Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
451038 | 2ro0 RC | 11032 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ro0
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 1642
_Distance_constraint_stats_list.Viol_count 1204
_Distance_constraint_stats_list.Viol_total 252.971
_Distance_constraint_stats_list.Viol_max 0.129
_Distance_constraint_stats_list.Viol_rms 0.0033
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0004
_Distance_constraint_stats_list.Viol_average_violations_only 0.0105
_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 4 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 ASP 0.033 0.024 1 0 "[ . 1 . 2]"
1 8 GLY 0.033 0.024 1 0 "[ . 1 . 2]"
1 9 LYS 0.044 0.044 10 0 "[ . 1 . 2]"
1 10 GLU 0.037 0.019 9 0 "[ . 1 . 2]"
1 11 GLU 0.057 0.020 4 0 "[ . 1 . 2]"
1 12 PRO 0.007 0.004 20 0 "[ . 1 . 2]"
1 13 GLY 0.096 0.015 18 0 "[ . 1 . 2]"
1 14 ILE 0.080 0.016 5 0 "[ . 1 . 2]"
1 15 ALA 0.116 0.020 18 0 "[ . 1 . 2]"
1 16 LYS 0.046 0.013 7 0 "[ . 1 . 2]"
1 17 LYS 0.552 0.035 14 0 "[ . 1 . 2]"
1 18 ILE 0.437 0.021 7 0 "[ . 1 . 2]"
1 19 ASN 0.133 0.019 5 0 "[ . 1 . 2]"
1 20 SER 0.022 0.009 5 0 "[ . 1 . 2]"
1 21 VAL 0.652 0.026 1 0 "[ . 1 . 2]"
1 22 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 ASP 0.518 0.025 4 0 "[ . 1 . 2]"
1 24 ILE 1.442 0.044 2 0 "[ . 1 . 2]"
1 25 ILE 0.321 0.043 7 0 "[ . 1 . 2]"
1 26 ILE 0.546 0.129 7 0 "[ . 1 . 2]"
1 27 LYS 0.216 0.056 7 0 "[ . 1 . 2]"
1 28 CYS 0.728 0.061 13 0 "[ . 1 . 2]"
1 29 GLN 0.622 0.043 7 0 "[ . 1 . 2]"
1 30 CYS 0.178 0.066 6 0 "[ . 1 . 2]"
1 31 TRP 0.437 0.030 11 0 "[ . 1 . 2]"
1 32 VAL 0.341 0.019 3 0 "[ . 1 . 2]"
1 33 GLN 0.286 0.029 17 0 "[ . 1 . 2]"
1 34 LYS 0.159 0.055 14 0 "[ . 1 . 2]"
1 35 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 GLU 0.493 0.101 17 0 "[ . 1 . 2]"
1 39 ARG 0.048 0.008 6 0 "[ . 1 . 2]"
1 40 LEU 0.699 0.029 20 0 "[ . 1 . 2]"
1 41 ALA 0.160 0.018 14 0 "[ . 1 . 2]"
1 42 GLU 0.129 0.019 11 0 "[ . 1 . 2]"
1 43 ILE 0.533 0.129 7 0 "[ . 1 . 2]"
1 44 LEU 0.091 0.012 11 0 "[ . 1 . 2]"
1 45 SER 0.140 0.013 20 0 "[ . 1 . 2]"
1 46 ILE 0.349 0.031 17 0 "[ . 1 . 2]"
1 47 ASN 0.090 0.011 7 0 "[ . 1 . 2]"
1 48 THR 0.456 0.022 16 0 "[ . 1 . 2]"
1 49 ARG 0.556 0.073 12 0 "[ . 1 . 2]"
1 50 LYS 0.019 0.007 13 0 "[ . 1 . 2]"
1 51 ALA 1.300 0.082 7 0 "[ . 1 . 2]"
1 52 PRO 0.060 0.008 8 0 "[ . 1 . 2]"
1 53 PRO 1.979 0.082 7 0 "[ . 1 . 2]"
1 54 LYS 0.161 0.020 20 0 "[ . 1 . 2]"
1 55 PHE 0.529 0.014 17 0 "[ . 1 . 2]"
1 56 TYR 0.045 0.022 11 0 "[ . 1 . 2]"
1 57 VAL 0.193 0.012 11 0 "[ . 1 . 2]"
1 58 HIS 0.911 0.071 11 0 "[ . 1 . 2]"
1 59 TYR 0.253 0.055 14 0 "[ . 1 . 2]"
1 60 VAL 0.350 0.016 16 0 "[ . 1 . 2]"
1 61 ASN 0.004 0.004 4 0 "[ . 1 . 2]"
1 62 TYR 0.020 0.012 11 0 "[ . 1 . 2]"
1 63 ASN 0.010 0.007 11 0 "[ . 1 . 2]"
1 64 LYS 0.013 0.004 10 0 "[ . 1 . 2]"
1 65 ARG 0.010 0.010 16 0 "[ . 1 . 2]"
1 66 LEU 0.832 0.071 11 0 "[ . 1 . 2]"
1 67 ASP 0.062 0.040 16 0 "[ . 1 . 2]"
1 68 GLU 0.054 0.035 11 0 "[ . 1 . 2]"
1 69 TRP 0.055 0.035 11 0 "[ . 1 . 2]"
1 70 ILE 0.096 0.026 11 0 "[ . 1 . 2]"
1 71 THR 0.002 0.002 16 0 "[ . 1 . 2]"
1 72 THR 0.176 0.010 11 0 "[ . 1 . 2]"
1 73 ASP 0.010 0.008 11 0 "[ . 1 . 2]"
1 74 ARG 0.132 0.026 11 0 "[ . 1 . 2]"
1 75 ILE 0.593 0.026 1 0 "[ . 1 . 2]"
1 76 ASN 0.012 0.006 17 0 "[ . 1 . 2]"
1 77 LEU 0.211 0.019 5 0 "[ . 1 . 2]"
1 78 ASP 0.014 0.007 12 0 "[ . 1 . 2]"
1 79 LYS 0.319 0.030 11 0 "[ . 1 . 2]"
1 80 GLU 0.634 0.035 14 0 "[ . 1 . 2]"
1 81 VAL 1.442 0.061 13 0 "[ . 1 . 2]"
1 82 LEU 0.372 0.026 11 0 "[ . 1 . 2]"
1 83 TYR 0.261 0.038 11 0 "[ . 1 . 2]"
1 84 PRO 0.006 0.005 13 0 "[ . 1 . 2]"
1 85 LYS 0.355 0.124 8 0 "[ . 1 . 2]"
1 86 LEU 0.007 0.004 11 0 "[ . 1 . 2]"
1 87 LYS 0.042 0.034 9 0 "[ . 1 . 2]"
1 88 ALA 0.008 0.007 3 0 "[ . 1 . 2]"
1 89 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 ASP 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 4 MET H 1 4 MET QB . . 3.300 2.487 2.142 3.169 . 0 0 "[ . 1 . 2]" 1
2 1 4 MET QB 1 4 MET ME . . 2.860 2.427 1.980 2.855 . 0 0 "[ . 1 . 2]" 1
3 1 4 MET HB2 1 5 SER H . . 5.500 3.726 2.102 4.485 . 0 0 "[ . 1 . 2]" 1
4 1 4 MET HB3 1 5 SER H . . 5.500 3.368 2.112 4.652 . 0 0 "[ . 1 . 2]" 1
5 1 7 ASP HA 1 7 ASP QB . . 2.480 2.349 2.169 2.479 . 0 0 "[ . 1 . 2]" 1
6 1 7 ASP HA 1 8 GLY H . . 3.550 2.586 2.146 3.574 0.024 1 0 "[ . 1 . 2]" 1
7 1 7 ASP QB 1 8 GLY H . . 4.470 2.712 1.966 3.983 . 0 0 "[ . 1 . 2]" 1
8 1 8 GLY H 1 9 LYS H . . 5.500 3.851 1.971 4.583 . 0 0 "[ . 1 . 2]" 1
9 1 9 LYS H 1 9 LYS QB . . 3.100 2.624 2.249 3.144 0.044 10 0 "[ . 1 . 2]" 1
10 1 9 LYS H 1 9 LYS QG . . 4.110 3.391 1.939 4.109 . 0 0 "[ . 1 . 2]" 1
11 1 9 LYS H 1 10 GLU H . . 4.340 3.702 2.456 4.332 . 0 0 "[ . 1 . 2]" 1
12 1 9 LYS HA 1 9 LYS QB . . 2.590 2.393 2.177 2.525 . 0 0 "[ . 1 . 2]" 1
13 1 9 LYS HA 1 9 LYS QD . . 4.550 3.231 2.074 4.265 . 0 0 "[ . 1 . 2]" 1
14 1 9 LYS HA 1 10 GLU H . . 3.140 2.420 2.141 3.051 . 0 0 "[ . 1 . 2]" 1
15 1 9 LYS QB 1 9 LYS QD . . 2.540 2.181 2.005 2.464 . 0 0 "[ . 1 . 2]" 1
16 1 9 LYS QE 1 9 LYS QG . . 3.370 2.245 2.080 2.499 . 0 0 "[ . 1 . 2]" 1
17 1 10 GLU H 1 10 GLU HB2 . . 3.710 2.931 2.249 3.695 . 0 0 "[ . 1 . 2]" 1
18 1 10 GLU H 1 10 GLU QB . . 2.890 2.523 2.224 2.732 . 0 0 "[ . 1 . 2]" 1
19 1 10 GLU H 1 10 GLU HB3 . . 3.710 2.890 2.497 3.676 . 0 0 "[ . 1 . 2]" 1
20 1 10 GLU H 1 10 GLU QG . . 4.250 3.880 2.155 4.246 . 0 0 "[ . 1 . 2]" 1
21 1 10 GLU H 1 11 GLU HA . . 5.210 4.971 4.497 5.229 0.019 9 0 "[ . 1 . 2]" 1
22 1 10 GLU HA 1 10 GLU QB . . 2.600 2.403 2.168 2.513 . 0 0 "[ . 1 . 2]" 1
23 1 10 GLU HA 1 10 GLU QG . . 3.840 2.572 2.070 3.436 . 0 0 "[ . 1 . 2]" 1
24 1 10 GLU HA 1 11 GLU H . . 2.400 2.239 2.140 2.406 0.006 9 0 "[ . 1 . 2]" 1
25 1 10 GLU HB2 1 10 GLU QG . . 2.740 2.356 2.132 2.482 . 0 0 "[ . 1 . 2]" 1
26 1 10 GLU HB3 1 10 GLU QG . . 2.740 2.257 2.137 2.496 . 0 0 "[ . 1 . 2]" 1
27 1 10 GLU QG 1 11 GLU H . . 3.280 2.864 2.356 3.278 . 0 0 "[ . 1 . 2]" 1
28 1 11 GLU H 1 11 GLU QB . . 2.930 2.361 2.151 2.950 0.020 4 0 "[ . 1 . 2]" 1
29 1 11 GLU HA 1 11 GLU QB . . 2.520 2.458 2.171 2.513 . 0 0 "[ . 1 . 2]" 1
30 1 11 GLU HA 1 11 GLU QG . . 3.730 2.463 2.135 3.443 . 0 0 "[ . 1 . 2]" 1
31 1 11 GLU HA 1 12 PRO HD2 . . 2.770 2.502 2.441 2.514 . 0 0 "[ . 1 . 2]" 1
32 1 11 GLU HA 1 12 PRO QD . . 2.370 2.150 2.113 2.157 . 0 0 "[ . 1 . 2]" 1
33 1 11 GLU HA 1 12 PRO HD3 . . 2.770 2.343 2.314 2.348 . 0 0 "[ . 1 . 2]" 1
34 1 11 GLU QB 1 12 PRO QD . . 4.190 1.997 1.936 2.099 . 0 0 "[ . 1 . 2]" 1
35 1 11 GLU QG 1 12 PRO QD . . 4.040 2.671 2.069 3.789 . 0 0 "[ . 1 . 2]" 1
36 1 12 PRO HA 1 13 GLY H . . 2.700 2.543 2.419 2.642 . 0 0 "[ . 1 . 2]" 1
37 1 12 PRO HA 1 14 ILE MD . . 5.320 4.518 4.033 5.213 . 0 0 "[ . 1 . 2]" 1
38 1 12 PRO HA 1 85 LYS QB . . 5.340 3.274 1.985 3.883 . 0 0 "[ . 1 . 2]" 1
39 1 12 PRO HA 1 85 LYS QD . . 5.500 2.680 1.909 4.433 . 0 0 "[ . 1 . 2]" 1
40 1 12 PRO HA 1 85 LYS HG2 . . 5.500 3.347 1.991 5.494 . 0 0 "[ . 1 . 2]" 1
41 1 12 PRO HA 1 85 LYS QG . . 4.790 3.099 1.981 4.093 . 0 0 "[ . 1 . 2]" 1
42 1 12 PRO HA 1 85 LYS HG3 . . 5.500 4.336 3.609 5.370 . 0 0 "[ . 1 . 2]" 1
43 1 12 PRO HB2 1 13 GLY H . . 3.660 2.291 2.077 2.579 . 0 0 "[ . 1 . 2]" 1
44 1 12 PRO HB2 1 13 GLY HA2 . . 4.150 3.878 3.749 4.013 . 0 0 "[ . 1 . 2]" 1
45 1 12 PRO HB2 1 14 ILE MD . . 5.030 4.708 4.325 5.034 0.004 20 0 "[ . 1 . 2]" 1
46 1 12 PRO HB2 1 85 LYS QB . . 4.210 2.576 1.923 3.183 . 0 0 "[ . 1 . 2]" 1
47 1 12 PRO HB3 1 13 GLY H . . 3.820 3.305 3.213 3.438 . 0 0 "[ . 1 . 2]" 1
48 1 12 PRO QG 1 85 LYS QB . . 5.150 4.007 3.245 4.660 . 0 0 "[ . 1 . 2]" 1
49 1 13 GLY H 1 13 GLY HA2 . . 2.540 2.393 2.313 2.425 . 0 0 "[ . 1 . 2]" 1
50 1 13 GLY H 1 14 ILE H . . 3.710 3.465 3.274 3.688 . 0 0 "[ . 1 . 2]" 1
51 1 13 GLY H 1 14 ILE MD . . 4.140 3.032 2.612 3.772 . 0 0 "[ . 1 . 2]" 1
52 1 13 GLY H 1 14 ILE QG . . 4.890 3.752 3.184 4.255 . 0 0 "[ . 1 . 2]" 1
53 1 13 GLY H 1 85 LYS H . . 5.090 4.406 3.223 5.058 . 0 0 "[ . 1 . 2]" 1
54 1 13 GLY H 1 85 LYS QB . . 4.290 2.046 1.879 2.557 . 0 0 "[ . 1 . 2]" 1
55 1 13 GLY HA2 1 14 ILE H . . 3.070 2.163 2.139 2.193 . 0 0 "[ . 1 . 2]" 1
56 1 13 GLY HA2 1 14 ILE MD . . 4.930 3.501 2.935 4.846 . 0 0 "[ . 1 . 2]" 1
57 1 13 GLY HA2 1 14 ILE QG . . 4.580 4.247 3.964 4.510 . 0 0 "[ . 1 . 2]" 1
58 1 13 GLY HA2 1 82 LEU MD1 . . 5.500 4.312 2.737 5.501 0.001 9 0 "[ . 1 . 2]" 1
59 1 13 GLY HA2 1 82 LEU QD . . 4.220 3.627 2.728 4.228 0.008 13 0 "[ . 1 . 2]" 1
60 1 13 GLY HA2 1 82 LEU MD2 . . 5.500 4.856 3.948 5.515 0.015 1 0 "[ . 1 . 2]" 1
61 1 13 GLY HA2 1 83 TYR H . . 4.930 4.728 4.446 4.941 0.011 11 0 "[ . 1 . 2]" 1
62 1 13 GLY HA2 1 85 LYS H . . 5.000 4.840 4.508 5.015 0.015 18 0 "[ . 1 . 2]" 1
63 1 13 GLY HA2 1 85 LYS QB . . 5.140 3.469 2.849 4.211 . 0 0 "[ . 1 . 2]" 1
64 1 13 GLY HA2 1 85 LYS QD . . 5.490 4.110 1.918 5.237 . 0 0 "[ . 1 . 2]" 1
65 1 13 GLY HA3 1 14 ILE H . . 3.460 3.360 3.253 3.421 . 0 0 "[ . 1 . 2]" 1
66 1 13 GLY HA3 1 14 ILE QG . . 5.320 4.875 4.413 5.173 . 0 0 "[ . 1 . 2]" 1
67 1 13 GLY HA3 1 82 LEU QD . . 4.970 3.727 3.048 4.518 . 0 0 "[ . 1 . 2]" 1
68 1 13 GLY HA3 1 85 LYS QB . . 5.340 4.487 4.119 5.079 . 0 0 "[ . 1 . 2]" 1
69 1 13 GLY HA3 1 85 LYS QD . . 5.500 4.646 2.933 5.405 . 0 0 "[ . 1 . 2]" 1
70 1 14 ILE H 1 14 ILE HB . . 3.530 2.614 2.538 2.731 . 0 0 "[ . 1 . 2]" 1
71 1 14 ILE H 1 14 ILE MD . . 3.690 2.454 1.941 3.674 . 0 0 "[ . 1 . 2]" 1
72 1 14 ILE H 1 14 ILE HG12 . . 4.220 4.125 4.011 4.224 0.004 5 0 "[ . 1 . 2]" 1
73 1 14 ILE H 1 14 ILE QG . . 3.470 2.994 2.723 3.183 . 0 0 "[ . 1 . 2]" 1
74 1 14 ILE H 1 14 ILE HG13 . . 4.220 3.079 2.763 3.310 . 0 0 "[ . 1 . 2]" 1
75 1 14 ILE H 1 82 LEU QD . . 4.170 3.696 2.612 4.186 0.016 5 0 "[ . 1 . 2]" 1
76 1 14 ILE H 1 83 TYR H . . 3.750 3.252 2.853 3.508 . 0 0 "[ . 1 . 2]" 1
77 1 14 ILE H 1 83 TYR HB2 . . 4.310 4.054 3.595 4.285 . 0 0 "[ . 1 . 2]" 1
78 1 14 ILE HA 1 14 ILE MD . . 4.040 3.573 3.391 3.879 . 0 0 "[ . 1 . 2]" 1
79 1 14 ILE HA 1 14 ILE QG . . 3.670 2.390 2.314 2.449 . 0 0 "[ . 1 . 2]" 1
