0 0 "[ . 1 . 2]" 1
1262 1 69 LEU H 1 69 LEU HG . . 4.510 4.135 4.055 4.301 . 0 0 "[ . 1 . 2]" 1
1263 1 69 LEU H 1 70 GLN H . . 3.420 2.692 2.300 2.945 . 0 0 "[ . 1 . 2]" 1
1264 1 69 LEU H 1 70 GLN QB . . 5.160 4.551 4.269 4.710 . 0 0 "[ . 1 . 2]" 1
1265 1 69 LEU HA 1 69 LEU MD1 . . 2.970 2.544 2.399 2.629 . 0 0 "[ . 1 . 2]" 1
1266 1 69 LEU HA 1 69 LEU MD2 . . 4.260 4.000 3.934 4.033 . 0 0 "[ . 1 . 2]" 1
1267 1 69 LEU HA 1 69 LEU HG . . 4.000 3.407 3.296 3.487 . 0 0 "[ . 1 . 2]" 1
1268 1 69 LEU HA 1 72 LEU H . . 3.930 3.104 3.054 3.207 . 0 0 "[ . 1 . 2]" 1
1269 1 69 LEU HA 1 72 LEU HB2 . . 4.260 4.262 4.244 4.285 0.025 4 0 "[ . 1 . 2]" 1
1270 1 69 LEU HA 1 72 LEU HB3 . . 3.760 2.659 2.634 2.699 . 0 0 "[ . 1 . 2]" 1
1271 1 69 LEU HA 1 72 LEU MD2 . . 2.960 1.989 1.976 2.060 . 0 0 "[ . 1 . 2]" 1
1272 1 69 LEU HA 1 72 LEU HG . . 4.680 3.323 3.170 3.484 . 0 0 "[ . 1 . 2]" 1
1273 1 69 LEU HA 1 73 LEU H . . 4.650 4.553 4.415 4.655 0.005 10 0 "[ . 1 . 2]" 1
1274 1 69 LEU HA 1 73 LEU HG . . 5.440 5.248 5.026 5.434 . 0 0 "[ . 1 . 2]" 1
1275 1 69 LEU HB2 1 69 LEU MD1 . . 3.520 2.213 2.134 2.344 . 0 0 "[ . 1 . 2]" 1
1276 1 69 LEU HB2 1 69 LEU MD2 . . 3.550 2.481 2.410 2.558 . 0 0 "[ . 1 . 2]" 1
1277 1 69 LEU HB2 1 70 GLN H . . 4.420 3.886 3.729 4.043 . 0 0 "[ . 1 . 2]" 1
1278 1 69 LEU HB2 1 72 LEU HB3 . . 5.160 4.803 4.749 4.948 . 0 0 "[ . 1 . 2]" 1
1279 1 69 LEU HB3 1 69 LEU MD1 . . 3.500 3.181 3.163 3.194 . 0 0 "[ . 1 . 2]" 1
1280 1 69 LEU HB3 1 69 LEU MD2 . . 3.310 2.206 2.102 2.273 . 0 0 "[ . 1 . 2]" 1
1281 1 69 LEU HB3 1 70 GLN H . . 3.690 2.535 2.281 2.738 . 0 0 "[ . 1 . 2]" 1
1282 1 69 LEU HB3 1 73 LEU MD1 . . 5.500 5.174 4.904 5.317 . 0 0 "[ . 1 . 2]" 1
1283 1 69 LEU MD1 1 72 LEU H . . 4.870 4.000 3.735 4.351 . 0 0 "[ . 1 . 2]" 1
1284 1 69 LEU MD1 1 73 LEU H . . 4.130 3.567 3.232 4.051 . 0 0 "[ . 1 . 2]" 1
1285 1 69 LEU MD1 1 73 LEU HG . . 3.080 2.807 2.552 3.079 . 0 0 "[ . 1 . 2]" 1
1286 1 69 LEU MD2 1 70 GLN H . . 4.980 3.650 3.350 3.994 . 0 0 "[ . 1 . 2]" 1
1287 1 69 LEU MD2 1 73 LEU MD1 . . 3.920 3.536 3.273 3.665 . 0 0 "[ . 1 . 2]" 1
1288 1 69 LEU HG 1 70 GLN H . . 4.260 2.719 2.499 3.272 . 0 0 "[ . 1 . 2]" 1
1289 1 69 LEU HG 1 70 GLN HA . . 4.120 2.941 2.808 3.197 . 0 0 "[ . 1 . 2]" 1
1290 1 69 LEU HG 1 73 LEU MD1 . . 3.390 3.034 2.726 3.227 . 0 0 "[ . 1 . 2]" 1
1291 1 69 LEU HG 1 73 LEU HG . . 4.630 4.397 4.166 4.603 . 0 0 "[ . 1 . 2]" 1
1292 1 70 GLN H 1 70 GLN QB . . 3.020 2.464 2.230 2.598 . 0 0 "[ . 1 . 2]" 1