80 1 14 ILE HA 1 14 ILE MG . . 2.480 2.298 2.227 2.382 . 0 0 "[ . 1 . 2]" 1
81 1 14 ILE HA 1 15 ALA H . . 2.400 2.157 2.139 2.229 . 0 0 "[ . 1 . 2]" 1
82 1 14 ILE HA 1 15 ALA MB . . 4.930 3.976 3.894 4.028 . 0 0 "[ . 1 . 2]" 1
83 1 14 ILE HA 1 85 LYS QD . . 5.500 4.762 4.035 5.504 0.004 8 0 "[ . 1 . 2]" 1
84 1 14 ILE HB 1 14 ILE MD . . 2.810 2.118 2.051 2.226 . 0 0 "[ . 1 . 2]" 1
85 1 14 ILE HB 1 15 ALA H . . 4.250 4.157 3.936 4.256 0.006 7 0 "[ . 1 . 2]" 1
86 1 14 ILE HB 1 83 TYR H . . 4.210 3.259 2.762 3.751 . 0 0 "[ . 1 . 2]" 1
87 1 14 ILE HB 1 83 TYR HB2 . . 3.820 2.372 2.060 2.709 . 0 0 "[ . 1 . 2]" 1
88 1 14 ILE HB 1 83 TYR HB3 . . 4.520 3.527 3.071 3.954 . 0 0 "[ . 1 . 2]" 1
89 1 14 ILE MD 1 83 TYR HB2 . . 5.500 3.289 2.849 3.686 . 0 0 "[ . 1 . 2]" 1
90 1 14 ILE MD 1 83 TYR HB3 . . 5.310 3.420 2.892 3.856 . 0 0 "[ . 1 . 2]" 1
91 1 14 ILE MD 1 84 PRO HA . . 5.500 4.026 3.626 4.516 . 0 0 "[ . 1 . 2]" 1
92 1 14 ILE MD 1 84 PRO QG . . 5.500 4.447 4.145 4.713 . 0 0 "[ . 1 . 2]" 1
93 1 14 ILE MD 1 85 LYS H . . 5.260 3.700 3.282 4.228 . 0 0 "[ . 1 . 2]" 1
94 1 14 ILE MD 1 85 LYS HA . . 4.210 2.105 1.915 2.494 . 0 0 "[ . 1 . 2]" 1
95 1 14 ILE MD 1 85 LYS QB . . 4.420 2.269 1.875 3.032 . 0 0 "[ . 1 . 2]" 1
96 1 14 ILE MD 1 85 LYS QD . . 3.290 2.156 1.803 2.916 . 0 0 "[ . 1 . 2]" 1
97 1 14 ILE MD 1 85 LYS QE . . 5.500 3.756 3.322 4.425 . 0 0 "[ . 1 . 2]" 1
98 1 14 ILE QG 1 14 ILE MG . . 2.560 2.021 1.937 2.200 . 0 0 "[ . 1 . 2]" 1
99 1 14 ILE QG 1 15 ALA H . . 5.330 4.212 4.016 4.357 . 0 0 "[ . 1 . 2]" 1
100 1 14 ILE MG 1 15 ALA H . . 3.090 2.546 2.015 2.951 . 0 0 "[ . 1 . 2]" 1
101 1 14 ILE MG 1 15 ALA MB . . 4.600 4.076 3.829 4.294 . 0 0 "[ . 1 . 2]" 1
102 1 14 ILE MG 1 16 LYS QE . . 3.990 2.368 1.970 2.727 . 0 0 "[ . 1 . 2]" 1
103 1 14 ILE MG 1 16 LYS HG2 . . 4.870 3.789 3.531 4.077 . 0 0 "[ . 1 . 2]" 1
104 1 14 ILE MG 1 83 TYR HB2 . . 4.300 3.155 2.496 3.571 . 0 0 "[ . 1 . 2]" 1
105 1 14 ILE MG 1 83 TYR HB3 . . 5.500 4.315 3.757 4.795 . 0 0 "[ . 1 . 2]" 1
106 1 14 ILE MG 1 83 TYR QD . . 5.500 3.664 3.250 4.046 . 0 0 "[ . 1 . 2]" 1
107 1 15 ALA H 1 16 LYS H . . 4.510 4.271 4.064 4.404 . 0 0 "[ . 1 . 2]" 1
108 1 15 ALA HA 1 16 LYS H . . 2.400 2.146 2.140 2.188 . 0 0 "[ . 1 . 2]" 1
109 1 15 ALA HA 1 80 GLU HB2 . . 5.340 5.067 4.783 5.301 . 0 0 "[ . 1 . 2]" 1
110 1 15 ALA HA 1 80 GLU HB3 . . 5.010 4.133 3.925 4.403 . 0 0 "[ . 1 . 2]" 1
111 1 15 ALA HA 1 82 LEU HA . . 3.840 2.800 2.655 2.920 . 0 0 "[ . 1 . 2]" 1
112 1 15 ALA HA 1 82 LEU HB3 . . 5.500 5.386 5.032 5.520 0.020 18 0 "[ . 1 . 2]" 1
113 1 15 ALA HA 1 82 LEU QD . . 3.000 2.731 2.532 2.989 . 0 0 "[ . 1 . 2]" 1
114 1 15 ALA HA 1 83 TYR H . . 4.200 3.716 3.456 3.931 . 0 0 "[ . 1 . 2]" 1
115 1 15 ALA HA 1 83 TYR QD . . 5.500 4.224 3.899 4.545 . 0 0 "[ . 1 . 2]" 1
116 1 15 ALA MB 1 80 GLU HA . . 5.060 4.974 4.862 5.044 . 0 0 "[ . 1 . 2]" 1
117 1 15 ALA MB 1 80 GLU HB2 . . 3.730 3.504 3.318 3.609 . 0 0 "[ . 1 . 2]" 1
118 1 15 ALA MB 1 80 GLU HB3 . . 2.920 2.859 2.734 2.929 0.009 17 0 "[ . 1 . 2]" 1
119 1 15 ALA MB 1 81 VAL H . . 5.150 4.488 4.163 4.660 . 0 0 "[ . 1 . 2]" 1
120 1 15 ALA MB 1 82 LEU HA . . 4.150 3.832 3.571 4.063 . 0 0 "[ . 1 . 2]" 1
121 1 15 ALA MB 1 82 LEU QD . . 2.550 2.384 2.137 2.547 . 0 0 "[ . 1 . 2]" 1
122 1 15 ALA MB 1 83 TYR H . . 5.110 4.821 4.568 5.065 . 0 0 "[ . 1 . 2]" 1
123 1 16 LYS H 1 16 LYS HG2 . . 2.840 2.490 2.368 2.570 . 0 0 "[ . 1 . 2]" 1
124 1 16 LYS H 1 17 LYS H . . 5.500 4.397 4.375 4.454 . 0 0 "[ . 1 . 2]" 1
125 1 16 LYS H 1 18 ILE MG . . 5.500 5.073 4.880 5.191 . 0 0 "[ . 1 . 2]" 1
126 1 16 LYS H 1 81 VAL H . . 3.720 3.163 2.964 3.300 . 0 0 "[ . 1 . 2]" 1
127 1 16 LYS H 1 81 VAL MG2 . . 5.500 4.749 4.558 4.924 . 0 0 "[ . 1 . 2]" 1
128 1 16 LYS H 1 83 TYR QD . . 4.450 3.360 3.126 3.565 . 0 0 "[ . 1 . 2]" 1
129 1 16 LYS HA 1 16 LYS HB2 . . 2.900 2.375 2.360 2.411 . 0 0 "[ . 1 . 2]" 1
130 1 16 LYS HA 1 16 LYS HB3 . . 2.600 2.529 2.487 2.547 . 0 0 "[ . 1 . 2]" 1
131 1 16 LYS HA 1 17 LYS H . . 2.400 2.257 2.230 2.300 . 0 0 "[ . 1 . 2]" 1
132 1 16 LYS HB2 1 16 LYS HD2 . . 4.060 3.634 3.499 3.744 . 0 0 "[ . 1 . 2]" 1
133 1 16 LYS HB2 1 16 LYS QD . . 3.470 2.386 2.209 2.540 . 0 0 "[ . 1 . 2]" 1
134 1 16 LYS HB2 1 16 LYS HD3 . . 4.060 2.420 2.233 2.584 . 0 0 "[ . 1 . 2]" 1
135 1 16 LYS HB2 1 16 LYS QE . . 4.640 3.339 3.072 3.698 . 0 0 "[ . 1 . 2]" 1
136 1 16 LYS HB2 1 17 LYS H . . 3.000 2.864 2.728 2.958 . 0 0 "[ . 1 . 2]" 1
137 1 16 LYS HB2 1 18 ILE MG . . 4.200 3.845 3.661 3.949 . 0 0 "[ . 1 . 2]" 1
138 1 16 LYS HB2 1 83 TYR QD . . 5.210 4.937 4.731 5.132 . 0 0 "[ . 1 . 2]" 1
139 1 16 LYS HB2 1 83 TYR QE . . 4.710 4.658 4.598 4.723 0.013 7 0 "[ . 1 . 2]" 1
140 1 16 LYS HB3 1 16 LYS QD . . 3.520 2.786 2.701 2.862 . 0 0 "[ . 1 . 2]" 1
141 1 16 LYS HB3 1 16 LYS QE . . 4.430 2.378 1.992 2.789 . 0 0 "[ . 1 . 2]" 1
142 1 16 LYS HB3 1 18 ILE MG . . 4.880 4.768 4.616 4.877 . 0 0 "[ . 1 . 2]" 1
143 1 16 LYS HB3 1 83 TYR QD . . 5.390 3.984 3.755 4.184 . 0 0 "[ . 1 . 2]" 1
144 1 16 LYS HB3 1 83 TYR QE . . 4.600 4.576 4.490 4.609 0.009 7 0 "[ . 1 . 2]" 1
145 1 16 LYS QD 1 16 LYS QE . . 2.420 2.050 2.026 2.087 . 0 0 "[ . 1 . 2]" 1
146 1 16 LYS QD 1 16 LYS HG2 . . 2.510 2.408 2.370 2.453 . 0 0 "[ . 1 . 2]" 1
147 1 16 LYS QD 1 16 LYS HG3 . . 2.430 2.171 2.163 2.177 . 0 0 "[ . 1 . 2]" 1
148 1 16 LYS QD 1 83 TYR QD . . 5.340 3.237 2.688 3.631 . 0 0 "[ . 1 . 2]" 1
149 1 16 LYS QD 1 83 TYR QE . . 3.860 2.357 2.211 2.552 . 0 0 "[ . 1 . 2]" 1
150 1 16 LYS QE 1 16 LYS HG2 . . 2.400 2.195 2.101 2.308 . 0 0 "[ . 1 . 2]" 1
151 1 16 LYS QE 1 18 ILE MG . . 4.470 4.301 4.089 4.472 0.002 5 0 "[ . 1 . 2]" 1
152 1 16 LYS QE 1 83 TYR QD . . 4.940 2.321 1.961 2.805 . 0 0 "[ . 1 . 2]" 1
153 1 16 LYS QE 1 83 TYR QE . . 4.780 3.321 2.998 3.713 . 0 0 "[ . 1 . 2]" 1
154 1 16 LYS HG2 1 81 VAL H . . 5.500 4.382 4.135 4.608 . 0 0 "[ . 1 . 2]" 1
155 1 16 LYS HG2 1 83 TYR QD . . 5.500 2.066 1.991 2.232 . 0 0 "[ . 1 . 2]" 1
156 1 16 LYS HG2 1 83 TYR QE . . 4.120 2.264 2.154 2.420 . 0 0 "[ . 1 . 2]" 1
157 1 16 LYS HG3 1 17 LYS H . . 3.860 3.734 3.663 3.854 . 0 0 "[ . 1 . 2]" 1
158 1 16 LYS HG3 1 18 ILE MG . . 4.030 2.328 2.083 2.575 . 0 0 "[ . 1 . 2]" 1
159 1 16 LYS HG3 1 83 TYR QD . . 5.500 3.593 3.409 3.807 . 0 0 "[ . 1 . 2]" 1
160 1 16 LYS HG3 1 83 TYR QE . . 4.980 2.445 2.308 2.536 . 0 0 "[ . 1 . 2]" 1
161 1 17 LYS H 1 18 ILE H . . 4.480 4.357 4.253 4.501 0.021 7 0 "[ . 1 . 2]" 1
162 1 17 LYS H 1 80 GLU HB3 . . 4.890 4.881 4.770 4.909 0.019 5 0 "[ . 1 . 2]" 1
163 1 17 LYS HA 1 17 LYS QB . . 2.520 2.456 2.321 2.530 0.010 1 0 "[ . 1 . 2]" 1
164 1 17 LYS HA 1 17 LYS QG . . 3.600 2.327 2.174 2.524 . 0 0 "[ . 1 . 2]" 1
165 1 17 LYS HA 1 18 ILE H . . 2.400 2.146 2.140 2.178 . 0 0 "[ . 1 . 2]" 1
166 1 17 LYS HA 1 18 ILE MG . . 4.540 3.877 3.669 4.005 . 0 0 "[ . 1 . 2]" 1
167 1 17 LYS HA 1 80 GLU HA . . 2.700 2.718 2.703 2.735 0.035 14 0 "[ . 1 . 2]" 1
168 1 17 LYS HA 1 80 GLU QG . . 4.320 4.225 3.949 4.332 0.012 17 0 "[ . 1 . 2]" 1
169 1 17 LYS HA 1 81 VAL H . . 4.230 2.820 2.660 2.961 . 0 0 "[ . 1 . 2]" 1
170 1 17 LYS HA 1 81 VAL MG2 . . 4.680 3.045 2.813 3.400 . 0 0 "[ . 1 . 2]" 1
171 1 17 LYS QB 1 17 LYS QE . . 4.180 2.922 1.976 3.653 . 0 0 "[ . 1 . 2]" 1
172 1 17 LYS QB 1 18 ILE H . . 3.750 3.448 3.143 3.749 . 0 0 "[ . 1 . 2]" 1
173 1 17 LYS QB 1 80 GLU HA . . 4.650 3.843 3.564 4.113 . 0 0 "[ . 1 . 2]" 1
174 1 17 LYS HB2 1 80 GLU QG . . 4.710 4.296 3.197 4.713 0.003 20 0 "[ . 1 . 2]" 1
175 1 17 LYS HB3 1 80 GLU QG . . 4.710 4.616 4.234 4.716 0.006 4 0 "[ . 1 . 2]" 1
176 1 17 LYS QD 1 80 GLU H . . 4.370 3.841 2.678 4.374 0.004 9 0 "[ . 1 . 2]" 1
177 1 17 LYS QD 1 80 GLU HA . . 4.790 3.169 2.003 3.819 . 0 0 "[ . 1 . 2]" 1
178 1 17 LYS QD 1 80 GLU QG . . 3.800 2.532 2.074 3.379 . 0 0 "[ . 1 . 2]" 1
179 1 17 LYS QE 1 17 LYS QG . . 3.330 2.196 1.948 2.680 . 0 0 "[ . 1 . 2]" 1
180 1 17 LYS QE 1 80 GLU H . . 4.850 4.253 2.654 4.854 0.004 9 0 "[ . 1 . 2]" 1
181 1 17 LYS QG 1 80 GLU H . . 4.910 3.695 3.432 4.087 . 0 0 "[ . 1 . 2]" 1
182 1 17 LYS QG 1 80 GLU HA . . 4.000 2.048 1.899 2.512 . 0 0 "[ . 1 . 2]" 1
183 1 17 LYS QG 1 80 GLU QG . . 3.100 2.089 1.957 3.069 . 0 0 "[ . 1 . 2]" 1
184 1 17 LYS QG 1 81 VAL H . . 5.340 3.495 3.316 4.022 . 0 0 "[ . 1 . 2]" 1
185 1 18 ILE H 1 18 ILE HB . . 3.990 3.729 3.675 3.851 . 0 0 "[ . 1 . 2]" 1
186 1 18 ILE H 1 18 ILE QG . . 3.840 2.156 2.081 2.320 . 0 0 "[ . 1 . 2]" 1
187 1 18 ILE H 1 18 ILE MG . . 3.890 2.792 2.589 3.113 . 0 0 "[ . 1 . 2]" 1
188 1 18 ILE H 1 19 ASN H . . 5.180 4.498 4.435 4.543 . 0 0 "[ . 1 . 2]" 1
189 1 18 ILE H 1 77 LEU QD . . 4.530 3.818 3.567 4.233 . 0 0 "[ . 1 . 2]" 1
190 1 18 ILE H 1 80 GLU HA . . 4.820 4.396 4.245 4.511 . 0 0 "[ . 1 . 2]" 1
191 1 18 ILE H 1 81 VAL MG2 . . 4.160 2.478 2.301 2.848 . 0 0 "[ . 1 . 2]" 1
192 1 18 ILE HA 1 18 ILE HB . . 2.550 2.469 2.433 2.496 . 0 0 "[ . 1 . 2]" 1
193 1 18 ILE HA 1 18 ILE MD . . 4.370 4.115 4.052 4.156 . 0 0 "[ . 1 . 2]" 1
194 1 18 ILE HA 1 18 ILE QG . . 4.010 3.307 3.303 3.310 . 0 0 "[ . 1 . 2]" 1
195 1 18 ILE HA 1 18 ILE MG . . 2.400 2.302 2.208 2.396 . 0 0 "[ . 1 . 2]" 1
196 1 18 ILE HA 1 19 ASN H . . 2.680 2.472 2.344 2.571 . 0 0 "[ . 1 . 2]" 1
197 1 18 ILE HB 1 18 ILE MD . . 2.640 2.226 2.122 2.323 . 0 0 "[ . 1 . 2]" 1
198 1 18 ILE HB 1 19 ASN H . . 3.810 2.242 2.047 2.519 . 0 0 "[ . 1 . 2]" 1
199 1 18 ILE HB 1 19 ASN QB . . 4.990 4.649 4.437 4.960 . 0 0 "[ . 1 . 2]" 1
200 1 18 ILE HB 1 20 SER H . . 3.760 2.505 2.418 2.811 . 0 0 "[ . 1 . 2]" 1
201 1 18 ILE HB 1 23 ASP HB2 . . 4.560 3.782 3.592 4.568 0.008 3 0 "[ . 1 . 2]" 1
202 1 18 ILE HB 1 23 ASP QB . . 3.810 3.560 3.464 3.808 . 0 0 "[ . 1 . 2]" 1
203 1 18 ILE HB 1 23 ASP HB3 . . 4.560 4.500 3.719 4.578 0.018 1 0 "[ . 1 . 2]" 1
204 1 18 ILE HB 1 77 LEU QD . . 4.360 3.760 3.569 4.150 . 0 0 "[ . 1 . 2]" 1
205 1 18 ILE MD 1 18 ILE MG . . 2.750 2.381 2.024 2.563 . 0 0 "[ . 1 . 2]" 1
206 1 18 ILE MD 1 20 SER H . . 4.280 2.809 2.374 3.647 . 0 0 "[ . 1 . 2]" 1
207 1 18 ILE MD 1 21 VAL HA . . 4.110 3.195 2.996 3.289 . 0 0 "[ . 1 . 2]" 1