1293 1 70 GLN H 1 70 GLN HG2 . . 3.920 3.567 3.396 3.826 . 0 0 "[ . 1 . 2]" 1
1294 1 70 GLN H 1 70 GLN HG3 . . 3.920 2.176 1.901 2.735 . 0 0 "[ . 1 . 2]" 1
1295 1 70 GLN H 1 73 LEU MD1 . . 4.990 4.548 4.315 4.702 . 0 0 "[ . 1 . 2]" 1
1296 1 70 GLN HA 1 70 GLN HG2 . . 3.820 2.700 2.314 2.850 . 0 0 "[ . 1 . 2]" 1
1297 1 70 GLN HA 1 70 GLN HG3 . . 3.820 2.818 2.591 2.925 . 0 0 "[ . 1 . 2]" 1
1298 1 70 GLN HA 1 72 LEU H . . 4.370 4.335 4.286 4.371 0.001 8 0 "[ . 1 . 2]" 1
1299 1 70 GLN HA 1 72 LEU HG . . 4.630 4.470 4.371 4.580 . 0 0 "[ . 1 . 2]" 1
1300 1 70 GLN HA 1 73 LEU H . . 4.200 3.837 3.670 3.928 . 0 0 "[ . 1 . 2]" 1
1301 1 70 GLN HA 1 73 LEU HB2 . . 3.870 3.528 3.219 3.654 . 0 0 "[ . 1 . 2]" 1
1302 1 70 GLN HA 1 73 LEU HB3 . . 5.230 5.166 4.852 5.237 0.007 12 0 "[ . 1 . 2]" 1
1303 1 70 GLN HA 1 73 LEU MD1 . . 3.830 2.607 2.270 2.811 . 0 0 "[ . 1 . 2]" 1
1304 1 70 GLN QB 1 71 GLU H . . 3.650 2.988 2.781 3.097 . 0 0 "[ . 1 . 2]" 1
1305 1 71 GLU H 1 71 GLU HB2 . . 3.580 2.785 2.206 3.612 0.032 4 0 "[ . 1 . 2]" 1
1306 1 71 GLU H 1 71 GLU QB . . 3.020 2.261 2.177 2.363 . 0 0 "[ . 1 . 2]" 1
1307 1 71 GLU H 1 71 GLU HB3 . . 3.580 2.512 2.251 3.489 . 0 0 "[ . 1 . 2]" 1
1308 1 71 GLU H 1 71 GLU QG . . 4.050 3.810 2.577 4.083 0.033 14 0 "[ . 1 . 2]" 1
1309 1 71 GLU H 1 72 LEU H . . 3.450 2.317 2.211 2.491 . 0 0 "[ . 1 . 2]" 1
1310 1 71 GLU HA 1 71 GLU QG . . 3.480 2.559 2.195 3.268 . 0 0 "[ . 1 . 2]" 1
1311 1 71 GLU HA 1 74 ARG H . . 3.900 3.387 3.314 3.494 . 0 0 "[ . 1 . 2]" 1
1312 1 71 GLU HA 1 74 ARG QB . . 3.310 2.684 2.480 2.801 . 0 0 "[ . 1 . 2]" 1
1313 1 71 GLU HA 1 74 ARG HD2 . . 4.860 4.229 3.397 4.859 . 0 0 "[ . 1 . 2]" 1
1314 1 71 GLU HA 1 74 ARG QD . . 4.260 3.474 3.066 3.738 . 0 0 "[ . 1 . 2]" 1
1315 1 71 GLU HA 1 74 ARG HD3 . . 4.860 3.825 3.099 4.510 . 0 0 "[ . 1 . 2]" 1
1316 1 71 GLU HA 1 74 ARG HG2 . . 5.500 5.254 4.828 5.491 . 0 0 "[ . 1 . 2]" 1
1317 1 71 GLU HA 1 74 ARG HG3 . . 5.380 5.226 4.884 5.368 . 0 0 "[ . 1 . 2]" 1
1318 1 71 GLU QB 1 72 LEU H . . 3.470 2.822 2.696 3.469 . 0 0 "[ . 1 . 2]" 1
1319 1 71 GLU HB2 1 72 LEU H . . 4.200 3.945 2.976 4.156 . 0 0 "[ . 1 . 2]" 1
1320 1 71 GLU HB3 1 72 LEU H . . 4.200 2.944 2.748 3.724 . 0 0 "[ . 1 . 2]" 1
1321 1 71 GLU QG 1 72 LEU H . . 4.610 3.741 2.314 4.436 . 0 0 "[ . 1 . 2]" 1
1322 1 71 GLU QG 1 75 ASN HD21 . . 4.730 3.674 3.001 4.709 . 0 0 "[ . 1 . 2]" 1
1323 1 71 GLU QG 1 75 ASN QD . . 4.100 3.251 2.437 4.080 . 0 0 "[ . 1 . 2]" 1
1324 1 71 GLU QG 1 75 ASN HD22 . . 4.730 3.844 2.490 4.697 . 0 0 "[ . 1 . 2]" 1
1325 1 72 LEU H 1 72 LEU HB2 . . 3.490 3.495 3.482 3.504 0.014 2 0 "[ . 1 . 2]" 1
1326 1 72 LEU H 1 72 LEU HB3 . . 3.210 2.185 2.164 2.198 . 0 0 "[ . 1 . 2]" 1
1327 1 72 LEU H 1 72 LEU MD1 . . 4.530 4.007 3.972 4.062 . 0 0 "[ . 1 . 2]" 1
1328 1 72 LEU H 1 72 LEU MD2 . . 4.670 3.543 3.509 3.594 . 0 0 "[ . 1 . 2]" 1
1329 1 72 LEU H 1 72 LEU HG . . 4.430 2.912 2.872 2.977 . 0 0 "[ . 1 . 2]" 1
1330 1 72 LEU H 1 73 LEU H . . 3.500 2.711 2.673 2.762 . 0 0 "[ . 1 . 2]" 1
1331 1 72 LEU HA 1 72 LEU MD1 . . 3.470 3.189 3.157 3.255 . 0 0 "[ . 1 . 2]" 1
1332 1 72 LEU HA 1 72 LEU MD2 . . 4.330 4.136 4.133 4.138 . 0 0 "[ . 1 . 2]" 1
1333 1 72 LEU HA 1 72 LEU HG . . 3.840 3.760 3.744 3.772 . 0 0 "[ . 1 . 2]" 1
1334 1 72 LEU HA 1 75 ASN H . . 4.590 3.949 3.695 4.195 . 0 0 "[ . 1 . 2]" 1
1335 1 72 LEU HA 1 75 ASN QB . . 4.170 3.843 3.557 4.174 0.004 16 0 "[ . 1 . 2]" 1
1336 1 72 LEU HA 1 75 ASN QD . . 4.860 3.479 1.839 4.810 . 0 0 "[ . 1 . 2]" 1
1337 1 72 LEU HB2 1 72 LEU MD2 . . 3.340 2.488 2.456 2.530 . 0 0 "[ . 1 . 2]" 1
1338 1 72 LEU HB2 1 73 LEU H . . 4.160 3.971 3.935 4.035 . 0 0 "[ . 1 . 2]" 1
1339 1 72 LEU HB3 1 72 LEU MD1 . . 3.660 3.164 3.158 3.168 . 0 0 "[ . 1 . 2]" 1
1340 1 72 LEU HB3 1 72 LEU MD2 . . 3.440 2.246 2.197 2.282 . 0 0 "[ . 1 . 2]" 1
1341 1 72 LEU HB3 1 73 LEU H . . 3.640 3.569 3.527 3.610 . 0 0 "[ . 1 . 2]" 1
1342 1 72 LEU MD1 1 73 LEU H . . 4.260 2.663 2.553 2.793 . 0 0 "[ . 1 . 2]" 1
1343 1 72 LEU MD1 1 73 LEU HA . . 4.030 2.106 1.995 2.239 . 0 0 "[ . 1 . 2]" 1
1344 1 72 LEU MD1 1 73 LEU HG . . 3.250 2.123 1.969 2.387 . 0 0 "[ . 1 . 2]" 1
1345 1 72 LEU MD2 1 73 LEU H . . 4.270 3.710 3.658 3.788 . 0 0 "[ . 1 . 2]" 1
1346 1 72 LEU MD2 1 73 LEU HA . . 4.660 4.646 4.580 4.668 0.008 18 0 "[ . 1 . 2]" 1
1347 1 72 LEU HG 1 73 LEU H . . 4.630 1.965 1.900 2.065 . 0 0 "[ . 1 . 2]" 1
1348 1 72 LEU HG 1 73 LEU HA . . 5.210 3.627 3.536 3.676 . 0 0 "[ . 1 . 2]" 1
1349 1 72 LEU HG 1 73 LEU MD2 . . 4.080 3.847 3.697 3.983 . 0 0 "[ . 1 . 2]" 1
1350 1 73 LEU H 1 73 LEU HB2 . . 3.370 2.372 2.302 2.444 . 0 0 "[ . 1 . 2]" 1
1351 1 73 LEU H 1 73 LEU HB3 . . 3.910 3.570 3.550 3.584 . 0 0 "[ . 1 . 2]" 1
1352 1 73 LEU H 1 73 LEU MD1 . . 4.000 3.225 3.134 3.400 . 0 0 "[ . 1 . 2]" 1
1353 1 73 LEU H 1 73 LEU MD2 . . 4.050 3.874 3.778 3.949 . 0 0 "[ . 1 . 2]" 1
1354 1 73 LEU H 1 73 LEU HG . . 3.190 2.527 2.380 2.645 . 0 0 "[ . 1 . 2]" 1