208 1 18 ILE MD 1 21 VAL HB . . 5.200 5.175 4.948 5.215 0.015 14 0 "[ . 1 . 2]" 1
209 1 18 ILE MD 1 21 VAL QG . . 4.590 3.950 3.822 4.059 . 0 0 "[ . 1 . 2]" 1
210 1 18 ILE MD 1 23 ASP H . . 4.040 3.719 3.568 3.900 . 0 0 "[ . 1 . 2]" 1
211 1 18 ILE MD 1 23 ASP HB2 . . 3.760 2.898 2.593 3.760 0.000 7 0 "[ . 1 . 2]" 1
212 1 18 ILE MD 1 23 ASP QB . . 3.150 2.667 2.494 2.926 . 0 0 "[ . 1 . 2]" 1
213 1 18 ILE MD 1 23 ASP HB3 . . 3.760 3.311 2.531 3.666 . 0 0 "[ . 1 . 2]" 1
214 1 18 ILE MD 1 24 ILE HA . . 4.510 4.146 3.976 4.481 . 0 0 "[ . 1 . 2]" 1
215 1 18 ILE MD 1 24 ILE MD . . 4.030 3.183 2.972 3.525 . 0 0 "[ . 1 . 2]" 1
216 1 18 ILE MD 1 24 ILE HG13 . . 3.840 3.145 2.962 3.432 . 0 0 "[ . 1 . 2]" 1
217 1 18 ILE MD 1 77 LEU QD . . 2.550 2.364 1.993 2.544 . 0 0 "[ . 1 . 2]" 1
218 1 18 ILE MD 1 81 VAL HB . . 4.150 4.079 3.762 4.156 0.006 14 0 "[ . 1 . 2]" 1
219 1 18 ILE MD 1 81 VAL MG2 . . 2.410 2.395 2.251 2.425 0.015 17 0 "[ . 1 . 2]" 1
220 1 18 ILE MD 1 83 TYR QE . . 4.400 3.929 3.539 4.171 . 0 0 "[ . 1 . 2]" 1
221 1 18 ILE QG 1 18 ILE MG . . 2.400 2.120 1.991 2.323 . 0 0 "[ . 1 . 2]" 1
222 1 18 ILE QG 1 19 ASN H . . 4.070 3.562 3.138 3.824 . 0 0 "[ . 1 . 2]" 1
223 1 18 ILE QG 1 20 SER H . . 4.210 3.445 2.821 4.213 0.003 13 0 "[ . 1 . 2]" 1
224 1 18 ILE QG 1 77 LEU MD1 . . 4.740 3.450 1.992 4.741 0.001 17 0 "[ . 1 . 2]" 1
225 1 18 ILE QG 1 77 LEU QD . . 3.560 2.325 1.988 2.771 . 0 0 "[ . 1 . 2]" 1
226 1 18 ILE QG 1 77 LEU MD2 . . 4.740 3.254 2.127 4.444 . 0 0 "[ . 1 . 2]" 1
227 1 18 ILE QG 1 81 VAL HB . . 4.280 3.044 2.701 3.481 . 0 0 "[ . 1 . 2]" 1
228 1 18 ILE QG 1 81 VAL MG2 . . 3.390 1.896 1.834 2.016 . 0 0 "[ . 1 . 2]" 1
229 1 18 ILE MG 1 19 ASN H . . 3.700 3.589 3.534 3.696 . 0 0 "[ . 1 . 2]" 1
230 1 18 ILE MG 1 20 SER H . . 4.380 4.120 4.062 4.298 . 0 0 "[ . 1 . 2]" 1
231 1 18 ILE MG 1 23 ASP HB2 . . 4.080 3.464 3.126 4.084 0.004 7 0 "[ . 1 . 2]" 1
232 1 18 ILE MG 1 23 ASP QB . . 3.580 2.987 2.786 3.089 . 0 0 "[ . 1 . 2]" 1
233 1 18 ILE MG 1 23 ASP HB3 . . 4.080 3.283 3.087 3.409 . 0 0 "[ . 1 . 2]" 1
234 1 18 ILE MG 1 81 VAL HB . . 4.340 3.353 3.071 3.667 . 0 0 "[ . 1 . 2]" 1
235 1 18 ILE MG 1 81 VAL MG1 . . 4.060 3.658 3.468 4.057 . 0 0 "[ . 1 . 2]" 1
236 1 18 ILE MG 1 83 TYR QE . . 3.020 2.656 2.297 2.974 . 0 0 "[ . 1 . 2]" 1
237 1 19 ASN H 1 19 ASN HB2 . . 4.040 2.920 2.405 3.885 . 0 0 "[ . 1 . 2]" 1
238 1 19 ASN H 1 19 ASN QB . . 3.330 2.655 2.370 3.086 . 0 0 "[ . 1 . 2]" 1
239 1 19 ASN H 1 19 ASN HB3 . . 4.040 3.397 2.858 3.903 . 0 0 "[ . 1 . 2]" 1
240 1 19 ASN H 1 20 SER H . . 2.550 2.043 1.891 2.286 . 0 0 "[ . 1 . 2]" 1
241 1 19 ASN H 1 20 SER QB . . 5.340 4.027 3.435 4.323 . 0 0 "[ . 1 . 2]" 1
242 1 19 ASN H 1 77 LEU QB . . 5.340 5.346 5.331 5.359 0.019 5 0 "[ . 1 . 2]" 1
243 1 19 ASN H 1 77 LEU QD . . 4.810 3.644 3.352 4.170 . 0 0 "[ . 1 . 2]" 1
244 1 19 ASN HA 1 19 ASN QD . . 3.830 3.043 2.195 3.830 0.000 15 0 "[ . 1 . 2]" 1
245 1 19 ASN HA 1 20 SER H . . 3.460 3.127 3.031 3.458 . 0 0 "[ . 1 . 2]" 1
246 1 19 ASN HA 1 77 LEU HB2 . . 4.570 4.235 4.141 4.366 . 0 0 "[ . 1 . 2]" 1
247 1 19 ASN HA 1 77 LEU QB . . 3.850 2.820 2.741 2.959 . 0 0 "[ . 1 . 2]" 1
248 1 19 ASN HA 1 77 LEU HB3 . . 4.570 2.863 2.778 3.010 . 0 0 "[ . 1 . 2]" 1
249 1 19 ASN HA 1 77 LEU MD1 . . 4.620 2.501 2.025 3.234 . 0 0 "[ . 1 . 2]" 1
250 1 19 ASN HA 1 77 LEU QD . . 4.000 2.273 2.021 2.628 . 0 0 "[ . 1 . 2]" 1
251 1 19 ASN HA 1 77 LEU MD2 . . 4.620 3.399 2.188 4.555 . 0 0 "[ . 1 . 2]" 1
252 1 19 ASN QB 1 20 SER H . . 4.080 3.616 2.922 3.999 . 0 0 "[ . 1 . 2]" 1
253 1 19 ASN QB 1 20 SER QB . . 5.180 4.676 3.914 5.181 0.001 15 0 "[ . 1 . 2]" 1
254 1 19 ASN QB 1 77 LEU QD . . 4.850 3.693 3.306 4.062 . 0 0 "[ . 1 . 2]" 1
255 1 20 SER H 1 20 SER HB2 . . 4.200 2.999 2.706 3.790 . 0 0 "[ . 1 . 2]" 1
256 1 20 SER H 1 20 SER QB . . 3.670 2.849 2.595 3.205 . 0 0 "[ . 1 . 2]" 1
257 1 20 SER H 1 20 SER HB3 . . 4.200 3.796 2.672 3.920 . 0 0 "[ . 1 . 2]" 1
258 1 20 SER H 1 21 VAL H . . 4.920 4.303 4.164 4.544 . 0 0 "[ . 1 . 2]" 1
259 1 20 SER H 1 77 LEU QD . . 4.200 2.852 2.536 3.569 . 0 0 "[ . 1 . 2]" 1
260 1 20 SER HA 1 20 SER QB . . 2.310 2.273 2.183 2.309 . 0 0 "[ . 1 . 2]" 1
261 1 20 SER HA 1 21 VAL H . . 2.410 2.175 2.141 2.238 . 0 0 "[ . 1 . 2]" 1
262 1 20 SER HA 1 21 VAL MG1 . . 5.260 3.529 3.447 3.589 . 0 0 "[ . 1 . 2]" 1
263 1 20 SER HA 1 21 VAL QG . . 4.430 3.301 3.264 3.333 . 0 0 "[ . 1 . 2]" 1
264 1 20 SER HA 1 21 VAL MG2 . . 5.260 3.975 3.848 4.054 . 0 0 "[ . 1 . 2]" 1
265 1 20 SER HA 1 77 LEU MD1 . . 4.810 3.590 3.134 3.868 . 0 0 "[ . 1 . 2]" 1
266 1 20 SER HA 1 77 LEU QD . . 3.700 3.421 3.035 3.709 0.009 5 0 "[ . 1 . 2]" 1
267 1 20 SER HA 1 77 LEU MD2 . . 4.810 4.334 3.767 4.811 0.001 7 0 "[ . 1 . 2]" 1
268 1 20 SER QB 1 21 VAL H . . 4.200 3.107 2.843 3.669 . 0 0 "[ . 1 . 2]" 1
269 1 20 SER QB 1 21 VAL QG . . 5.110 3.788 3.664 4.291 . 0 0 "[ . 1 . 2]" 1
270 1 20 SER QB 1 22 ASP H . . 4.010 2.726 2.551 3.592 . 0 0 "[ . 1 . 2]" 1
271 1 20 SER QB 1 22 ASP QB . . 4.070 2.891 2.784 3.590 . 0 0 "[ . 1 . 2]" 1
272 1 20 SER QB 1 23 ASP H . . 4.450 2.958 2.791 3.523 . 0 0 "[ . 1 . 2]" 1
273 1 20 SER QB 1 77 LEU QD . . 5.280 4.393 4.226 4.532 . 0 0 "[ . 1 . 2]" 1
274 1 21 VAL H 1 21 VAL HB . . 3.950 3.633 3.616 3.657 . 0 0 "[ . 1 . 2]" 1
275 1 21 VAL H 1 21 VAL QG . . 2.460 1.912 1.839 1.969 . 0 0 "[ . 1 . 2]" 1
276 1 21 VAL H 1 22 ASP H . . 3.500 2.481 2.364 2.599 . 0 0 "[ . 1 . 2]" 1
277 1 21 VAL H 1 23 ASP H . . 5.280 4.472 4.399 4.637 . 0 0 "[ . 1 . 2]" 1
278 1 21 VAL H 1 77 LEU QD . . 4.180 3.675 3.171 4.029 . 0 0 "[ . 1 . 2]" 1
279 1 21 VAL HA 1 21 VAL HB . . 2.550 2.413 2.408 2.418 . 0 0 "[ . 1 . 2]" 1
280 1 21 VAL HA 1 21 VAL QG . . 2.530 2.338 2.314 2.361 . 0 0 "[ . 1 . 2]" 1
281 1 21 VAL HA 1 23 ASP H . . 4.460 3.992 3.886 4.038 . 0 0 "[ . 1 . 2]" 1
282 1 21 VAL HA 1 24 ILE H . . 5.350 5.083 5.028 5.129 . 0 0 "[ . 1 . 2]" 1
283 1 21 VAL HA 1 24 ILE HB . . 4.820 4.348 4.131 4.481 . 0 0 "[ . 1 . 2]" 1
284 1 21 VAL HA 1 24 ILE MD . . 2.400 1.931 1.919 1.954 . 0 0 "[ . 1 . 2]" 1
285 1 21 VAL HA 1 24 ILE HG12 . . 4.050 3.642 3.557 3.746 . 0 0 "[ . 1 . 2]" 1
286 1 21 VAL HA 1 24 ILE HG13 . . 4.310 2.585 2.511 2.691 . 0 0 "[ . 1 . 2]" 1
287 1 21 VAL HA 1 55 PHE HZ . . 5.500 5.021 4.939 5.175 . 0 0 "[ . 1 . 2]" 1
288 1 21 VAL HA 1 75 ILE MD . . 5.490 3.902 3.765 4.089 . 0 0 "[ . 1 . 2]" 1
289 1 21 VAL HA 1 77 LEU MD1 . . 4.700 4.177 3.707 4.615 . 0 0 "[ . 1 . 2]" 1
290 1 21 VAL HA 1 77 LEU QD . . 4.090 3.496 3.285 3.679 . 0 0 "[ . 1 . 2]" 1
291 1 21 VAL HA 1 77 LEU MD2 . . 4.700 3.821 3.408 4.143 . 0 0 "[ . 1 . 2]" 1
292 1 21 VAL HB 1 24 ILE MD . . 3.670 2.190 1.944 2.346 . 0 0 "[ . 1 . 2]" 1
293 1 21 VAL HB 1 24 ILE HG12 . . 5.500 4.962 4.671 5.133 . 0 0 "[ . 1 . 2]" 1
294 1 21 VAL HB 1 24 ILE HG13 . . 4.780 4.001 3.797 4.067 . 0 0 "[ . 1 . 2]" 1
295 1 21 VAL HB 1 55 PHE HZ . . 3.780 3.256 3.215 3.340 . 0 0 "[ . 1 . 2]" 1
296 1 21 VAL HB 1 72 THR MG . . 4.680 3.223 3.015 3.525 . 0 0 "[ . 1 . 2]" 1
297 1 21 VAL HB 1 75 ILE MD . . 4.930 2.827 2.752 2.880 . 0 0 "[ . 1 . 2]" 1
298 1 21 VAL HB 1 75 ILE HG12 . . 5.500 5.512 5.501 5.526 0.026 1 0 "[ . 1 . 2]" 1
299 1 21 VAL QG 1 22 ASP H . . 3.490 2.358 2.214 2.605 . 0 0 "[ . 1 . 2]" 1
300 1 21 VAL QG 1 22 ASP HA . . 4.220 3.241 3.095 3.331 . 0 0 "[ . 1 . 2]" 1
301 1 21 VAL QG 1 24 ILE MD . . 2.660 2.629 2.493 2.669 0.009 11 0 "[ . 1 . 2]" 1
302 1 21 VAL QG 1 24 ILE HG13 . . 4.800 4.043 3.953 4.072 . 0 0 "[ . 1 . 2]" 1
303 1 21 VAL QG 1 53 PRO HD2 . . 4.260 3.644 3.446 3.785 . 0 0 "[ . 1 . 2]" 1
304 1 21 VAL QG 1 53 PRO HG2 . . 4.080 3.017 2.818 3.213 . 0 0 "[ . 1 . 2]" 1
305 1 21 VAL QG 1 55 PHE QE . . 4.180 2.551 2.329 2.767 . 0 0 "[ . 1 . 2]" 1
306 1 21 VAL QG 1 55 PHE HZ . . 3.250 2.211 2.085 2.384 . 0 0 "[ . 1 . 2]" 1
307 1 21 VAL QG 1 72 THR HA . . 3.900 2.395 2.181 2.556 . 0 0 "[ . 1 . 2]" 1
308 1 21 VAL QG 1 72 THR HB . . 4.090 2.381 2.224 2.625 . 0 0 "[ . 1 . 2]" 1
309 1 21 VAL QG 1 72 THR MG . . 2.390 1.785 1.694 1.929 . 0 0 "[ . 1 . 2]" 1
310 1 21 VAL QG 1 75 ILE H . . 5.440 4.766 4.645 4.924 . 0 0 "[ . 1 . 2]" 1
311 1 21 VAL QG 1 75 ILE HB . . 4.180 3.111 3.018 3.220 . 0 0 "[ . 1 . 2]" 1
312 1 21 VAL QG 1 75 ILE MD . . 2.780 1.984 1.867 2.104 . 0 0 "[ . 1 . 2]" 1
313 1 21 VAL QG 1 77 LEU QD . . 4.290 2.438 2.153 2.749 . 0 0 "[ . 1 . 2]" 1
314 1 21 VAL QG 1 77 LEU HG . . 5.230 3.662 3.428 3.830 . 0 0 "[ . 1 . 2]" 1
315 1 21 VAL MG1 1 24 ILE HB . . 5.500 5.481 5.302 5.510 0.010 20 0 "[ . 1 . 2]" 1
316 1 21 VAL MG1 1 24 ILE MD . . 3.920 2.726 2.593 2.761 . 0 0 "[ . 1 . 2]" 1
317 1 21 VAL MG1 1 55 PHE HZ . . 4.510 4.518 4.510 4.524 0.014 15 0 "[ . 1 . 2]" 1
318 1 21 VAL MG1 1 72 THR HA . . 4.570 2.418 2.194 2.589 . 0 0 "[ . 1 . 2]" 1
319 1 21 VAL MG1 1 72 THR MG . . 3.270 2.137 1.965 2.368 . 0 0 "[ . 1 . 2]" 1
320 1 21 VAL MG2 1 24 ILE HB . . 5.500 4.953 4.815 5.046 . 0 0 "[ . 1 . 2]" 1
321 1 21 VAL MG2 1 24 ILE MD . . 3.920 3.454 3.235 3.641 . 0 0 "[ . 1 . 2]" 1
322 1 21 VAL MG2 1 55 PHE HZ . . 4.510 2.216 2.088 2.392 . 0 0 "[ . 1 . 2]" 1
323 1 21 VAL MG2 1 72 THR HA . . 4.570 3.900 3.790 4.027 . 0 0 "[ . 1 . 2]" 1
324 1 21 VAL MG2 1 72 THR MG . . 3.270 1.917 1.849 2.097 . 0 0 "[ . 1 . 2]" 1
325 1 22 ASP H 1 22 ASP HB2 . . 3.620 2.455 2.328 2.677 . 0 0 "[ . 1 . 2]" 1
326 1 22 ASP H 1 22 ASP QB . . 2.830 2.269 2.211 2.395 . 0 0 "[ . 1 . 2]" 1
327 1 22 ASP H 1 22 ASP HB3 . . 3.620 2.872 2.393 3.585 . 0 0 "[ . 1 . 2]" 1
328 1 22 ASP H 1 23 ASP H . . 3.080 2.672 2.649 2.744 . 0 0 "[ . 1 . 2]" 1
329 1 22 ASP H 1 24 ILE H . . 5.350 5.056 5.028 5.082 . 0 0 "[ . 1 . 2]" 1
330 1 22 ASP H 1 24 ILE MD . . 5.100 4.474 4.412 4.609 . 0 0 "[ . 1 . 2]" 1
331 1 22 ASP HA 1 22 ASP QB . . 2.520 2.386 2.303 2.438 . 0 0 "[ . 1 . 2]" 1
332 1 22 ASP HA 1 24 ILE H . . 4.940 3.809 3.791 3.822 . 0 0 "[ . 1 . 2]" 1
333 1 22 ASP QB 1 23 ASP H . . 3.690 2.650 2.611 2.730 . 0 0 "[ . 1 . 2]" 1
334 1 22 ASP QB 1 24 ILE H . . 5.320 4.709 4.499 4.864 . 0 0 "[ . 1 . 2]" 1
335 1 23 ASP H 1 23 ASP QB . . 3.000 2.216 2.210 2.240 . 0 0 "[ . 1 . 2]" 1