1355 1 73 LEU H 1 76 ALA MB . . 5.160 4.267 4.024 4.438 . 0 0 "[ . 1 . 2]" 1
1356 1 73 LEU HA 1 73 LEU MD2 . . 2.870 2.521 2.299 2.588 . 0 0 "[ . 1 . 2]" 1
1357 1 73 LEU HA 1 73 LEU HG . . 3.600 2.731 2.670 2.801 . 0 0 "[ . 1 . 2]" 1
1358 1 73 LEU HA 1 76 ALA H . . 4.110 3.384 2.928 3.997 . 0 0 "[ . 1 . 2]" 1
1359 1 73 LEU HA 1 76 ALA MB . . 3.270 2.018 1.969 2.128 . 0 0 "[ . 1 . 2]" 1
1360 1 73 LEU HA 1 80 VAL MG1 . . 4.500 3.904 3.694 4.312 . 0 0 "[ . 1 . 2]" 1
1361 1 73 LEU HB2 1 73 LEU MD1 . . 3.250 2.128 1.987 2.227 . 0 0 "[ . 1 . 2]" 1
1362 1 73 LEU HB2 1 73 LEU MD2 . . 3.670 3.126 3.115 3.150 . 0 0 "[ . 1 . 2]" 1
1363 1 73 LEU HB2 1 74 ARG H . . 3.730 2.579 2.404 3.000 . 0 0 "[ . 1 . 2]" 1
1364 1 73 LEU HB3 1 73 LEU MD1 . . 3.270 2.615 2.508 2.681 . 0 0 "[ . 1 . 2]" 1
1365 1 73 LEU HB3 1 73 LEU MD2 . . 3.370 2.058 2.017 2.228 . 0 0 "[ . 1 . 2]" 1
1366 1 73 LEU HB3 1 74 ARG H . . 4.190 3.483 3.319 3.835 . 0 0 "[ . 1 . 2]" 1
1367 1 73 LEU HB3 1 74 ARG HA . . 4.850 4.290 4.187 4.422 . 0 0 "[ . 1 . 2]" 1
1368 1 73 LEU HG 1 76 ALA MB . . 4.290 4.228 4.176 4.287 . 0 0 "[ . 1 . 2]" 1
1369 1 74 ARG H 1 74 ARG QB . . 3.070 2.233 2.122 2.277 . 0 0 "[ . 1 . 2]" 1
1370 1 74 ARG H 1 74 ARG HD2 . . 5.350 4.988 4.446 5.383 0.033 16 0 "[ . 1 . 2]" 1
1371 1 74 ARG H 1 74 ARG HD3 . . 5.350 4.821 4.175 5.276 . 0 0 "[ . 1 . 2]" 1
1372 1 74 ARG H 1 75 ASN H . . 3.620 3.001 2.636 3.179 . 0 0 "[ . 1 . 2]" 1
1373 1 74 ARG H 1 76 ALA H . . 5.140 4.288 3.852 4.592 . 0 0 "[ . 1 . 2]" 1
1374 1 74 ARG H 1 76 ALA MB . . 5.500 4.484 4.206 4.706 . 0 0 "[ . 1 . 2]" 1
1375 1 74 ARG HA 1 74 ARG HD2 . . 5.230 4.323 4.015 4.674 . 0 0 "[ . 1 . 2]" 1
1376 1 74 ARG HA 1 74 ARG QD . . 4.510 3.936 3.738 4.131 . 0 0 "[ . 1 . 2]" 1
1377 1 74 ARG HA 1 74 ARG HD3 . . 5.230 4.558 4.065 4.727 . 0 0 "[ . 1 . 2]" 1
1378 1 74 ARG HA 1 74 ARG HG2 . . 3.910 3.118 2.938 3.400 . 0 0 "[ . 1 . 2]" 1
1379 1 74 ARG HA 1 74 ARG HG3 . . 3.660 2.528 2.204 2.874 . 0 0 "[ . 1 . 2]" 1
1380 1 74 ARG QB 1 74 ARG HD2 . . 3.680 2.531 2.184 3.205 . 0 0 "[ . 1 . 2]" 1
1381 1 74 ARG QB 1 74 ARG HD3 . . 3.680 2.297 2.068 2.619 . 0 0 "[ . 1 . 2]" 1
1382 1 74 ARG QB 1 75 ASN H . . 3.630 2.388 2.119 2.755 . 0 0 "[ . 1 . 2]" 1
1383 1 74 ARG HG2 1 75 ASN H . . 5.270 3.700 3.116 4.408 . 0 0 "[ . 1 . 2]" 1
1384 1 74 ARG HG2 1 75 ASN HA . . 4.920 3.833 3.300 4.569 . 0 0 "[ . 1 . 2]" 1
1385 1 75 ASN H 1 75 ASN QB . . 3.410 2.377 2.162 2.719 . 0 0 "[ . 1 . 2]" 1
1386 1 75 ASN H 1 76 ALA H . . 3.690 2.675 2.302 3.169 . 0 0 "[ . 1 . 2]" 1
1387 1 75 ASN H 1 76 ALA MB . . 4.710 4.031 3.641 4.344 . 0 0 "[ . 1 . 2]" 1
1388 1 75 ASN QB 1 76 ALA H . . 4.240 3.035 2.398 3.891 . 0 0 "[ . 1 . 2]" 1
1389 1 75 ASN QB 1 76 ALA HA . . 4.890 4.052 3.765 4.589 . 0 0 "[ . 1 . 2]" 1
1390 1 75 ASN QB 1 76 ALA MB . . 4.860 4.159 3.869 4.681 . 0 0 "[ . 1 . 2]" 1
1391 1 76 ALA H 1 76 ALA MB . . 3.040 2.178 2.034 2.501 . 0 0 "[ . 1 . 2]" 1
1392 1 76 ALA HA 1 77 SER H . . 3.150 2.186 2.141 2.316 . 0 0 "[ . 1 . 2]" 1
1393 1 76 ALA HA 1 77 SER HB2 . . 5.160 4.655 4.451 4.889 . 0 0 "[ . 1 . 2]" 1
1394 1 76 ALA HA 1 77 SER QB . . 4.420 4.151 3.999 4.301 . 0 0 "[ . 1 . 2]" 1
1395 1 76 ALA HA 1 77 SER HB3 . . 5.160 4.696 4.272 4.985 . 0 0 "[ . 1 . 2]" 1
1396 1 76 ALA HA 1 80 VAL MG2 . . 4.770 3.780 3.295 4.156 . 0 0 "[ . 1 . 2]" 1
1397 1 76 ALA MB 1 77 SER H . . 3.630 3.371 3.046 3.640 0.010 16 0 "[ . 1 . 2]" 1
1398 1 76 ALA MB 1 77 SER HA . . 4.810 4.146 3.950 4.376 . 0 0 "[ . 1 . 2]" 1
1399 1 76 ALA MB 1 80 VAL MG1 . . 3.320 2.560 2.105 2.882 . 0 0 "[ . 1 . 2]" 1
1400 1 76 ALA MB 1 80 VAL MG2 . . 2.920 2.020 1.849 2.280 . 0 0 "[ . 1 . 2]" 1
1401 1 77 SER H 1 80 VAL MG2 . . 4.550 3.860 3.104 4.435 . 0 0 "[ . 1 . 2]" 1
1402 1 77 SER HA 1 78 GLY H . . 3.340 2.418 2.186 2.648 . 0 0 "[ . 1 . 2]" 1
1403 1 77 SER HA 1 80 VAL MG2 . . 4.300 3.636 3.199 4.132 . 0 0 "[ . 1 . 2]" 1
1404 1 77 SER QB 1 78 GLY H . . 3.670 3.235 2.856 3.638 . 0 0 "[ . 1 . 2]" 1
1405 1 77 SER QB 1 78 GLY QA . . 5.180 3.983 3.728 4.264 . 0 0 "[ . 1 . 2]" 1
1406 1 79 SER H 1 79 SER QB . . 3.530 2.355 2.169 2.584 . 0 0 "[ . 1 . 2]" 1
1407 1 79 SER QB 1 80 VAL H . . 4.440 3.670 3.318 3.987 . 0 0 "[ . 1 . 2]" 1
1408 1 79 SER QB 1 81 ILE MD . . 4.300 3.423 2.674 4.299 . 0 0 "[ . 1 . 2]" 1
1409 1 80 VAL H 1 80 VAL HB . . 3.550 2.572 2.474 2.738 . 0 0 "[ . 1 . 2]" 1
1410 1 80 VAL H 1 80 VAL MG1 . . 4.520 3.816 3.773 3.893 . 0 0 "[ . 1 . 2]" 1
1411 1 80 VAL H 1 80 VAL MG2 . . 3.610 2.487 2.132 2.917 . 0 0 "[ . 1 . 2]" 1
1412 1 80 VAL HA 1 80 VAL MG1 . . 3.420 2.335 2.217 2.472 . 0 0 "[ . 1 . 2]" 1
1413 1 80 VAL HA 1 80 VAL MG2 . . 3.150 2.404 2.281 2.487 . 0 0 "[ . 1 . 2]" 1
1414 1 80 VAL HA 1 81 ILE H . . 2.900 2.194 2.147 2.230 . 0 0 "[ . 1 . 2]" 1
1415 1 80 VAL HA 1 81 ILE HG12 . . 5.500 4.921 3.830 5.507 0.007 15 0 "[ . 1 . 2]" 1
1416 1 80 VAL HA 1 81 ILE HG13 . . 5.500 5.378 5.046 5.501 0.001 19 0 "[ . 1 . 2]" 1
1417 1 80 VAL HB 1 81 ILE H . . 5.090 4.015 3.841 4.229 . 0 0 "[ . 1 . 2]" 1