336 1 23 ASP H 1 24 ILE H . . 3.470 3.487 3.478 3.495 0.025 4 0 "[ . 1 . 2]" 1
337 1 23 ASP QB 1 24 ILE H . . 4.400 3.918 3.912 3.967 . 0 0 "[ . 1 . 2]" 1
338 1 23 ASP QB 1 24 ILE MD . . 5.340 5.054 4.974 5.125 . 0 0 "[ . 1 . 2]" 1
339 1 23 ASP QB 1 77 LEU QD . . 5.280 5.216 5.120 5.290 0.010 17 0 "[ . 1 . 2]" 1
340 1 24 ILE H 1 24 ILE HB . . 2.660 2.677 2.651 2.704 0.044 2 0 "[ . 1 . 2]" 1
341 1 24 ILE H 1 24 ILE MD . . 5.060 4.124 4.077 4.229 . 0 0 "[ . 1 . 2]" 1
342 1 24 ILE H 1 24 ILE HG12 . . 4.170 4.098 4.057 4.157 . 0 0 "[ . 1 . 2]" 1
343 1 24 ILE H 1 24 ILE HG13 . . 3.580 3.004 2.969 3.076 . 0 0 "[ . 1 . 2]" 1
344 1 24 ILE H 1 24 ILE MG . . 4.570 3.849 3.839 3.864 . 0 0 "[ . 1 . 2]" 1
345 1 24 ILE H 1 25 ILE H . . 4.920 4.361 4.180 4.425 . 0 0 "[ . 1 . 2]" 1
346 1 24 ILE H 1 55 PHE QE . . 4.390 4.376 4.234 4.403 0.013 10 0 "[ . 1 . 2]" 1
347 1 24 ILE HA 1 24 ILE MD . . 4.500 3.820 3.795 3.839 . 0 0 "[ . 1 . 2]" 1
348 1 24 ILE HA 1 24 ILE HG12 . . 2.910 2.514 2.467 2.551 . 0 0 "[ . 1 . 2]" 1
349 1 24 ILE HA 1 24 ILE HG13 . . 4.180 2.961 2.901 3.006 . 0 0 "[ . 1 . 2]" 1
350 1 24 ILE HA 1 24 ILE MG . . 2.550 2.396 2.349 2.420 . 0 0 "[ . 1 . 2]" 1
351 1 24 ILE HA 1 25 ILE H . . 2.440 2.192 2.139 2.222 . 0 0 "[ . 1 . 2]" 1
352 1 24 ILE HA 1 25 ILE HG13 . . 4.720 4.602 4.400 4.742 0.022 7 0 "[ . 1 . 2]" 1
353 1 24 ILE HA 1 25 ILE MG . . 4.700 3.917 3.759 4.089 . 0 0 "[ . 1 . 2]" 1
354 1 24 ILE HA 1 43 ILE HG13 . . 5.030 4.511 4.115 4.629 . 0 0 "[ . 1 . 2]" 1
355 1 24 ILE HA 1 81 VAL MG1 . . 4.540 4.538 4.352 4.577 0.037 13 0 "[ . 1 . 2]" 1
356 1 24 ILE HA 1 83 TYR QE . . 4.330 3.613 2.765 4.334 0.004 7 0 "[ . 1 . 2]" 1
357 1 24 ILE HB 1 24 ILE MD . . 2.800 2.400 2.343 2.421 . 0 0 "[ . 1 . 2]" 1
358 1 24 ILE HB 1 25 ILE H . . 4.670 4.090 3.984 4.325 . 0 0 "[ . 1 . 2]" 1
359 1 24 ILE HB 1 55 PHE QE . . 4.350 2.863 2.741 2.987 . 0 0 "[ . 1 . 2]" 1
360 1 24 ILE HB 1 55 PHE HZ . . 5.040 4.519 4.374 4.618 . 0 0 "[ . 1 . 2]" 1
361 1 24 ILE MD 1 55 PHE HB3 . . 4.980 4.374 4.194 4.720 . 0 0 "[ . 1 . 2]" 1
362 1 24 ILE MD 1 55 PHE QE . . 4.000 3.372 3.222 3.701 . 0 0 "[ . 1 . 2]" 1
363 1 24 ILE MD 1 55 PHE HZ . . 4.760 3.831 3.660 4.206 . 0 0 "[ . 1 . 2]" 1
364 1 24 ILE MD 1 72 THR MG . . 5.290 4.579 4.446 4.740 . 0 0 "[ . 1 . 2]" 1
365 1 24 ILE MD 1 75 ILE MD . . 2.830 2.616 2.489 2.675 . 0 0 "[ . 1 . 2]" 1
366 1 24 ILE HG12 1 24 ILE MG . . 3.700 2.381 2.316 2.421 . 0 0 "[ . 1 . 2]" 1
367 1 24 ILE HG12 1 75 ILE MD . . 5.010 5.000 4.831 5.022 0.012 11 0 "[ . 1 . 2]" 1
368 1 24 ILE HG12 1 81 VAL MG1 . . 4.140 4.065 3.720 4.148 0.008 3 0 "[ . 1 . 2]" 1
369 1 24 ILE HG12 1 81 VAL MG2 . . 4.540 4.503 4.195 4.555 0.015 4 0 "[ . 1 . 2]" 1
370 1 24 ILE HG13 1 75 ILE MD . . 5.140 5.026 4.871 5.139 . 0 0 "[ . 1 . 2]" 1
371 1 24 ILE MG 1 25 ILE H . . 3.220 2.373 2.085 2.719 . 0 0 "[ . 1 . 2]" 1
372 1 24 ILE MG 1 25 ILE HA . . 4.540 3.491 3.344 3.794 . 0 0 "[ . 1 . 2]" 1
373 1 24 ILE MG 1 26 ILE HA . . 4.840 4.559 4.402 4.717 . 0 0 "[ . 1 . 2]" 1
374 1 24 ILE MG 1 28 CYS HB2 . . 4.000 3.393 3.043 3.693 . 0 0 "[ . 1 . 2]" 1
375 1 24 ILE MG 1 28 CYS QB . . 3.420 2.347 2.221 2.517 . 0 0 "[ . 1 . 2]" 1
376 1 24 ILE MG 1 28 CYS HB3 . . 4.000 2.397 2.253 2.622 . 0 0 "[ . 1 . 2]" 1
377 1 24 ILE MG 1 43 ILE HA . . 5.500 4.649 4.484 4.789 . 0 0 "[ . 1 . 2]" 1
378 1 24 ILE MG 1 43 ILE HB . . 4.450 3.534 3.421 3.742 . 0 0 "[ . 1 . 2]" 1
379 1 24 ILE MG 1 43 ILE MD . . 2.430 2.113 1.934 2.299 . 0 0 "[ . 1 . 2]" 1
380 1 24 ILE MG 1 43 ILE HG12 . . 3.530 3.321 3.236 3.355 . 0 0 "[ . 1 . 2]" 1
381 1 24 ILE MG 1 43 ILE HG13 . . 2.480 1.962 1.907 2.014 . 0 0 "[ . 1 . 2]" 1
382 1 24 ILE MG 1 43 ILE MG . . 2.700 2.261 2.071 2.551 . 0 0 "[ . 1 . 2]" 1
383 1 24 ILE MG 1 55 PHE QD . . 4.460 3.047 2.576 3.264 . 0 0 "[ . 1 . 2]" 1
384 1 24 ILE MG 1 55 PHE QE . . 3.870 3.687 3.456 3.873 0.003 11 0 "[ . 1 . 2]" 1
385 1 25 ILE H 1 25 ILE HB . . 4.080 3.771 3.682 3.833 . 0 0 "[ . 1 . 2]" 1
386 1 25 ILE H 1 25 ILE HG12 . . 3.630 2.358 2.038 2.525 . 0 0 "[ . 1 . 2]" 1
387 1 25 ILE H 1 25 ILE HG13 . . 2.700 2.603 2.415 2.704 0.004 20 0 "[ . 1 . 2]" 1
388 1 25 ILE H 1 28 CYS H . . 5.070 3.476 3.404 3.719 . 0 0 "[ . 1 . 2]" 1
389 1 25 ILE H 1 83 TYR QE . . 4.260 3.792 2.876 4.267 0.007 4 0 "[ . 1 . 2]" 1
390 1 25 ILE HA 1 25 ILE HB . . 2.550 2.511 2.484 2.533 . 0 0 "[ . 1 . 2]" 1
391 1 25 ILE HA 1 25 ILE MG . . 2.400 2.170 2.129 2.230 . 0 0 "[ . 1 . 2]" 1
392 1 25 ILE HA 1 26 ILE H . . 3.120 2.583 2.381 2.630 . 0 0 "[ . 1 . 2]" 1
393 1 25 ILE HA 1 46 ILE MD . . 2.760 2.092 1.930 2.281 . 0 0 "[ . 1 . 2]" 1
394 1 25 ILE HB 1 25 ILE MD . . 3.250 2.264 2.160 2.421 . 0 0 "[ . 1 . 2]" 1
395 1 25 ILE HB 1 26 ILE H . . 2.690 2.006 1.929 2.427 . 0 0 "[ . 1 . 2]" 1
396 1 25 ILE MD 1 25 ILE MG . . 2.400 2.275 2.030 2.397 . 0 0 "[ . 1 . 2]" 1
397 1 25 ILE MD 1 28 CYS H . . 3.550 3.434 3.205 3.593 0.043 7 0 "[ . 1 . 2]" 1
398 1 25 ILE MD 1 28 CYS QB . . 5.110 3.274 3.117 3.479 . 0 0 "[ . 1 . 2]" 1
399 1 25 ILE MD 1 83 TYR HB3 . . 4.860 4.050 3.653 4.297 . 0 0 "[ . 1 . 2]" 1
400 1 25 ILE MD 1 83 TYR QD . . 4.850 2.687 2.350 2.956 . 0 0 "[ . 1 . 2]" 1
401 1 25 ILE MD 1 83 TYR QE . . 4.040 3.582 3.066 4.008 . 0 0 "[ . 1 . 2]" 1
402 1 25 ILE MD 1 84 PRO HD2 . . 4.500 2.536 2.354 2.749 . 0 0 "[ . 1 . 2]" 1
403 1 25 ILE MD 1 84 PRO QD . . 3.780 2.166 1.951 2.322 . 0 0 "[ . 1 . 2]" 1
404 1 25 ILE MD 1 84 PRO HD3 . . 4.500 2.366 2.016 2.578 . 0 0 "[ . 1 . 2]" 1
405 1 25 ILE MD 1 84 PRO QG . . 3.970 2.105 1.931 2.421 . 0 0 "[ . 1 . 2]" 1
406 1 25 ILE HG12 1 25 ILE MG . . 2.400 2.176 2.102 2.272 . 0 0 "[ . 1 . 2]" 1
407 1 25 ILE HG12 1 28 CYS H . . 3.980 3.721 3.566 3.855 . 0 0 "[ . 1 . 2]" 1
408 1 25 ILE HG12 1 83 TYR QD . . 4.750 3.250 2.796 3.569 . 0 0 "[ . 1 . 2]" 1
409 1 25 ILE HG12 1 83 TYR QE . . 4.440 2.839 2.441 3.069 . 0 0 "[ . 1 . 2]" 1
410 1 25 ILE HG12 1 84 PRO HD2 . . 5.500 4.357 4.112 4.491 . 0 0 "[ . 1 . 2]" 1
411 1 25 ILE HG12 1 84 PRO QD . . 4.830 3.889 3.754 4.114 . 0 0 "[ . 1 . 2]" 1
412 1 25 ILE HG12 1 84 PRO HD3 . . 5.500 4.391 4.145 4.854 . 0 0 "[ . 1 . 2]" 1
413 1 25 ILE HG13 1 28 CYS QB . . 4.660 2.208 1.956 2.488 . 0 0 "[ . 1 . 2]" 1
414 1 25 ILE HG13 1 83 TYR QD . . 4.410 4.078 3.435 4.400 . 0 0 "[ . 1 . 2]" 1
415 1 25 ILE HG13 1 83 TYR QE . . 4.420 4.239 3.441 4.458 0.038 11 0 "[ . 1 . 2]" 1
416 1 25 ILE MG 1 46 ILE MD . . 3.470 3.304 3.128 3.475 0.005 7 0 "[ . 1 . 2]" 1
417 1 25 ILE MG 1 83 TYR QD . . 4.440 4.388 4.213 4.456 0.016 7 0 "[ . 1 . 2]" 1
418 1 25 ILE MG 1 83 TYR QE . . 3.860 3.663 3.404 3.874 0.014 20 0 "[ . 1 . 2]" 1
419 1 26 ILE H 1 26 ILE HB . . 3.090 2.472 2.447 2.548 . 0 0 "[ . 1 . 2]" 1
420 1 26 ILE H 1 26 ILE QG . . 3.970 2.953 2.087 3.081 . 0 0 "[ . 1 . 2]" 1
421 1 26 ILE H 1 27 LYS H . . 5.080 2.521 2.478 2.672 . 0 0 "[ . 1 . 2]" 1
422 1 26 ILE H 1 43 ILE MG . . 4.320 3.935 3.703 4.023 . 0 0 "[ . 1 . 2]" 1
423 1 26 ILE HA 1 26 ILE MD . . 3.920 3.291 3.184 3.867 . 0 0 "[ . 1 . 2]" 1
424 1 26 ILE HA 1 26 ILE QG . . 3.710 2.284 2.263 2.428 . 0 0 "[ . 1 . 2]" 1
425 1 26 ILE HA 1 26 ILE MG . . 2.550 2.368 2.315 2.408 . 0 0 "[ . 1 . 2]" 1
426 1 26 ILE HA 1 27 LYS HA . . 5.390 4.637 4.624 4.677 . 0 0 "[ . 1 . 2]" 1
427 1 26 ILE HA 1 27 LYS QG . . 5.500 5.230 4.907 5.507 0.007 1 0 "[ . 1 . 2]" 1
428 1 26 ILE HA 1 28 CYS H . . 3.740 3.639 3.522 3.676 . 0 0 "[ . 1 . 2]" 1
429 1 26 ILE HA 1 43 ILE HB . . 3.650 2.842 1.988 3.063 . 0 0 "[ . 1 . 2]" 1
430 1 26 ILE HA 1 43 ILE MD . . 5.500 4.952 4.464 5.120 . 0 0 "[ . 1 . 2]" 1
431 1 26 ILE HA 1 43 ILE HG12 . . 5.500 5.291 4.428 5.503 0.003 6 0 "[ . 1 . 2]" 1
432 1 26 ILE HA 1 43 ILE MG . . 2.400 2.014 1.939 2.161 . 0 0 "[ . 1 . 2]" 1
433 1 26 ILE HA 1 46 ILE MD . . 5.010 4.270 3.415 4.823 . 0 0 "[ . 1 . 2]" 1
434 1 26 ILE HA 1 46 ILE HG13 . . 5.500 4.562 4.162 5.027 . 0 0 "[ . 1 . 2]" 1
435 1 26 ILE HB 1 26 ILE MD . . 2.530 2.172 2.089 2.209 . 0 0 "[ . 1 . 2]" 1
436 1 26 ILE HB 1 27 LYS H . . 3.800 2.984 2.846 3.093 . 0 0 "[ . 1 . 2]" 1
437 1 26 ILE HB 1 27 LYS QD . . 3.630 3.139 2.331 3.634 0.004 14 0 "[ . 1 . 2]" 1
438 1 26 ILE HB 1 28 CYS H . . 5.010 4.886 4.792 4.947 . 0 0 "[ . 1 . 2]" 1
439 1 26 ILE MD 1 27 LYS H . . 4.600 3.906 3.815 4.656 0.056 7 0 "[ . 1 . 2]" 1
440 1 26 ILE MD 1 43 ILE MG . . 3.910 3.927 3.911 4.039 0.129 7 0 "[ . 1 . 2]" 1
441 1 26 ILE MD 1 45 SER HA . . 3.900 3.240 2.479 3.313 . 0 0 "[ . 1 . 2]" 1
442 1 26 ILE MD 1 45 SER HB2 . . 5.390 5.323 4.042 5.400 0.010 9 0 "[ . 1 . 2]" 1
443 1 26 ILE MD 1 45 SER HB3 . . 5.500 5.469 4.863 5.512 0.012 12 0 "[ . 1 . 2]" 1
444 1 26 ILE MD 1 46 ILE H . . 4.180 3.945 3.364 4.116 . 0 0 "[ . 1 . 2]" 1
445 1 26 ILE QG 1 26 ILE MG . . 2.460 2.036 1.982 2.263 . 0 0 "[ . 1 . 2]" 1
446 1 26 ILE QG 1 43 ILE MG . . 4.710 3.062 2.559 3.267 . 0 0 "[ . 1 . 2]" 1
447 1 26 ILE QG 1 44 LEU HB3 . . 5.340 5.085 4.931 5.227 . 0 0 "[ . 1 . 2]" 1
448 1 26 ILE QG 1 45 SER HA . . 5.340 2.161 2.083 2.282 . 0 0 "[ . 1 . 2]" 1
449 1 26 ILE QG 1 46 ILE MD . . 4.560 3.654 2.610 4.282 . 0 0 "[ . 1 . 2]" 1
450 1 26 ILE QG 1 46 ILE HG13 . . 5.340 3.619 2.751 4.516 . 0 0 "[ . 1 . 2]" 1
451 1 26 ILE MG 1 27 LYS H . . 4.100 3.657 3.544 3.800 . 0 0 "[ . 1 . 2]" 1
452 1 26 ILE MG 1 27 LYS HA . . 4.690 3.578 3.470 3.720 . 0 0 "[ . 1 . 2]" 1
453 1 26 ILE MG 1 44 LEU HA . . 4.050 2.254 2.049 2.390 . 0 0 "[ . 1 . 2]" 1
454 1 26 ILE MG 1 45 SER H . . 4.760 4.240 3.805 4.526 . 0 0 "[ . 1 . 2]" 1
455 1 27 LYS H 1 27 LYS QG . . 3.740 2.837 2.242 3.421 . 0 0 "[ . 1 . 2]" 1
456 1 27 LYS H 1 28 CYS H . . 3.700 2.438 2.403 2.532 . 0 0 "[ . 1 . 2]" 1
457 1 27 LYS HA 1 27 LYS HB3 . . 2.550 2.495 2.416 2.568 0.018 1 0 "[ . 1 . 2]" 1
458 1 27 LYS HA 1 27 LYS HD2 . . 4.550 2.796 1.998 4.261 . 0 0 "[ . 1 . 2]" 1
459 1 27 LYS HA 1 27 LYS QD . . 3.780 2.644 1.987 3.568 . 0 0 "[ . 1 . 2]" 1
460 1 27 LYS HA 1 27 LYS HD3 . . 4.550 3.756 2.248 4.473 . 0 0 "[ . 1 . 2]" 1
461 1 27 LYS HA 1 27 LYS QG . . 3.200 2.666 2.217 3.018 . 0 0 "[ . 1 . 2]" 1