1418 1 80 VAL MG1 1 81 ILE H . . 3.550 2.181 1.936 2.653 . 0 0 "[ . 1 . 2]" 1
1419 1 80 VAL MG2 1 81 ILE H . . 4.310 3.974 3.881 4.098 . 0 0 "[ . 1 . 2]" 1
1420 1 81 ILE H 1 81 ILE HB . . 3.400 2.502 2.447 2.558 . 0 0 "[ . 1 . 2]" 1
1421 1 81 ILE H 1 81 ILE MD . . 4.580 2.795 2.032 4.064 . 0 0 "[ . 1 . 2]" 1
1422 1 81 ILE H 1 81 ILE HG12 . . 4.330 3.745 2.945 4.270 . 0 0 "[ . 1 . 2]" 1
1423 1 81 ILE H 1 81 ILE HG13 . . 4.330 4.128 3.924 4.329 . 0 0 "[ . 1 . 2]" 1
1424 1 81 ILE H 1 81 ILE MG . . 4.230 3.760 3.729 3.796 . 0 0 "[ . 1 . 2]" 1
1425 1 81 ILE HB 1 82 LEU H . . 5.030 4.106 3.935 4.427 . 0 0 "[ . 1 . 2]" 1
1426 1 81 ILE MG 1 82 LEU H . . 3.570 2.265 1.938 2.947 . 0 0 "[ . 1 . 2]" 1
1427 1 81 ILE MG 1 83 LYS H . . 4.550 3.605 3.443 3.758 . 0 0 "[ . 1 . 2]" 1
1428 1 81 ILE MG 1 83 LYS HA . . 4.270 4.017 3.832 4.140 . 0 0 "[ . 1 . 2]" 1
1429 1 82 LEU H 1 82 LEU QB . . 3.420 2.640 2.366 2.874 . 0 0 "[ . 1 . 2]" 1
1430 1 82 LEU H 1 82 LEU MD1 . . 4.470 3.971 3.711 4.240 . 0 0 "[ . 1 . 2]" 1
1431 1 82 LEU H 1 82 LEU HG . . 3.860 3.087 2.419 3.716 . 0 0 "[ . 1 . 2]" 1
1432 1 82 LEU HA 1 82 LEU MD2 . . 3.210 2.249 2.056 2.530 . 0 0 "[ . 1 . 2]" 1
1433 1 82 LEU HA 1 82 LEU HG . . 3.820 2.995 2.691 3.284 . 0 0 "[ . 1 . 2]" 1
1434 1 82 LEU HA 1 83 LYS H . . 3.020 2.141 2.138 2.149 . 0 0 "[ . 1 . 2]" 1
1435 1 82 LEU QB 1 82 LEU MD1 . . 2.980 2.044 1.979 2.100 . 0 0 "[ . 1 . 2]" 1
1436 1 82 LEU QB 1 82 LEU MD2 . . 3.120 2.206 2.039 2.284 . 0 0 "[ . 1 . 2]" 1
1437 1 82 LEU QB 1 83 LYS H . . 3.850 3.382 3.248 3.486 . 0 0 "[ . 1 . 2]" 1
1438 1 82 LEU QB 1 84 ILE MD . . 3.220 2.416 2.113 2.706 . 0 0 "[ . 1 . 2]" 1
1439 1 82 LEU QB 1 84 ILE QG . . 3.550 3.220 2.889 3.544 . 0 0 "[ . 1 . 2]" 1
1440 1 82 LEU HB2 1 82 LEU MD1 . . 3.550 2.176 2.045 2.340 . 0 0 "[ . 1 . 2]" 1
1441 1 82 LEU HB2 1 84 ILE MD . . 3.860 3.213 2.592 3.791 . 0 0 "[ . 1 . 2]" 1
1442 1 82 LEU HB2 1 84 ILE QG . . 4.290 3.696 3.169 4.290 0.000 12 0 "[ . 1 . 2]" 1
1443 1 82 LEU HB3 1 82 LEU MD1 . . 3.550 2.512 2.369 2.647 . 0 0 "[ . 1 . 2]" 1
1444 1 82 LEU HB3 1 84 ILE MD . . 3.860 2.523 2.174 2.875 . 0 0 "[ . 1 . 2]" 1
1445 1 82 LEU HB3 1 84 ILE QG . . 4.290 3.624 3.084 4.192 . 0 0 "[ . 1 . 2]" 1
1446 1 82 LEU MD2 1 83 LYS H . . 4.370 3.737 3.089 4.229 . 0 0 "[ . 1 . 2]" 1
1447 1 82 LEU HG 1 83 LYS H . . 5.360 5.051 4.716 5.257 . 0 0 "[ . 1 . 2]" 1
1448 1 82 LEU HG 1 84 ILE MD . . 5.500 4.979 4.664 5.341 . 0 0 "[ . 1 . 2]" 1
1449 1 83 LYS H 1 83 LYS QB . . 3.500 2.277 2.221 2.324 . 0 0 "[ . 1 . 2]" 1
1450 1 83 LYS H 1 83 LYS HG2 . . 5.170 4.493 4.163 4.661 . 0 0 "[ . 1 . 2]" 1
1451 1 83 LYS H 1 83 LYS HG3 . . 5.330 4.446 4.301 4.606 . 0 0 "[ . 1 . 2]" 1
1452 1 83 LYS HA 1 83 LYS HD2 . . 4.980 4.252 3.904 4.725 . 0 0 "[ . 1 . 2]" 1
1453 1 83 LYS HA 1 83 LYS HD3 . . 4.980 4.656 3.934 4.982 0.002 13 0 "[ . 1 . 2]" 1
1454 1 83 LYS HA 1 83 LYS HG2 . . 3.960 3.177 2.907 3.382 . 0 0 "[ . 1 . 2]" 1
1455 1 83 LYS HA 1 83 LYS HG3 . . 3.500 2.417 2.184 2.777 . 0 0 "[ . 1 . 2]" 1
1456 1 83 LYS HA 1 84 ILE H . . 2.940 2.161 2.140 2.192 . 0 0 "[ . 1 . 2]" 1
1457 1 83 LYS HA 1 84 ILE HB . . 5.090 4.892 4.790 5.033 . 0 0 "[ . 1 . 2]" 1
1458 1 83 LYS HA 1 84 ILE QG . . 4.660 3.531 3.236 3.665 . 0 0 "[ . 1 . 2]" 1
1459 1 83 LYS HA 1 84 ILE MG . . 5.500 5.460 5.360 5.512 0.012 8 0 "[ . 1 . 2]" 1
1460 1 83 LYS QB 1 83 LYS HD2 . . 3.650 2.356 2.082 3.279 . 0 0 "[ . 1 . 2]" 1
1461 1 83 LYS QB 1 83 LYS HD3 . . 3.650 2.614 2.094 3.293 . 0 0 "[ . 1 . 2]" 1
1462 1 83 LYS QB 1 83 LYS HE2 . . 4.370 3.634 2.296 4.253 . 0 0 "[ . 1 . 2]" 1
1463 1 83 LYS QB 1 83 LYS QE . . 3.820 3.180 1.999 3.642 . 0 0 "[ . 1 . 2]" 1
1464 1 83 LYS QB 1 83 LYS HE3 . . 4.370 3.659 2.046 4.236 . 0 0 "[ . 1 . 2]" 1
1465 1 83 LYS QB 1 84 ILE H . . 4.770 3.877 3.572 3.960 . 0 0 "[ . 1 . 2]" 1
1466 1 83 LYS QB 1 85 LEU QD . . 4.850 3.792 3.334 4.863 0.013 19 0 "[ . 1 . 2]" 1
1467 1 83 LYS QE 1 83 LYS HG2 . . 3.710 2.674 2.252 3.468 . 0 0 "[ . 1 . 2]" 1
1468 1 83 LYS QE 1 85 LEU QD . . 4.240 3.150 1.875 4.215 . 0 0 "[ . 1 . 2]" 1
1469 1 83 LYS HG2 1 84 ILE H . . 4.400 3.768 3.069 4.200 . 0 0 "[ . 1 . 2]" 1
1470 1 83 LYS HG3 1 84 ILE H . . 4.330 3.552 3.121 3.899 . 0 0 "[ . 1 . 2]" 1
1471 1 84 ILE H 1 84 ILE HB . . 3.320 2.767 2.645 2.918 . 0 0 "[ . 1 . 2]" 1
1472 1 84 ILE H 1 84 ILE MD . . 3.980 3.411 2.906 3.786 . 0 0 "[ . 1 . 2]" 1
1473 1 84 ILE H 1 84 ILE QG . . 3.460 2.184 1.934 2.512 . 0 0 "[ . 1 . 2]" 1
1474 1 84 ILE H 1 85 LEU QD . . 4.550 3.914 3.720 4.586 0.036 13 0 "[ . 1 . 2]" 1
1475 1 84 ILE HA 1 84 ILE MD . . 3.450 2.264 2.063 2.489 . 0 0 "[ . 1 . 2]" 1
1476 1 84 ILE HA 1 84 ILE QG . . 3.880 3.007 2.853 3.163 . 0 0 "[ . 1 . 2]" 1
1477 1 84 ILE HA 1 84 ILE MG . . 3.340 2.176 2.076 2.286 . 0 0 "[ . 1 . 2]" 1
1478 1 84 ILE HA 1 85 LEU H . . 3.080 2.353 2.296 2.395 . 0 0 "[ . 1 . 2]" 1
1479 1 84 ILE HA 1 85 LEU HB2 . . 4.380 4.068 4.051 4.119 . 0 0 "[ . 1 . 2]" 1