462 1 27 LYS HA 1 42 GLU HG2 . . 5.500 5.146 4.979 5.390 . 0 0 "[ . 1 . 2]" 1
463 1 27 LYS HA 1 42 GLU HG3 . . 4.510 4.463 4.324 4.529 0.019 11 0 "[ . 1 . 2]" 1
464 1 27 LYS HA 1 84 PRO QD . . 5.350 4.383 4.188 4.596 . 0 0 "[ . 1 . 2]" 1
465 1 27 LYS HB2 1 84 PRO QB . . 4.440 3.096 2.591 3.502 . 0 0 "[ . 1 . 2]" 1
466 1 27 LYS HB2 1 84 PRO QG . . 2.810 1.990 1.976 2.027 . 0 0 "[ . 1 . 2]" 1
467 1 27 LYS QE 1 27 LYS QG . . 3.230 2.261 2.046 2.769 . 0 0 "[ . 1 . 2]" 1
468 1 27 LYS QG 1 84 PRO QD . . 5.350 4.142 3.862 4.499 . 0 0 "[ . 1 . 2]" 1
469 1 27 LYS QG 1 84 PRO QG . . 4.600 3.010 2.771 3.294 . 0 0 "[ . 1 . 2]" 1
470 1 28 CYS H 1 43 ILE HB . . 3.470 2.961 2.834 3.087 . 0 0 "[ . 1 . 2]" 1
471 1 28 CYS HA 1 29 GLN H . . 2.430 2.235 2.198 2.395 . 0 0 "[ . 1 . 2]" 1
472 1 28 CYS QB 1 43 ILE HG12 . . 5.300 3.473 2.927 3.694 . 0 0 "[ . 1 . 2]" 1
473 1 28 CYS QB 1 43 ILE HG13 . . 4.380 2.629 2.305 2.900 . 0 0 "[ . 1 . 2]" 1
474 1 28 CYS QB 1 81 VAL MG1 . . 3.600 3.598 3.277 3.661 0.061 13 0 "[ . 1 . 2]" 1
475 1 29 GLN H 1 29 GLN QB . . 3.690 2.630 2.536 2.809 . 0 0 "[ . 1 . 2]" 1
476 1 29 GLN H 1 29 GLN QG . . 3.560 2.922 2.564 3.389 . 0 0 "[ . 1 . 2]" 1
477 1 29 GLN H 1 30 CYS H . . 5.410 4.316 4.227 4.371 . 0 0 "[ . 1 . 2]" 1
478 1 29 GLN H 1 81 VAL MG1 . . 3.770 2.908 2.708 3.030 . 0 0 "[ . 1 . 2]" 1
479 1 29 GLN H 1 81 VAL MG2 . . 5.230 5.188 4.965 5.244 0.014 11 0 "[ . 1 . 2]" 1
480 1 29 GLN H 1 82 LEU H . . 3.690 3.036 2.811 3.210 . 0 0 "[ . 1 . 2]" 1
481 1 29 GLN H 1 82 LEU HB2 . . 3.850 3.530 3.194 3.829 . 0 0 "[ . 1 . 2]" 1
482 1 29 GLN H 1 82 LEU HB3 . . 4.380 3.783 3.458 4.383 0.003 19 0 "[ . 1 . 2]" 1
483 1 29 GLN HA 1 29 GLN QB . . 2.530 2.360 2.286 2.398 . 0 0 "[ . 1 . 2]" 1
484 1 29 GLN HA 1 29 GLN QG . . 3.720 2.448 2.307 2.570 . 0 0 "[ . 1 . 2]" 1
485 1 29 GLN HA 1 30 CYS H . . 2.480 2.154 2.141 2.170 . 0 0 "[ . 1 . 2]" 1
486 1 29 GLN HA 1 30 CYS QB . . 5.340 4.322 4.025 4.459 . 0 0 "[ . 1 . 2]" 1
487 1 29 GLN HA 1 40 LEU MD1 . . 5.500 5.240 5.109 5.357 . 0 0 "[ . 1 . 2]" 1
488 1 29 GLN HA 1 40 LEU QD . . 4.780 4.766 4.670 4.796 0.016 7 0 "[ . 1 . 2]" 1
489 1 29 GLN HA 1 40 LEU MD2 . . 5.500 5.480 5.378 5.515 0.015 20 0 "[ . 1 . 2]" 1
490 1 29 GLN HA 1 40 LEU HG . . 5.500 5.197 5.119 5.239 . 0 0 "[ . 1 . 2]" 1
491 1 29 GLN HA 1 42 GLU HA . . 2.400 2.259 2.125 2.351 . 0 0 "[ . 1 . 2]" 1
492 1 29 GLN HA 1 42 GLU HB3 . . 5.500 5.181 5.050 5.330 . 0 0 "[ . 1 . 2]" 1
493 1 29 GLN HA 1 42 GLU HG2 . . 5.500 5.045 4.792 5.383 . 0 0 "[ . 1 . 2]" 1
494 1 29 GLN HA 1 43 ILE H . . 4.520 2.615 2.502 2.754 . 0 0 "[ . 1 . 2]" 1
495 1 29 GLN HA 1 43 ILE HG12 . . 4.960 2.993 2.860 3.064 . 0 0 "[ . 1 . 2]" 1
496 1 29 GLN HA 1 43 ILE MG . . 5.500 5.489 5.397 5.543 0.043 7 0 "[ . 1 . 2]" 1
497 1 29 GLN HA 1 81 VAL MG1 . . 5.500 4.512 4.292 4.608 . 0 0 "[ . 1 . 2]" 1
498 1 29 GLN QB 1 40 LEU HA . . 5.340 5.344 5.187 5.369 0.029 20 0 "[ . 1 . 2]" 1
499 1 29 GLN QB 1 40 LEU QD . . 3.070 2.960 2.874 2.998 . 0 0 "[ . 1 . 2]" 1
500 1 29 GLN QB 1 40 LEU HG . . 4.750 3.334 3.202 3.399 . 0 0 "[ . 1 . 2]" 1
501 1 29 GLN QB 1 41 ALA H . . 4.970 4.761 4.143 4.976 0.006 14 0 "[ . 1 . 2]" 1
502 1 29 GLN QB 1 82 LEU HA . . 4.750 4.591 4.401 4.771 0.021 8 0 "[ . 1 . 2]" 1
503 1 29 GLN QB 1 82 LEU HB2 . . 3.530 2.072 1.961 2.264 . 0 0 "[ . 1 . 2]" 1
504 1 29 GLN QB 1 82 LEU HB3 . . 4.500 2.761 2.416 3.466 . 0 0 "[ . 1 . 2]" 1
505 1 29 GLN QB 1 82 LEU QD . . 4.000 3.245 2.733 3.786 . 0 0 "[ . 1 . 2]" 1
506 1 29 GLN HB2 1 40 LEU MD1 . . 4.710 4.049 3.762 4.231 . 0 0 "[ . 1 . 2]" 1
507 1 29 GLN HB2 1 40 LEU MD2 . . 4.710 4.414 4.030 4.620 . 0 0 "[ . 1 . 2]" 1
508 1 29 GLN HB2 1 40 LEU HG . . 5.500 4.821 4.422 5.023 . 0 0 "[ . 1 . 2]" 1
509 1 29 GLN HB2 1 82 LEU HB2 . . 4.200 2.086 1.969 2.279 . 0 0 "[ . 1 . 2]" 1
510 1 29 GLN HB3 1 40 LEU MD1 . . 4.710 3.499 3.237 3.763 . 0 0 "[ . 1 . 2]" 1
511 1 29 GLN HB3 1 40 LEU MD2 . . 4.710 3.485 3.336 3.582 . 0 0 "[ . 1 . 2]" 1
512 1 29 GLN HB3 1 40 LEU HG . . 5.500 3.400 3.286 3.469 . 0 0 "[ . 1 . 2]" 1
513 1 29 GLN HB3 1 82 LEU HB2 . . 4.200 3.561 3.338 3.880 . 0 0 "[ . 1 . 2]" 1
514 1 29 GLN QE 1 40 LEU QD . . 5.120 3.320 2.001 4.652 . 0 0 "[ . 1 . 2]" 1
515 1 29 GLN QE 1 82 LEU QD . . 4.230 3.482 2.856 4.239 0.009 7 0 "[ . 1 . 2]" 1
516 1 29 GLN QG 1 30 CYS H . . 4.630 4.158 4.039 4.364 . 0 0 "[ . 1 . 2]" 1
517 1 29 GLN QG 1 42 GLU HA . . 4.100 2.379 2.071 2.891 . 0 0 "[ . 1 . 2]" 1
518 1 29 GLN QG 1 82 LEU H . . 5.020 4.852 4.513 5.028 0.008 13 0 "[ . 1 . 2]" 1
519 1 29 GLN QG 1 82 LEU QD . . 5.130 4.269 3.569 4.790 . 0 0 "[ . 1 . 2]" 1
520 1 30 CYS H 1 31 TRP H . . 4.600 4.384 4.350 4.446 . 0 0 "[ . 1 . 2]" 1
521 1 30 CYS H 1 41 ALA H . . 4.020 3.838 3.590 3.982 . 0 0 "[ . 1 . 2]" 1
522 1 30 CYS H 1 41 ALA MB . . 4.080 3.874 3.585 3.993 . 0 0 "[ . 1 . 2]" 1
523 1 30 CYS H 1 42 GLU HA . . 4.130 3.240 3.149 3.444 . 0 0 "[ . 1 . 2]" 1
524 1 30 CYS H 1 81 VAL MG1 . . 4.640 4.515 4.142 4.643 0.003 12 0 "[ . 1 . 2]" 1
525 1 30 CYS HA 1 30 CYS HB2 . . 2.940 2.468 2.395 2.634 . 0 0 "[ . 1 . 2]" 1
526 1 30 CYS HA 1 30 CYS QB . . 2.540 2.211 2.182 2.471 . 0 0 "[ . 1 . 2]" 1
527 1 30 CYS HA 1 30 CYS HB3 . . 2.940 2.510 2.383 3.006 0.066 6 0 "[ . 1 . 2]" 1
528 1 30 CYS HA 1 31 TRP H . . 2.720 2.604 2.361 2.700 . 0 0 "[ . 1 . 2]" 1
529 1 30 CYS HA 1 31 TRP HD1 . . 4.660 3.260 2.971 3.524 . 0 0 "[ . 1 . 2]" 1
530 1 30 CYS HA 1 40 LEU QD . . 4.320 3.975 3.554 4.225 . 0 0 "[ . 1 . 2]" 1
531 1 30 CYS HA 1 81 VAL HA . . 3.940 3.240 3.030 3.339 . 0 0 "[ . 1 . 2]" 1
532 1 30 CYS HA 1 81 VAL MG1 . . 3.890 3.466 3.005 3.690 . 0 0 "[ . 1 . 2]" 1
533 1 30 CYS HA 1 81 VAL MG2 . . 3.910 3.417 3.091 3.598 . 0 0 "[ . 1 . 2]" 1
534 1 30 CYS HA 1 82 LEU HB2 . . 5.500 5.084 4.839 5.324 . 0 0 "[ . 1 . 2]" 1
535 1 30 CYS HA 1 82 LEU QD . . 5.440 5.208 4.879 5.336 . 0 0 "[ . 1 . 2]" 1
536 1 30 CYS QB 1 31 TRP H . . 3.360 2.164 1.933 3.246 . 0 0 "[ . 1 . 2]" 1
537 1 30 CYS QB 1 75 ILE MG . . 3.130 3.004 2.797 3.128 . 0 0 "[ . 1 . 2]" 1
538 1 30 CYS QB 1 77 LEU QD . . 5.280 4.096 3.819 4.608 . 0 0 "[ . 1 . 2]" 1
539 1 30 CYS QB 1 81 VAL HA . . 4.310 4.011 3.799 4.313 0.003 6 0 "[ . 1 . 2]" 1
540 1 30 CYS QB 1 81 VAL MG1 . . 3.280 3.022 2.537 3.244 . 0 0 "[ . 1 . 2]" 1
541 1 30 CYS QB 1 81 VAL MG2 . . 3.000 2.937 2.738 3.019 0.019 17 0 "[ . 1 . 2]" 1
542 1 30 CYS QB 1 82 LEU H . . 5.300 4.665 4.435 4.827 . 0 0 "[ . 1 . 2]" 1
543 1 30 CYS HB2 1 31 TRP HD1 . . 5.500 4.554 4.079 5.507 0.007 6 0 "[ . 1 . 2]" 1
544 1 30 CYS HB3 1 31 TRP HD1 . . 5.500 5.390 5.078 5.507 0.007 7 0 "[ . 1 . 2]" 1
545 1 31 TRP H 1 31 TRP HB2 . . 3.380 2.442 2.343 2.529 . 0 0 "[ . 1 . 2]" 1
546 1 31 TRP H 1 31 TRP HD1 . . 4.180 2.859 2.264 3.116 . 0 0 "[ . 1 . 2]" 1
547 1 31 TRP H 1 41 ALA MB . . 5.430 5.091 4.841 5.419 . 0 0 "[ . 1 . 2]" 1
548 1 31 TRP H 1 75 ILE MG . . 4.350 4.037 3.813 4.363 0.013 17 0 "[ . 1 . 2]" 1
549 1 31 TRP H 1 79 LYS HB2 . . 5.330 4.034 3.626 4.266 . 0 0 "[ . 1 . 2]" 1
550 1 31 TRP HA 1 32 VAL H . . 2.420 2.197 2.175 2.246 . 0 0 "[ . 1 . 2]" 1
551 1 31 TRP HA 1 39 ARG H . . 4.590 4.463 4.209 4.557 . 0 0 "[ . 1 . 2]" 1
552 1 31 TRP HA 1 40 LEU HA . . 4.630 2.444 2.226 2.614 . 0 0 "[ . 1 . 2]" 1
553 1 31 TRP HA 1 41 ALA H . . 4.170 2.468 2.302 2.771 . 0 0 "[ . 1 . 2]" 1
554 1 31 TRP HB2 1 31 TRP HD1 . . 3.610 2.756 2.705 2.852 . 0 0 "[ . 1 . 2]" 1
555 1 31 TRP HB2 1 31 TRP HE1 . . 5.000 4.821 4.803 4.855 . 0 0 "[ . 1 . 2]" 1
556 1 31 TRP HB2 1 32 VAL H . . 4.390 4.158 3.979 4.230 . 0 0 "[ . 1 . 2]" 1
557 1 31 TRP HB2 1 40 LEU HA . . 5.500 4.832 4.586 4.901 . 0 0 "[ . 1 . 2]" 1
558 1 31 TRP HB2 1 76 ASN QB . . 5.130 2.279 2.146 2.393 . 0 0 "[ . 1 . 2]" 1
559 1 31 TRP HB2 1 76 ASN QD . . 4.600 3.550 2.695 4.420 . 0 0 "[ . 1 . 2]" 1
560 1 31 TRP HB2 1 78 ASP H . . 5.500 5.069 4.872 5.307 . 0 0 "[ . 1 . 2]" 1
561 1 31 TRP HB2 1 79 LYS H . . 4.650 4.115 3.985 4.298 . 0 0 "[ . 1 . 2]" 1
562 1 31 TRP HB2 1 79 LYS HA . . 5.500 5.506 5.489 5.530 0.030 11 0 "[ . 1 . 2]" 1
563 1 31 TRP HB2 1 79 LYS HB2 . . 4.870 2.558 2.515 2.662 . 0 0 "[ . 1 . 2]" 1
564 1 31 TRP HB2 1 79 LYS HB3 . . 4.750 3.597 3.398 3.810 . 0 0 "[ . 1 . 2]" 1
565 1 31 TRP HB2 1 79 LYS HD2 . . 5.220 4.105 2.821 4.901 . 0 0 "[ . 1 . 2]" 1
566 1 31 TRP HB2 1 79 LYS QD . . 4.380 2.775 2.396 3.183 . 0 0 "[ . 1 . 2]" 1
567 1 31 TRP HB2 1 79 LYS HD3 . . 5.220 2.904 2.415 3.522 . 0 0 "[ . 1 . 2]" 1
568 1 31 TRP HB3 1 31 TRP HE3 . . 3.800 2.479 2.420 2.522 . 0 0 "[ . 1 . 2]" 1
569 1 31 TRP HB3 1 32 VAL MG2 . . 5.500 4.864 4.766 4.941 . 0 0 "[ . 1 . 2]" 1
570 1 31 TRP HB3 1 38 GLU HB2 . . 5.070 3.449 2.542 4.984 . 0 0 "[ . 1 . 2]" 1
571 1 31 TRP HB3 1 38 GLU QB . . 4.340 2.848 2.514 3.645 . 0 0 "[ . 1 . 2]" 1
572 1 31 TRP HB3 1 38 GLU HB3 . . 5.070 3.818 2.798 4.470 . 0 0 "[ . 1 . 2]" 1
573 1 31 TRP HB3 1 38 GLU HG2 . . 5.500 4.817 2.474 5.517 0.017 14 0 "[ . 1 . 2]" 1
574 1 31 TRP HB3 1 38 GLU QG . . 4.700 3.917 2.143 4.321 . 0 0 "[ . 1 . 2]" 1
575 1 31 TRP HB3 1 38 GLU HG3 . . 5.500 4.269 2.349 4.517 . 0 0 "[ . 1 . 2]" 1
576 1 31 TRP HB3 1 40 LEU HA . . 5.500 4.118 3.873 4.211 . 0 0 "[ . 1 . 2]" 1
577 1 31 TRP HB3 1 79 LYS HD2 . . 5.500 4.562 3.157 5.427 . 0 0 "[ . 1 . 2]" 1
578 1 31 TRP HB3 1 79 LYS QD . . 4.640 3.134 2.668 3.736 . 0 0 "[ . 1 . 2]" 1
579 1 31 TRP HB3 1 79 LYS HD3 . . 5.500 3.243 2.723 3.842 . 0 0 "[ . 1 . 2]" 1
580 1 31 TRP HB3 1 79 LYS QE . . 5.340 3.907 2.606 5.059 . 0 0 "[ . 1 . 2]" 1
581 1 31 TRP HD1 1 40 LEU QD . . 5.440 3.241 2.983 3.413 . 0 0 "[ . 1 . 2]" 1
582 1 31 TRP HD1 1 40 LEU HG . . 5.500 5.478 5.176 5.509 0.009 5 0 "[ . 1 . 2]" 1
583 1 31 TRP HD1 1 79 LYS H . . 5.500 4.800 4.595 4.972 . 0 0 "[ . 1 . 2]" 1
584 1 31 TRP HD1 1 79 LYS HA . . 5.180 5.006 4.766 5.170 . 0 0 "[ . 1 . 2]" 1
585 1 31 TRP HD1 1 79 LYS HB2 . . 3.580 2.925 2.619 3.236 . 0 0 "[ . 1 . 2]" 1
586 1 31 TRP HD1 1 79 LYS HB3 . . 3.490 2.399 2.108 2.583 . 0 0 "[ . 1 . 2]" 1
587 1 31 TRP HD1 1 79 LYS QD . . 4.290 3.940 3.203 4.292 0.002 19 0 "[ . 1 . 2]" 1
588 1 31 TRP HD1 1 79 LYS QE . . 5.180 5.061 3.774 5.194 0.014 11 0 "[ . 1 . 2]" 1
589 1 31 TRP HD1 1 79 LYS HG2 . . 4.360 3.831 3.360 4.181 . 0 0 "[ . 1 . 2]" 1
590 1 31 TRP HE1 1 40 LEU MD1 . . 5.460 2.400 2.312 2.630 . 0 0 "[ . 1 . 2]" 1
591 1 31 TRP HE1 1 40 LEU QD . . 3.940 2.393 2.307 2.623 . 0 0 "[ . 1 . 2]" 1
592 1 31 TRP HE1 1 40 LEU MD2 . . 5.460 4.781 4.454 5.164 . 0 0 "[ . 1 . 2]" 1
593 1 31 TRP HE1 1 40 LEU HG . . 5.500 5.032 4.907 5.230 . 0 0 "[ . 1 . 2]" 1
594 1 31 TRP HE1 1 79 LYS HB2 . . 4.850 4.591 4.246 4.848 . 0 0 "[ . 1 . 2]" 1
595 1 31 TRP HE1 1 79 LYS HB3 . . 4.250 3.307 2.974 3.532 . 0 0 "[ . 1 . 2]" 1
596 1 31 TRP HE1 1 79 LYS QD . . 5.330 4.838 3.399 5.341 0.011 19 0 "[ . 1 . 2]" 1
597 1 31 TRP HE1 1 79 LYS QE . . 5.340 5.119 4.193 5.345 0.005 20 0 "[ . 1 . 2]" 1
598 1 31 TRP HE3 1 32 VAL H . . 4.420 3.749 3.472 4.220 . 0 0 "[ . 1 . 2]" 1
599 1 31 TRP HE3 1 38 GLU H . . 5.500 5.044 4.859 5.121 . 0 0 "[ . 1 . 2]" 1
600 1 31 TRP HE3 1 38 GLU HA . . 5.500 3.774 3.604 4.038 . 0 0 "[ . 1 . 2]" 1
601 1 31 TRP HE3 1 38 GLU QB . . 3.620 2.447 2.245 2.644 . 0 0 "[ . 1 . 2]" 1
602 1 31 TRP HE3 1 38 GLU HG2 . . 4.640 4.120 3.080 4.618 . 0 0 "[ . 1 . 2]" 1
603 1 31 TRP HE3 1 38 GLU HG3 . . 4.640 3.740 2.918 4.643 0.003 7 0 "[ . 1 . 2]" 1
604 1 31 TRP HE3 1 39 ARG H . . 4.440 2.973 2.715 3.251 . 0 0 "[ . 1 . 2]" 1
605 1 31 TRP HE3 1 40 LEU H . . 4.650 3.494 3.277 3.789 . 0 0 "[ . 1 . 2]" 1
606 1 31 TRP HE3 1 40 LEU HA . . 4.950 3.568 3.498 3.828 . 0 0 "[ . 1 . 2]" 1
607 1 31 TRP HE3 1 40 LEU HB2 . . 5.500 4.339 4.164 4.391 . 0 0 "[ . 1 . 2]" 1
608 1 31 TRP HE3 1 40 LEU HB3 . . 5.500 5.494 5.354 5.506 0.006 5 0 "[ . 1 . 2]" 1
609 1 31 TRP HE3 1 40 LEU QD . . 5.100 4.455 4.328 4.684 . 0 0 "[ . 1 . 2]" 1
610 1 31 TRP HE3 1 79 LYS QE . . 5.260 3.943 3.086 4.864 . 0 0 "[ . 1 . 2]" 1
611 1 31 TRP HH2 1 39 ARG HA . . 4.770 4.420 4.189 4.755 . 0 0 "[ . 1 . 2]" 1
612 1 31 TRP HH2 1 40 LEU QB . . 5.300 3.294 3.105 3.655 . 0 0 "[ . 1 . 2]" 1
613 1 31 TRP HH2 1 40 LEU MD1 . . 5.500 3.917 3.694 4.271 . 0 0 "[ . 1 . 2]" 1
614 1 31 TRP HH2 1 40 LEU MD2 . . 5.500 4.978 4.841 5.309 . 0 0 "[ . 1 . 2]" 1
615 1 31 TRP HZ2 1 40 LEU QB . . 5.340 3.289 3.137 3.685 . 0 0 "[ . 1 . 2]" 1
616 1 31 TRP HZ2 1 40 LEU MD1 . . 5.220 2.530 2.301 2.914 . 0 0 "[ . 1 . 2]" 1
617 1 31 TRP HZ2 1 40 LEU QD . . 4.480 2.512 2.291 2.881 . 0 0 "[ . 1 . 2]" 1
618 1 31 TRP HZ2 1 40 LEU MD2 . . 5.220 4.285 4.112 4.741 . 0 0 "[ . 1 . 2]" 1
619 1 31 TRP HZ3 1 38 GLU H . . 5.500 5.070 4.893 5.404 . 0 0 "[ . 1 . 2]" 1
620 1 31 TRP HZ3 1 39 ARG HA . . 3.800 2.321 2.067 2.616 . 0 0 "[ . 1 . 2]" 1
621 1 31 TRP HZ3 1 40 LEU HB2 . . 5.500 3.881 3.789 4.213 . 0 0 "[ . 1 . 2]" 1
622 1 31 TRP HZ3 1 40 LEU HB3 . . 5.500 5.026 4.925 5.292 . 0 0 "[ . 1 . 2]" 1
623 1 32 VAL H 1 32 VAL HB . . 3.440 2.666 2.591 2.749 . 0 0 "[ . 1 . 2]" 1
624 1 32 VAL H 1 32 VAL MG1 . . 4.120 3.865 3.832 3.898 . 0 0 "[ . 1 . 2]" 1
625 1 32 VAL H 1 32 VAL MG2 . . 3.730 2.592 2.469 2.739 . 0 0 "[ . 1 . 2]" 1
626 1 32 VAL H 1 38 GLU HA . . 5.020 4.430 4.257 4.557 . 0 0 "[ . 1 . 2]" 1
627 1 32 VAL H 1 39 ARG H . . 3.480 3.000 2.833 3.154 . 0 0 "[ . 1 . 2]" 1
628 1 32 VAL H 1 40 LEU HA . . 4.200 3.781 3.526 3.936 . 0 0 "[ . 1 . 2]" 1
629 1 32 VAL HA 1 32 VAL MG1 . . 2.740 2.301 2.237 2.393 . 0 0 "[ . 1 . 2]" 1
630 1 32 VAL HA 1 32 VAL MG2 . . 2.620 2.436 2.378 2.476 . 0 0 "[ . 1 . 2]" 1
631 1 32 VAL HA 1 33 GLN H . . 2.570 2.226 2.174 2.252 . 0 0 "[ . 1 . 2]" 1
632 1 32 VAL HA 1 33 GLN QB . . 4.880 4.044 3.996 4.078 . 0 0 "[ . 1 . 2]" 1
633 1 32 VAL HA 1 74 ARG HB3 . . 5.500 5.276 5.102 5.385 . 0 0 "[ . 1 . 2]" 1
634 1 32 VAL HA 1 75 ILE H . . 5.500 5.466 5.396 5.513 0.013 7 0 "[ . 1 . 2]" 1
635 1 32 VAL HA 1 75 ILE HA . . 3.210 3.041 2.775 3.127 . 0 0 "[ . 1 . 2]" 1
636 1 32 VAL HA 1 75 ILE HG12 . . 5.190 5.132 4.728 5.200 0.010 3 0 "[ . 1 . 2]" 1
637 1 32 VAL HA 1 75 ILE MG . . 4.570 4.214 3.819 4.329 . 0 0 "[ . 1 . 2]" 1
638 1 32 VAL HB 1 34 LYS QG . . 5.310 4.286 3.138 5.320 0.010 17 0 "[ . 1 . 2]" 1
639 1 32 VAL HB 1 41 ALA MB . . 3.870 2.805 2.672 2.986 . 0 0 "[ . 1 . 2]" 1
640 1 32 VAL HB 1 57 VAL MG2 . . 4.340 4.179 3.907 4.348 0.008 20 0 "[ . 1 . 2]" 1
641 1 32 VAL HB 1 59 TYR QD . . 4.610 4.589 4.489 4.620 0.010 5 0 "[ . 1 . 2]" 1
642 1 32 VAL HB 1 59 TYR QE . . 3.360 3.067 2.723 3.253 . 0 0 "[ . 1 . 2]" 1
643 1 32 VAL HB 1 75 ILE HA . . 5.500 5.501 5.451 5.519 0.019 3 0 "[ . 1 . 2]" 1
644 1 32 VAL MG1 1 33 GLN H . . 3.670 2.041 1.921 2.312 . 0 0 "[ . 1 . 2]" 1
645 1 32 VAL MG1 1 33 GLN HA . . 4.940 3.972 3.858 4.055 . 0 0 "[ . 1 . 2]" 1
646 1 32 VAL MG1 1 33 GLN QB . . 4.790 3.541 3.441 3.675 . 0 0 "[ . 1 . 2]" 1
647 1 32 VAL MG1 1 34 LYS HA . . 5.500 4.443 4.361 4.600 . 0 0 "[ . 1 . 2]" 1
648 1 32 VAL MG1 1 34 LYS QB . . 4.580 3.718 3.327 4.097 . 0 0 "[ . 1 . 2]" 1
649 1 32 VAL MG1 1 34 LYS QD . . 4.450 3.297 2.555 4.379 . 0 0 "[ . 1 . 2]" 1
650 1 32 VAL MG1 1 39 ARG H . . 4.850 4.763 4.694 4.854 0.004 14 0 "[ . 1 . 2]" 1
651 1 32 VAL MG1 1 39 ARG HB2 . . 5.180 4.992 4.664 5.183 0.003 10 0 "[ . 1 . 2]" 1
652 1 32 VAL MG1 1 41 ALA MB . . 3.880 3.700 3.586 3.887 0.007 7 0 "[ . 1 . 2]" 1
653 1 32 VAL MG1 1 57 VAL MG1 . . 4.250 3.895 3.526 4.251 0.001 20 0 "[ . 1 . 2]" 1
654 1 32 VAL MG1 1 57 VAL MG2 . . 4.070 3.018 2.599 3.267 . 0 0 "[ . 1 . 2]" 1
655 1 32 VAL MG1 1 59 TYR QD . . 5.430 5.183 5.119 5.275 . 0 0 "[ . 1 . 2]" 1
656 1 32 VAL MG1 1 59 TYR QE . . 3.800 3.547 3.368 3.737 . 0 0 "[ . 1 . 2]" 1
657 1 32 VAL MG1 1 70 ILE MD . . 3.400 2.246 2.017 2.435 . 0 0 "[ . 1 . 2]" 1
658 1 32 VAL MG1 1 74 ARG HA . . 5.500 3.965 3.784 4.227 . 0 0 "[ . 1 . 2]" 1
659 1 32 VAL MG1 1 74 ARG HB2 . . 5.340 4.074 3.882 4.143 . 0 0 "[ . 1 . 2]" 1
660 1 32 VAL MG1 1 74 ARG HB3 . . 3.880 2.955 2.829 3.054 . 0 0 "[ . 1 . 2]" 1
661 1 32 VAL MG1 1 74 ARG HG2 . . 5.500 4.818 4.684 5.043 . 0 0 "[ . 1 . 2]" 1
662 1 32 VAL MG1 1 75 ILE H . . 5.090 4.856 4.747 4.956 . 0 0 "[ . 1 . 2]" 1
663 1 32 VAL MG1 1 75 ILE HA . . 4.200 3.483 3.219 3.649 . 0 0 "[ . 1 . 2]" 1
664 1 32 VAL MG1 1 75 ILE HG12 . . 4.890 4.616 4.218 4.886 . 0 0 "[ . 1 . 2]" 1
665 1 32 VAL MG2 1 33 GLN H . . 4.140 3.941 3.873 4.086 . 0 0 "[ . 1 . 2]" 1
666 1 32 VAL MG2 1 39 ARG H . . 4.970 4.924 4.820 4.974 0.004 3 0 "[ . 1 . 2]" 1
667 1 32 VAL MG2 1 43 ILE MD . . 4.590 4.231 3.913 4.491 . 0 0 "[ . 1 . 2]" 1
668 1 32 VAL MG2 1 57 VAL HB . . 4.490 2.926 2.494 3.209 . 0 0 "[ . 1 . 2]" 1
669 1 32 VAL MG2 1 57 VAL MG1 . . 3.870 2.405 2.057 2.727 . 0 0 "[ . 1 . 2]" 1
670 1 32 VAL MG2 1 57 VAL MG2 . . 4.230 2.359 2.142 2.525 . 0 0 "[ . 1 . 2]" 1
671 1 32 VAL MG2 1 59 TYR QD . . 5.080 4.889 4.678 5.002 . 0 0 "[ . 1 . 2]" 1
672 1 32 VAL MG2 1 59 TYR QE . . 4.260 4.117 3.894 4.263 0.003 14 0 "[ . 1 . 2]" 1
673 1 32 VAL MG2 1 75 ILE HA . . 4.310 3.141 2.990 3.437 . 0 0 "[ . 1 . 2]" 1
674 1 32 VAL MG2 1 75 ILE HG12 . . 4.370 3.620 3.528 3.820 . 0 0 "[ . 1 . 2]" 1
675 1 33 GLN H 1 33 GLN QB . . 2.690 2.256 2.112 2.303 . 0 0 "[ . 1 . 2]" 1
676 1 33 GLN H 1 33 GLN QG . . 4.170 3.945 3.699 4.081 . 0 0 "[ . 1 . 2]" 1
677 1 33 GLN H 1 74 ARG HA . . 4.470 4.291 4.035 4.386 . 0 0 "[ . 1 . 2]" 1
678 1 33 GLN HA 1 33 GLN QE . . 4.500 4.281 4.008 4.471 . 0 0 "[ . 1 . 2]" 1
679 1 33 GLN HA 1 33 GLN QG . . 3.830 2.393 2.031 2.667 . 0 0 "[ . 1 . 2]" 1
680 1 33 GLN HA 1 34 LYS H . . 2.400 2.139 2.138 2.140 . 0 0 "[ . 1 . 2]" 1
681 1 33 GLN HA 1 34 LYS QB . . 5.070 4.160 4.051 4.409 . 0 0 "[ . 1 . 2]" 1
682 1 33 GLN HA 1 38 GLU HA . . 2.720 2.579 2.401 2.713 . 0 0 "[ . 1 . 2]" 1
683 1 33 GLN HA 1 38 GLU QB . . 5.140 3.895 3.494 4.516 . 0 0 "[ . 1 . 2]" 1
684 1 33 GLN HA 1 38 GLU QG . . 5.340 4.590 2.903 5.369 0.029 17 0 "[ . 1 . 2]" 1
685 1 33 GLN QB 1 38 GLU HA . . 5.340 4.474 4.215 4.711 . 0 0 "[ . 1 . 2]" 1
686 1 33 GLN QB 1 74 ARG HA . . 4.320 3.877 3.030 4.184 . 0 0 "[ . 1 . 2]" 1
687 1 33 GLN HB2 1 33 GLN HE22 . . 5.500 4.153 3.568 4.753 . 0 0 "[ . 1 . 2]" 1
688 1 33 GLN HB3 1 33 GLN HE22 . . 5.500 4.376 3.411 5.355 . 0 0 "[ . 1 . 2]" 1
689 1 33 GLN QG 1 34 LYS QB . . 5.490 4.882 4.606 5.362 . 0 0 "[ . 1 . 2]" 1
690 1 33 GLN QG 1 38 GLU HA . . 5.160 4.084 3.366 4.556 . 0 0 "[ . 1 . 2]" 1
691 1 34 LYS H 1 34 LYS QB . . 3.530 2.659 2.606 2.735 . 0 0 "[ . 1 . 2]" 1
692 1 34 LYS H 1 34 LYS QG . . 4.920 3.862 3.150 4.368 . 0 0 "[ . 1 . 2]" 1
693 1 34 LYS H 1 35 ASN H . . 4.740 4.277 4.211 4.295 . 0 0 "[ . 1 . 2]" 1
694 1 34 LYS H 1 37 GLU H . . 3.930 2.927 2.824 3.063 . 0 0 "[ . 1 . 2]" 1
695 1 34 LYS H 1 37 GLU QB . . 4.020 3.834 3.784 3.873 . 0 0 "[ . 1 . 2]" 1
696 1 34 LYS H 1 38 GLU HA . . 3.610 3.134 3.068 3.257 . 0 0 "[ . 1 . 2]" 1
697 1 34 LYS H 1 39 ARG H . . 4.470 3.950 3.816 4.084 . 0 0 "[ . 1 . 2]" 1
698 1 34 LYS HA 1 34 LYS HD2 . . 3.530 2.284 1.997 3.528 . 0 0 "[ . 1 . 2]" 1
699 1 34 LYS HA 1 34 LYS QD . . 2.880 2.031 1.971 2.210 . 0 0 "[ . 1 . 2]" 1
700 1 34 LYS HA 1 34 LYS HD3 . . 3.530 2.875 2.000 3.520 . 0 0 "[ . 1 . 2]" 1
701 1 34 LYS HA 1 34 LYS QG . . 3.460 2.613 2.507 2.849 . 0 0 "[ . 1 . 2]" 1
702 1 34 LYS HA 1 59 TYR QE . . 5.500 5.456 5.260 5.555 0.055 14 0 "[ . 1 . 2]" 1
703 1 34 LYS QB 1 34 LYS QD . . 2.610 2.375 2.243 2.556 . 0 0 "[ . 1 . 2]" 1
704 1 34 LYS QB 1 34 LYS QE . . 4.100 3.112 2.095 3.741 . 0 0 "[ . 1 . 2]" 1
705 1 34 LYS QB 1 35 ASN H . . 3.780 3.275 3.001 3.485 . 0 0 "[ . 1 . 2]" 1
706 1 34 LYS QB 1 37 GLU H . . 4.700 4.367 4.270 4.503 . 0 0 "[ . 1 . 2]" 1
707 1 34 LYS QB 1 38 GLU HA . . 5.500 4.616 4.454 4.778 . 0 0 "[ . 1 . 2]" 1
708 1 34 LYS QB 1 39 ARG H . . 4.330 4.178 3.904 4.331 0.001 13 0 "[ . 1 . 2]" 1
709 1 34 LYS QB 1 39 ARG QD . . 4.380 2.974 1.961 3.588 . 0 0 "[ . 1 . 2]" 1
710 1 34 LYS QB 1 59 TYR QD . . 5.160 4.692 4.518 4.842 . 0 0 "[ . 1 . 2]" 1
711 1 34 LYS QB 1 59 TYR QE . . 4.080 3.026 2.630 3.263 . 0 0 "[ . 1 . 2]" 1
712 1 34 LYS QE 1 34 LYS QG . . 3.200 2.123 2.001 2.310 . 0 0 "[ . 1 . 2]" 1
713 1 34 LYS QE 1 59 TYR QE . . 4.060 3.362 2.790 4.010 . 0 0 "[ . 1 . 2]" 1
714 1 34 LYS QE 1 66 LEU QD . . 5.030 4.396 3.234 4.958 . 0 0 "[ . 1 . 2]" 1