1480 1 84 ILE HA 1 85 LEU HB3 . . 5.450 5.515 5.508 5.544 0.094 19 0 "[ . 1 . 2]" 1
1481 1 84 ILE HB 1 84 ILE MD . . 3.240 3.214 3.181 3.231 . 0 0 "[ . 1 . 2]" 1
1482 1 84 ILE HB 1 85 LEU H . . 3.790 3.443 3.312 3.599 . 0 0 "[ . 1 . 2]" 1
1483 1 84 ILE MD 1 85 LEU H . . 4.620 3.852 3.543 4.075 . 0 0 "[ . 1 . 2]" 1
1484 1 84 ILE QG 1 84 ILE MG . . 3.080 2.347 2.218 2.471 . 0 0 "[ . 1 . 2]" 1
1485 1 84 ILE QG 1 85 LEU H . . 4.730 4.440 4.357 4.506 . 0 0 "[ . 1 . 2]" 1
1486 1 84 ILE MG 1 85 LEU H . . 3.360 1.974 1.828 2.128 . 0 0 "[ . 1 . 2]" 1
1487 1 85 LEU H 1 85 LEU HB2 . . 3.750 2.713 2.601 2.754 . 0 0 "[ . 1 . 2]" 1
1488 1 85 LEU H 1 85 LEU HB3 . . 4.160 3.702 3.658 3.733 . 0 0 "[ . 1 . 2]" 1
1489 1 85 LEU H 1 85 LEU QD . . 4.820 3.310 3.080 3.912 . 0 0 "[ . 1 . 2]" 1
1490 1 85 LEU H 1 85 LEU HG . . 4.600 4.320 3.834 4.503 . 0 0 "[ . 1 . 2]" 1
1491 1 85 LEU HA 1 85 LEU QD . . 3.340 2.800 1.915 2.916 . 0 0 "[ . 1 . 2]" 1
1492 1 85 LEU HA 1 85 LEU HG . . 4.170 2.312 2.233 3.015 . 0 0 "[ . 1 . 2]" 1
1493 1 85 LEU HA 1 86 SER H . . 3.280 2.256 2.140 2.363 . 0 0 "[ . 1 . 2]" 1
1494 1 85 LEU HB2 1 86 SER H . . 5.220 4.175 3.957 4.536 . 0 0 "[ . 1 . 2]" 1
1495 1 85 LEU HB3 1 85 LEU MD1 . . 3.340 3.023 2.119 3.158 . 0 0 "[ . 1 . 2]" 1
1496 1 85 LEU HB3 1 85 LEU MD2 . . 3.340 2.122 1.988 2.457 . 0 0 "[ . 1 . 2]" 1
1497 1 85 LEU HB3 1 86 SER H . . 4.380 2.989 2.605 3.739 . 0 0 "[ . 1 . 2]" 1
1498 1 85 LEU QD 1 86 SER H . . 4.600 3.664 2.483 4.289 . 0 0 "[ . 1 . 2]" 1
1499 1 85 LEU MD1 1 86 SER H . . 5.500 4.664 4.092 4.932 . 0 0 "[ . 1 . 2]" 1
1500 1 85 LEU MD2 1 86 SER H . . 5.500 3.882 2.505 4.762 . 0 0 "[ . 1 . 2]" 1
1501 1 85 LEU HG 1 86 SER H . . 5.500 3.783 3.429 4.700 . 0 0 "[ . 1 . 2]" 1
1502 1 86 SER H 1 86 SER QB . . 3.630 2.370 2.165 2.668 . 0 0 "[ . 1 . 2]" 1
1503 1 86 SER HA 1 87 GLY H . . 3.570 2.825 2.242 3.574 0.004 11 0 "[ . 1 . 2]" 1
1504 1 86 SER QB 1 87 GLY H . . 4.380 2.664 1.943 3.614 . 0 0 "[ . 1 . 2]" 1
1505 1 86 SER HB2 1 87 GLY H . . 5.150 3.244 1.954 4.102 . 0 0 "[ . 1 . 2]" 1
1506 1 86 SER HB3 1 87 GLY H . . 5.150 3.264 2.208 4.030 . 0 0 "[ . 1 . 2]" 1
1507 1 87 GLY HA2 1 88 PRO QD . . 3.270 2.459 2.012 2.721 . 0 0 "[ . 1 . 2]" 1
1508 1 87 GLY HA2 1 88 PRO QG . . 4.840 4.368 3.915 4.620 . 0 0 "[ . 1 . 2]" 1
1509 1 87 GLY HA3 1 88 PRO QD . . 3.270 2.150 1.918 2.702 . 0 0 "[ . 1 . 2]" 1
1510 1 87 GLY HA3 1 88 PRO QG . . 4.840 4.007 3.825 4.448 . 0 0 "[ . 1 . 2]" 1
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