715 1 34 LYS HE2 1 34 LYS HG2 . . 4.080 3.143 2.086 4.082 0.002 6 0 "[ . 1 . 2]" 1
716 1 34 LYS HE2 1 34 LYS HG3 . . 4.080 2.867 2.072 3.938 . 0 0 "[ . 1 . 2]" 1
717 1 34 LYS HE3 1 34 LYS HG2 . . 4.080 3.372 2.159 3.992 . 0 0 "[ . 1 . 2]" 1
718 1 34 LYS HE3 1 34 LYS HG3 . . 4.080 2.996 2.083 3.654 . 0 0 "[ . 1 . 2]" 1
719 1 34 LYS QG 1 39 ARG QD . . 4.500 4.094 3.174 4.504 0.004 9 0 "[ . 1 . 2]" 1
720 1 34 LYS QG 1 59 TYR QE . . 4.280 2.698 1.993 3.409 . 0 0 "[ . 1 . 2]" 1
721 1 35 ASN H 1 36 ASP H . . 5.500 2.878 2.809 2.909 . 0 0 "[ . 1 . 2]" 1
722 1 35 ASN HA 1 35 ASN QB . . 2.520 2.404 2.280 2.483 . 0 0 "[ . 1 . 2]" 1
723 1 36 ASP H 1 37 GLU H . . 3.100 2.750 2.737 2.758 . 0 0 "[ . 1 . 2]" 1
724 1 36 ASP H 1 37 GLU QB . . 4.890 4.787 4.696 4.868 . 0 0 "[ . 1 . 2]" 1
725 1 36 ASP HA 1 36 ASP QB . . 2.550 2.410 2.294 2.479 . 0 0 "[ . 1 . 2]" 1
726 1 37 GLU H 1 37 GLU QB . . 2.850 2.632 2.581 2.675 . 0 0 "[ . 1 . 2]" 1
727 1 37 GLU H 1 37 GLU QG . . 3.720 3.399 3.227 3.582 . 0 0 "[ . 1 . 2]" 1
728 1 37 GLU H 1 38 GLU H . . 4.850 4.400 4.392 4.415 . 0 0 "[ . 1 . 2]" 1
729 1 37 GLU HA 1 37 GLU HG2 . . 3.970 2.561 2.291 2.799 . 0 0 "[ . 1 . 2]" 1
730 1 37 GLU HA 1 37 GLU QG . . 3.480 2.428 2.227 2.639 . 0 0 "[ . 1 . 2]" 1
731 1 37 GLU HA 1 37 GLU HG3 . . 3.970 3.214 2.468 3.741 . 0 0 "[ . 1 . 2]" 1
732 1 37 GLU HA 1 38 GLU H . . 2.700 2.574 2.521 2.597 . 0 0 "[ . 1 . 2]" 1
733 1 37 GLU QB 1 38 GLU H . . 2.400 2.058 2.007 2.153 . 0 0 "[ . 1 . 2]" 1
734 1 38 GLU H 1 38 GLU QB . . 3.250 2.854 2.384 3.127 . 0 0 "[ . 1 . 2]" 1
735 1 38 GLU H 1 38 GLU QG . . 4.160 2.613 1.946 4.161 0.001 2 0 "[ . 1 . 2]" 1
736 1 38 GLU H 1 39 ARG H . . 4.590 4.316 4.266 4.392 . 0 0 "[ . 1 . 2]" 1
737 1 38 GLU H 1 39 ARG HA . . 5.130 4.904 4.845 4.983 . 0 0 "[ . 1 . 2]" 1
738 1 38 GLU HA 1 38 GLU QB . . 2.520 2.269 2.172 2.530 0.010 2 0 "[ . 1 . 2]" 1
739 1 38 GLU HA 1 38 GLU HG2 . . 4.130 3.528 2.764 3.644 . 0 0 "[ . 1 . 2]" 1
740 1 38 GLU HA 1 38 GLU HG3 . . 4.130 3.485 2.180 4.231 0.101 17 0 "[ . 1 . 2]" 1
741 1 38 GLU HA 1 39 ARG H . . 2.440 2.148 2.141 2.162 . 0 0 "[ . 1 . 2]" 1
742 1 38 GLU HA 1 39 ARG QG . . 5.340 4.056 3.606 5.038 . 0 0 "[ . 1 . 2]" 1
743 1 38 GLU QB 1 39 ARG H . . 3.490 3.238 3.142 3.493 0.003 2 0 "[ . 1 . 2]" 1
744 1 38 GLU QB 1 39 ARG HA . . 5.340 4.281 4.080 4.450 . 0 0 "[ . 1 . 2]" 1
745 1 38 GLU QB 1 76 ASN QD . . 4.620 2.954 2.017 4.362 . 0 0 "[ . 1 . 2]" 1
746 1 38 GLU QG 1 39 ARG H . . 4.640 4.111 2.862 4.340 . 0 0 "[ . 1 . 2]" 1
747 1 38 GLU QG 1 76 ASN QD . . 4.770 3.418 1.804 4.733 . 0 0 "[ . 1 . 2]" 1
748 1 39 ARG H 1 39 ARG HB2 . . 3.880 2.656 2.506 2.799 . 0 0 "[ . 1 . 2]" 1
749 1 39 ARG H 1 40 LEU H . . 5.220 4.415 4.332 4.495 . 0 0 "[ . 1 . 2]" 1
750 1 39 ARG HA 1 39 ARG QD . . 4.520 3.749 3.331 4.159 . 0 0 "[ . 1 . 2]" 1
751 1 39 ARG HA 1 39 ARG HG2 . . 3.790 2.805 2.435 3.515 . 0 0 "[ . 1 . 2]" 1
752 1 39 ARG HA 1 39 ARG QG . . 3.300 2.394 2.061 2.575 . 0 0 "[ . 1 . 2]" 1
753 1 39 ARG HA 1 39 ARG HG3 . . 3.790 3.037 2.083 3.769 . 0 0 "[ . 1 . 2]" 1
754 1 39 ARG HA 1 40 LEU H . . 3.490 2.223 2.167 2.366 . 0 0 "[ . 1 . 2]" 1
755 1 39 ARG HA 1 59 TYR QD . . 5.500 5.078 4.589 5.508 0.008 6 0 "[ . 1 . 2]" 1
756 1 39 ARG HB2 1 40 LEU H . . 4.560 4.001 3.492 4.374 . 0 0 "[ . 1 . 2]" 1
757 1 39 ARG HB2 1 59 TYR QD . . 3.620 2.791 2.046 3.410 . 0 0 "[ . 1 . 2]" 1
758 1 39 ARG HB2 1 59 TYR QE . . 4.230 2.635 1.988 3.204 . 0 0 "[ . 1 . 2]" 1
759 1 39 ARG HB3 1 59 TYR QD . . 3.770 2.767 2.455 3.372 . 0 0 "[ . 1 . 2]" 1
760 1 39 ARG HB3 1 59 TYR QE . . 4.530 3.843 3.337 4.494 . 0 0 "[ . 1 . 2]" 1
761 1 39 ARG QD 1 59 TYR QD . . 4.080 3.418 2.611 4.078 . 0 0 "[ . 1 . 2]" 1
762 1 39 ARG QD 1 62 TYR QE . . 4.280 2.906 2.009 4.263 . 0 0 "[ . 1 . 2]" 1
763 1 39 ARG HD2 1 59 TYR QE . . 5.500 4.317 3.012 5.143 . 0 0 "[ . 1 . 2]" 1
764 1 39 ARG HD3 1 59 TYR QE . . 5.500 3.993 3.080 5.093 . 0 0 "[ . 1 . 2]" 1
765 1 39 ARG QG 1 40 LEU H . . 4.820 4.035 3.533 4.431 . 0 0 "[ . 1 . 2]" 1
766 1 39 ARG QG 1 59 TYR QD . . 4.730 3.919 3.464 4.448 . 0 0 "[ . 1 . 2]" 1
767 1 39 ARG HG2 1 59 TYR QD . . 5.500 4.532 3.634 5.397 . 0 0 "[ . 1 . 2]" 1
768 1 39 ARG HG2 1 62 TYR QE . . 5.500 4.374 2.808 5.504 0.004 19 0 "[ . 1 . 2]" 1
769 1 39 ARG HG3 1 59 TYR QD . . 5.500 4.569 3.601 5.252 . 0 0 "[ . 1 . 2]" 1
770 1 39 ARG HG3 1 62 TYR QE . . 5.500 4.741 4.062 5.501 0.001 16 0 "[ . 1 . 2]" 1
771 1 40 LEU H 1 40 LEU HB2 . . 3.800 2.437 2.355 2.581 . 0 0 "[ . 1 . 2]" 1
772 1 40 LEU H 1 40 LEU QB . . 3.290 2.233 2.208 2.288 . 0 0 "[ . 1 . 2]" 1
773 1 40 LEU H 1 40 LEU HB3 . . 3.800 2.599 2.551 2.669 . 0 0 "[ . 1 . 2]" 1
774 1 40 LEU H 1 40 LEU QD . . 4.530 3.683 3.640 3.743 . 0 0 "[ . 1 . 2]" 1
775 1 40 LEU H 1 41 ALA H . . 5.500 4.434 4.348 4.586 . 0 0 "[ . 1 . 2]" 1
776 1 40 LEU H 1 60 VAL QG . . 5.440 5.394 5.053 5.451 0.011 7 0 "[ . 1 . 2]" 1
777 1 40 LEU HA 1 40 LEU QD . . 2.530 2.494 2.424 2.540 0.010 4 0 "[ . 1 . 2]" 1
778 1 40 LEU HA 1 40 LEU HG . . 4.000 2.688 2.623 2.753 . 0 0 "[ . 1 . 2]" 1
779 1 40 LEU HA 1 41 ALA H . . 2.650 2.151 2.139 2.179 . 0 0 "[ . 1 . 2]" 1
780 1 40 LEU QB 1 40 LEU QD . . 2.850 1.785 1.770 1.816 . 0 0 "[ . 1 . 2]" 1
781 1 40 LEU QB 1 60 VAL HB . . 4.750 3.710 3.627 3.765 . 0 0 "[ . 1 . 2]" 1
782 1 40 LEU QB 1 60 VAL QG . . 3.930 3.622 3.320 3.790 . 0 0 "[ . 1 . 2]" 1
783 1 40 LEU HB2 1 41 ALA H . . 5.040 4.400 4.245 4.476 . 0 0 "[ . 1 . 2]" 1
784 1 40 LEU HB2 1 60 VAL HB . . 5.500 5.489 5.410 5.512 0.012 19 0 "[ . 1 . 2]" 1
785 1 40 LEU HB3 1 41 ALA H . . 5.040 4.234 3.959 4.344 . 0 0 "[ . 1 . 2]" 1
786 1 40 LEU HB3 1 60 VAL HB . . 5.500 3.773 3.685 3.834 . 0 0 "[ . 1 . 2]" 1
787 1 40 LEU QD 1 41 ALA H . . 3.580 3.512 3.248 3.596 0.016 20 0 "[ . 1 . 2]" 1
788 1 40 LEU QD 1 41 ALA MB . . 5.440 4.672 4.542 4.730 . 0 0 "[ . 1 . 2]" 1
789 1 40 LEU QD 1 60 VAL HB . . 4.490 3.060 2.736 3.389 . 0 0 "[ . 1 . 2]" 1
790 1 40 LEU QD 1 60 VAL QG . . 3.350 2.656 2.385 2.972 . 0 0 "[ . 1 . 2]" 1
791 1 40 LEU QD 1 82 LEU QD . . 4.230 3.218 2.640 3.671 . 0 0 "[ . 1 . 2]" 1
792 1 40 LEU MD1 1 41 ALA H . . 4.960 3.666 3.415 3.747 . 0 0 "[ . 1 . 2]" 1
793 1 40 LEU MD2 1 41 ALA H . . 4.960 4.508 4.063 4.731 . 0 0 "[ . 1 . 2]" 1
794 1 41 ALA H 1 41 ALA MB . . 2.910 2.451 2.346 2.640 . 0 0 "[ . 1 . 2]" 1
795 1 41 ALA HA 1 42 GLU H . . 2.900 2.179 2.161 2.200 . 0 0 "[ . 1 . 2]" 1
796 1 41 ALA HA 1 57 VAL MG2 . . 5.500 5.232 4.962 5.485 . 0 0 "[ . 1 . 2]" 1
797 1 41 ALA HA 1 59 TYR HA . . 3.060 2.620 2.234 2.890 . 0 0 "[ . 1 . 2]" 1
798 1 41 ALA HA 1 59 TYR QD . . 4.420 4.309 3.998 4.429 0.009 20 0 "[ . 1 . 2]" 1
799 1 41 ALA HA 1 59 TYR QE . . 5.500 5.466 5.199 5.518 0.018 14 0 "[ . 1 . 2]" 1
800 1 41 ALA HA 1 60 VAL QG . . 4.000 3.272 2.830 3.527 . 0 0 "[ . 1 . 2]" 1
801 1 41 ALA MB 1 42 GLU H . . 3.440 3.014 2.918 3.102 . 0 0 "[ . 1 . 2]" 1
802 1 41 ALA MB 1 43 ILE MD . . 4.220 3.983 3.795 4.076 . 0 0 "[ . 1 . 2]" 1
803 1 41 ALA MB 1 57 VAL HA . . 4.510 3.892 3.708 4.095 . 0 0 "[ . 1 . 2]" 1
804 1 41 ALA MB 1 57 VAL HB . . 2.590 2.102 1.892 2.236 . 0 0 "[ . 1 . 2]" 1
805 1 41 ALA MB 1 57 VAL MG1 . . 3.570 2.626 2.429 2.805 . 0 0 "[ . 1 . 2]" 1
806 1 41 ALA MB 1 57 VAL MG2 . . 3.500 3.046 2.845 3.207 . 0 0 "[ . 1 . 2]" 1
807 1 41 ALA MB 1 58 HIS H . . 3.870 3.045 2.803 3.304 . 0 0 "[ . 1 . 2]" 1
808 1 41 ALA MB 1 59 TYR HA . . 4.090 3.257 2.914 3.568 . 0 0 "[ . 1 . 2]" 1
809 1 41 ALA MB 1 59 TYR QD . . 3.990 3.657 3.390 3.971 . 0 0 "[ . 1 . 2]" 1
810 1 41 ALA MB 1 59 TYR QE . . 4.290 3.764 3.393 4.040 . 0 0 "[ . 1 . 2]" 1
811 1 42 GLU H 1 42 GLU HB3 . . 2.400 2.402 2.397 2.404 0.004 1 0 "[ . 1 . 2]" 1
812 1 42 GLU H 1 43 ILE H . . 5.500 4.476 4.425 4.539 . 0 0 "[ . 1 . 2]" 1
813 1 42 GLU H 1 58 HIS H . . 3.770 2.782 2.570 2.903 . 0 0 "[ . 1 . 2]" 1
814 1 42 GLU H 1 60 VAL QG . . 3.730 2.874 2.509 3.192 . 0 0 "[ . 1 . 2]" 1
815 1 42 GLU HA 1 42 GLU HB2 . . 2.820 2.389 2.386 2.390 . 0 0 "[ . 1 . 2]" 1
816 1 42 GLU HA 1 43 ILE H . . 2.400 2.167 2.143 2.226 . 0 0 "[ . 1 . 2]" 1
817 1 42 GLU HB2 1 43 ILE H . . 4.270 4.091 3.942 4.180 . 0 0 "[ . 1 . 2]" 1
818 1 42 GLU HB2 1 58 HIS HB3 . . 5.500 5.121 4.863 5.367 . 0 0 "[ . 1 . 2]" 1
819 1 42 GLU HB3 1 44 LEU QD . . 5.440 4.029 3.236 4.178 . 0 0 "[ . 1 . 2]" 1
820 1 42 GLU HB3 1 58 HIS HB2 . . 5.360 5.133 4.865 5.370 0.010 11 0 "[ . 1 . 2]" 1
821 1 42 GLU HB3 1 58 HIS HB3 . . 4.280 3.387 3.132 3.638 . 0 0 "[ . 1 . 2]" 1
822 1 42 GLU HB3 1 58 HIS HD2 . . 4.440 3.689 3.219 3.958 . 0 0 "[ . 1 . 2]" 1
823 1 42 GLU HB3 1 60 VAL QG . . 4.180 2.674 2.246 3.023 . 0 0 "[ . 1 . 2]" 1
824 1 42 GLU HG2 1 44 LEU MD1 . . 5.500 4.958 2.619 5.264 . 0 0 "[ . 1 . 2]" 1
825 1 42 GLU HG2 1 44 LEU QD . . 4.230 3.022 2.497 3.221 . 0 0 "[ . 1 . 2]" 1
826 1 42 GLU HG2 1 44 LEU MD2 . . 5.500 3.078 2.854 3.259 . 0 0 "[ . 1 . 2]" 1
827 1 42 GLU HG2 1 58 HIS H . . 4.950 4.861 4.704 4.955 0.005 10 0 "[ . 1 . 2]" 1
828 1 42 GLU HG3 1 43 ILE H . . 3.310 2.710 2.309 2.913 . 0 0 "[ . 1 . 2]" 1
829 1 42 GLU HG3 1 44 LEU QD . . 5.130 4.448 3.812 4.652 . 0 0 "[ . 1 . 2]" 1
830 1 43 ILE H 1 43 ILE MD . . 4.180 3.246 3.068 3.426 . 0 0 "[ . 1 . 2]" 1
831 1 43 ILE H 1 43 ILE HG12 . . 3.440 2.018 1.945 2.192 . 0 0 "[ . 1 . 2]" 1
832 1 43 ILE H 1 43 ILE HG13 . . 3.790 3.507 3.479 3.615 . 0 0 "[ . 1 . 2]" 1
833 1 43 ILE H 1 43 ILE MG . . 3.880 3.767 3.764 3.782 . 0 0 "[ . 1 . 2]" 1
834 1 43 ILE HA 1 43 ILE MD . . 2.430 2.020 1.973 2.143 . 0 0 "[ . 1 . 2]" 1
835 1 43 ILE HA 1 43 ILE HG12 . . 4.050 3.051 3.010 3.151 . 0 0 "[ . 1 . 2]" 1
836 1 43 ILE HA 1 43 ILE MG . . 2.810 2.284 2.256 2.330 . 0 0 "[ . 1 . 2]" 1
837 1 43 ILE HA 1 44 LEU H . . 3.470 2.215 2.214 2.217 . 0 0 "[ . 1 . 2]" 1
838 1 43 ILE HA 1 44 LEU QD . . 5.440 4.361 2.812 4.511 . 0 0 "[ . 1 . 2]" 1
839 1 43 ILE HA 1 45 SER H . . 4.250 3.963 3.851 4.254 0.004 20 0 "[ . 1 . 2]" 1
840 1 43 ILE HA 1 57 VAL HA . . 3.900 2.513 2.429 2.646 . 0 0 "[ . 1 . 2]" 1
841 1 43 ILE HA 1 57 VAL HB . . 5.210 4.476 4.329 4.678 . 0 0 "[ . 1 . 2]" 1
842 1 43 ILE HA 1 57 VAL MG1 . . 2.940 2.782 2.569 2.945 0.005 11 0 "[ . 1 . 2]" 1
843 1 43 ILE HA 1 57 VAL MG2 . . 5.220 5.029 4.918 5.158 . 0 0 "[ . 1 . 2]" 1
844 1 43 ILE HA 1 58 HIS H . . 4.850 3.925 3.740 4.089 . 0 0 "[ . 1 . 2]" 1
845 1 43 ILE MD 1 43 ILE MG . . 2.400 2.057 1.928 2.102 . 0 0 "[ . 1 . 2]" 1
846 1 43 ILE MD 1 44 LEU H . . 4.530 3.480 3.352 3.779 . 0 0 "[ . 1 . 2]" 1
847 1 43 ILE MD 1 55 PHE HA . . 5.330 4.988 4.826 5.264 . 0 0 "[ . 1 . 2]" 1
848 1 43 ILE MD 1 55 PHE HB2 . . 4.020 3.742 3.588 4.020 . 0 0 "[ . 1 . 2]" 1
849 1 43 ILE MD 1 55 PHE HB3 . . 3.850 3.020 2.867 3.296 . 0 0 "[ . 1 . 2]" 1
850 1 43 ILE MD 1 55 PHE QD . . 4.130 3.693 3.509 3.875 . 0 0 "[ . 1 . 2]" 1
851 1 43 ILE MD 1 55 PHE QE . . 5.300 5.126 4.973 5.273 . 0 0 "[ . 1 . 2]" 1
852 1 43 ILE MD 1 57 VAL HA . . 4.850 3.201 3.057 3.421 . 0 0 "[ . 1 . 2]" 1
853 1 43 ILE MD 1 57 VAL MG1 . . 2.400 1.945 1.859 2.060 . 0 0 "[ . 1 . 2]" 1
854 1 43 ILE HG12 1 43 ILE MG . . 3.540 3.194 3.186 3.202 . 0 0 "[ . 1 . 2]" 1
855 1 43 ILE HG13 1 43 ILE MG . . 2.570 2.343 2.309 2.400 . 0 0 "[ . 1 . 2]" 1
856 1 43 ILE HG13 1 44 LEU H . . 5.500 5.214 5.178 5.254 . 0 0 "[ . 1 . 2]" 1
857 1 43 ILE HG13 1 55 PHE QD . . 5.500 5.145 4.920 5.393 . 0 0 "[ . 1 . 2]" 1
858 1 43 ILE MG 1 44 LEU H . . 3.540 2.153 1.994 2.315 . 0 0 "[ . 1 . 2]" 1
859 1 43 ILE MG 1 44 LEU HB2 . . 5.140 4.224 4.135 4.348 . 0 0 "[ . 1 . 2]" 1
860 1 43 ILE MG 1 45 SER H . . 3.540 2.549 2.359 2.815 . 0 0 "[ . 1 . 2]" 1
861 1 43 ILE MG 1 45 SER HA . . 5.500 3.598 3.487 3.722 . 0 0 "[ . 1 . 2]" 1
862 1 43 ILE MG 1 46 ILE HG13 . . 3.660 3.106 2.761 3.400 . 0 0 "[ . 1 . 2]" 1
863 1 43 ILE MG 1 55 PHE HA . . 4.690 4.643 4.387 4.701 0.011 20 0 "[ . 1 . 2]" 1
864 1 43 ILE MG 1 55 PHE HB2 . . 4.780 4.683 4.594 4.768 . 0 0 "[ . 1 . 2]" 1
865 1 43 ILE MG 1 55 PHE HB3 . . 4.080 3.335 3.190 3.416 . 0 0 "[ . 1 . 2]" 1
866 1 43 ILE MG 1 55 PHE QD . . 3.530 3.440 3.249 3.530 . 2 0 "[ . 1 . 2]" 1
867 1 43 ILE MG 1 55 PHE QE . . 5.070 4.989 4.805 5.072 0.002 4 0 "[ . 1 . 2]" 1
868 1 43 ILE MG 1 57 VAL HA . . 4.760 4.015 3.933 4.166 . 0 0 "[ . 1 . 2]" 1
869 1 43 ILE MG 1 57 VAL MG2 . . 5.500 5.490 5.425 5.511 0.011 2 0 "[ . 1 . 2]" 1
870 1 44 LEU H 1 44 LEU HB2 . . 3.570 2.471 2.437 2.521 . 0 0 "[ . 1 . 2]" 1
871 1 44 LEU H 1 44 LEU HB3 . . 4.110 3.667 3.647 3.704 . 0 0 "[ . 1 . 2]" 1
872 1 44 LEU H 1 44 LEU HG . . 4.480 3.349 3.209 4.359 . 0 0 "[ . 1 . 2]" 1
873 1 44 LEU H 1 45 SER H . . 2.900 1.955 1.891 2.171 . 0 0 "[ . 1 . 2]" 1
874 1 44 LEU H 1 56 TYR QD . . 5.400 4.144 4.087 4.293 . 0 0 "[ . 1 . 2]" 1
875 1 44 LEU H 1 57 VAL HA . . 4.010 3.281 3.218 3.417 . 0 0 "[ . 1 . 2]" 1
876 1 44 LEU H 1 58 HIS H . . 5.220 4.832 4.672 4.995 . 0 0 "[ . 1 . 2]" 1
877 1 44 LEU HA 1 44 LEU HB3 . . 2.700 2.563 2.507 2.589 . 0 0 "[ . 1 . 2]" 1
878 1 44 LEU HA 1 44 LEU QD . . 2.400 2.066 1.939 2.115 . 0 0 "[ . 1 . 2]" 1
879 1 44 LEU HB2 1 44 LEU MD1 . . 3.590 2.433 2.366 3.176 . 0 0 "[ . 1 . 2]" 1
880 1 44 LEU HB2 1 44 LEU QD . . 3.040 2.317 2.113 2.348 . 0 0 "[ . 1 . 2]" 1
881 1 44 LEU HB2 1 44 LEU MD2 . . 3.590 3.132 2.146 3.193 . 0 0 "[ . 1 . 2]" 1
882 1 44 LEU HB2 1 45 SER H . . 3.560 2.770 2.404 2.907 . 0 0 "[ . 1 . 2]" 1
883 1 44 LEU HB2 1 56 TYR H . . 5.010 4.865 4.597 5.011 0.001 7 0 "[ . 1 . 2]" 1
884 1 44 LEU HB2 1 56 TYR QB . . 5.230 2.376 2.059 2.525 . 0 0 "[ . 1 . 2]" 1
885 1 44 LEU HB2 1 56 TYR QD . . 3.140 1.999 1.988 2.080 . 0 0 "[ . 1 . 2]" 1
886 1 44 LEU HB2 1 57 VAL H . . 5.260 4.849 4.704 5.056 . 0 0 "[ . 1 . 2]" 1
887 1 44 LEU HB2 1 57 VAL HA . . 5.220 4.156 3.926 4.374 . 0 0 "[ . 1 . 2]" 1
888 1 44 LEU HB2 1 58 HIS HB3 . . 5.500 4.675 4.466 5.279 . 0 0 "[ . 1 . 2]" 1
889 1 44 LEU HB3 1 45 SER H . . 3.700 3.558 3.347 3.687 . 0 0 "[ . 1 . 2]" 1
890 1 44 LEU HB3 1 56 TYR QD . . 3.370 2.429 2.264 2.625 . 0 0 "[ . 1 . 2]" 1
891 1 44 LEU QD 1 56 TYR QB . . 5.280 3.713 3.126 3.862 . 0 0 "[ . 1 . 2]" 1
892 1 44 LEU QD 1 56 TYR QD . . 3.510 2.564 2.368 3.157 . 0 0 "[ . 1 . 2]" 1
893 1 44 LEU QD 1 56 TYR QE . . 3.990 2.535 2.303 3.935 . 0 0 "[ . 1 . 2]" 1
894 1 44 LEU QD 1 57 VAL HA . . 4.460 4.036 2.188 4.261 . 0 0 "[ . 1 . 2]" 1
895 1 44 LEU QD 1 58 HIS H . . 4.430 3.853 2.490 4.022 . 0 0 "[ . 1 . 2]" 1
896 1 44 LEU QD 1 58 HIS HA . . 4.550 3.631 3.279 3.733 . 0 0 "[ . 1 . 2]" 1
897 1 44 LEU QD 1 58 HIS HB2 . . 3.340 1.942 1.899 2.086 . 0 0 "[ . 1 . 2]" 1
898 1 44 LEU QD 1 58 HIS HB3 . . 3.800 2.544 2.026 2.693 . 0 0 "[ . 1 . 2]" 1
899 1 44 LEU QD 1 58 HIS HD2 . . 4.430 3.052 2.752 3.369 . 0 0 "[ . 1 . 2]" 1
900 1 44 LEU QD 1 67 ASP QB . . 4.780 2.484 2.276 3.003 . 0 0 "[ . 1 . 2]" 1
901 1 44 LEU QD 1 68 GLU H . . 5.440 4.418 4.261 4.563 . 0 0 "[ . 1 . 2]" 1
902 1 44 LEU MD1 1 56 TYR QD . . 4.450 2.636 2.383 4.170 . 0 0 "[ . 1 . 2]" 1
903 1 44 LEU MD1 1 57 VAL HA . . 5.210 4.346 4.143 4.539 . 0 0 "[ . 1 . 2]" 1
904 1 44 LEU MD1 1 58 HIS HB2 . . 4.160 2.023 1.906 3.559 . 0 0 "[ . 1 . 2]" 1
905 1 44 LEU MD2 1 56 TYR QD . . 4.450 4.119 3.268 4.349 . 0 0 "[ . 1 . 2]" 1
906 1 44 LEU MD2 1 57 VAL HA . . 5.210 5.064 2.193 5.222 0.012 11 0 "[ . 1 . 2]" 1
907 1 44 LEU MD2 1 58 HIS HB2 . . 4.160 3.549 2.101 3.752 . 0 0 "[ . 1 . 2]" 1
908 1 44 LEU HG 1 56 TYR QD . . 5.020 3.998 2.947 4.129 . 0 0 "[ . 1 . 2]" 1
909 1 44 LEU HG 1 57 VAL HA . . 4.980 3.944 3.845 4.946 . 0 0 "[ . 1 . 2]" 1
910 1 44 LEU HG 1 58 HIS HB3 . . 5.110 2.536 2.324 3.701 . 0 0 "[ . 1 . 2]" 1
911 1 45 SER H 1 45 SER HB3 . . 3.820 3.443 3.200 3.526 . 0 0 "[ . 1 . 2]" 1
912 1 45 SER H 1 56 TYR H . . 3.640 3.134 3.084 3.200 . 0 0 "[ . 1 . 2]" 1
913 1 45 SER H 1 56 TYR HB2 . . 4.290 3.461 3.207 3.685 . 0 0 "[ . 1 . 2]" 1
914 1 45 SER H 1 56 TYR QB . . 3.570 2.161 1.973 2.330 . 0 0 "[ . 1 . 2]" 1
915 1 45 SER H 1 56 TYR HB3 . . 4.290 2.183 1.990 2.358 . 0 0 "[ . 1 . 2]" 1
916 1 45 SER H 1 56 TYR QD . . 5.440 3.703 3.529 3.866 . 0 0 "[ . 1 . 2]" 1
917 1 45 SER HA 1 46 ILE H . . 2.550 2.455 2.293 2.538 . 0 0 "[ . 1 . 2]" 1
918 1 45 SER HB2 1 56 TYR HB2 . . 4.160 3.625 3.362 3.793 . 0 0 "[ . 1 . 2]" 1
919 1 45 SER HB2 1 56 TYR QB . . 3.640 2.985 2.852 3.180 . 0 0 "[ . 1 . 2]" 1
920 1 45 SER HB2 1 56 TYR HB3 . . 4.160 3.179 3.060 3.424 . 0 0 "[ . 1 . 2]" 1
921 1 45 SER HB2 1 56 TYR QD . . 4.400 3.364 3.152 3.648 . 0 0 "[ . 1 . 2]" 1
922 1 45 SER HB2 1 69 TRP HH2 . . 4.830 4.297 3.905 4.574 . 0 0 "[ . 1 . 2]" 1
923 1 45 SER HB2 1 69 TRP HZ2 . . 5.500 5.280 4.617 5.504 0.004 7 0 "[ . 1 . 2]" 1
924 1 45 SER HB3 1 46 ILE H . . 3.720 2.845 2.689 3.497 . 0 0 "[ . 1 . 2]" 1
925 1 45 SER HB3 1 56 TYR H . . 4.540 4.119 3.975 4.315 . 0 0 "[ . 1 . 2]" 1
926 1 45 SER HB3 1 56 TYR HB2 . . 4.010 3.094 2.514 3.365 . 0 0 "[ . 1 . 2]" 1
927 1 45 SER HB3 1 56 TYR HB3 . . 4.010 3.429 2.933 3.770 . 0 0 "[ . 1 . 2]" 1
928 1 45 SER HB3 1 56 TYR QD . . 4.540 4.274 3.662 4.553 0.013 20 0 "[ . 1 . 2]" 1
929 1 45 SER HB3 1 69 TRP HH2 . . 4.100 3.054 2.423 3.298 . 0 0 "[ . 1 . 2]" 1
930 1 45 SER HB3 1 69 TRP HZ2 . . 5.150 4.715 3.845 5.008 . 0 0 "[ . 1 . 2]" 1
931 1 45 SER HB3 1 69 TRP HZ3 . . 5.500 3.675 3.479 4.188 . 0 0 "[ . 1 . 2]" 1
932 1 46 ILE H 1 46 ILE HB . . 3.270 2.728 2.611 2.831 . 0 0 "[ . 1 . 2]" 1
933 1 46 ILE H 1 46 ILE HG12 . . 4.500 4.130 3.895 4.484 . 0 0 "[ . 1 . 2]" 1
934 1 46 ILE H 1 46 ILE HG13 . . 3.400 2.917 2.720 3.263 . 0 0 "[ . 1 . 2]" 1
935 1 46 ILE H 1 46 ILE MG . . 3.950 3.887 3.838 3.930 . 0 0 "[ . 1 . 2]" 1
936 1 46 ILE HA 1 46 ILE MD . . 4.400 3.835 3.699 3.884 . 0 0 "[ . 1 . 2]" 1
937 1 46 ILE HA 1 46 ILE HG12 . . 3.790 2.788 2.593 3.234 . 0 0 "[ . 1 . 2]" 1
938 1 46 ILE HA 1 46 ILE HG13 . . 4.020 2.834 2.400 3.077 . 0 0 "[ . 1 . 2]" 1
939 1 46 ILE HA 1 46 ILE MG . . 2.650 2.297 2.237 2.358 . 0 0 "[ . 1 . 2]" 1
940 1 46 ILE HA 1 47 ASN H . . 2.420 2.203 2.153 2.241 . 0 0 "[ . 1 . 2]" 1
941 1 46 ILE HA 1 47 ASN HB3 . . 5.500 4.501 4.368 4.636 . 0 0 "[ . 1 . 2]" 1
942 1 46 ILE HA 1 55 PHE HA . . 2.810 2.505 2.367 2.640 . 0 0 "[ . 1 . 2]" 1
943 1 46 ILE HA 1 55 PHE HB3 . . 5.500 3.747 3.615 3.949 . 0 0 "[ . 1 . 2]" 1
944 1 46 ILE HA 1 55 PHE QD . . 4.410 3.059 2.904 3.324 . 0 0 "[ . 1 . 2]" 1
945 1 46 ILE HA 1 56 TYR H . . 4.270 3.190 3.069 3.329 . 0 0 "[ . 1 . 2]" 1
946 1 46 ILE HA 1 69 TRP HZ3 . . 4.610 3.719 2.989 3.971 . 0 0 "[ . 1 . 2]" 1
947 1 46 ILE HB 1 46 ILE MD . . 2.530 2.235 2.103 2.327 . 0 0 "[ . 1 . 2]" 1
948 1 46 ILE HB 1 48 THR H . . 5.270 5.067 4.964 5.188 . 0 0 "[ . 1 . 2]" 1
949 1 46 ILE MD 1 46 ILE MG . . 2.980 2.310 2.009 2.870 . 0 0 "[ . 1 . 2]" 1
950 1 46 ILE MD 1 47 ASN H . . 5.170 5.020 4.876 5.178 0.008 4 0 "[ . 1 . 2]" 1
951 1 46 ILE MD 1 55 PHE HA . . 5.500 5.457 5.269 5.507 0.007 20 0 "[ . 1 . 2]" 1
952 1 46 ILE MD 1 55 PHE QD . . 4.370 3.421 3.178 3.739 . 0 0 "[ . 1 . 2]" 1
953 1 46 ILE MD 1 55 PHE QE . . 3.950 3.101 2.499 3.953 0.003 3 0 "[ . 1 . 2]" 1
954 1 46 ILE HG12 1 46 ILE MG . . 3.600 2.272 1.974 2.401 . 0 0 "[ . 1 . 2]" 1
955 1 46 ILE HG12 1 55 PHE HA . . 4.760 4.349 3.988 4.767 0.007 2 0 "[ . 1 . 2]" 1
956 1 46 ILE HG12 1 55 PHE QE . . 3.900 2.948 2.408 3.409 . 0 0 "[ . 1 . 2]" 1
957 1 46 ILE HG12 1 56 TYR H . . 5.500 4.779 4.274 5.394 . 0 0 "[ . 1 . 2]" 1
958 1 46 ILE HG13 1 46 ILE MG . . 3.500 3.133 2.952 3.201 . 0 0 "[ . 1 . 2]" 1
959 1 46 ILE HG13 1 55 PHE HA . . 5.400 4.845 4.110 5.291 . 0 0 "[ . 1 . 2]" 1
960 1 46 ILE HG13 1 55 PHE QD . . 4.340 3.384 2.496 4.008 . 0 0 "[ . 1 . 2]" 1
961 1 46 ILE HG13 1 55 PHE QE . . 5.280 4.537 3.976 4.999 . 0 0 "[ . 1 . 2]" 1
962 1 46 ILE MG 1 47 ASN H . . 3.870 2.252 1.950 2.422 . 0 0 "[ . 1 . 2]" 1
963 1 46 ILE MG 1 47 ASN HA . . 4.860 3.572 3.455 3.798 . 0 0 "[ . 1 . 2]" 1
964 1 46 ILE MG 1 48 THR H . . 4.880 3.373 3.195 3.617 . 0 0 "[ . 1 . 2]" 1
965 1 46 ILE MG 1 48 THR HA . . 4.470 4.167 4.099 4.303 . 0 0 "[ . 1 . 2]" 1
966 1 46 ILE MG 1 48 THR HB . . 5.500 4.763 4.697 4.834 . 0 0 "[ . 1 . 2]" 1
967 1 46 ILE MG 1 48 THR MG . . 2.940 2.298 2.191 2.462 . 0 0 "[ . 1 . 2]" 1
968 1 46 ILE MG 1 53 PRO HB2 . . 4.170 3.854 3.728 3.904 . 0 0 "[ . 1 . 2]" 1
969 1 46 ILE MG 1 53 PRO HB3 . . 4.800 4.802 4.646 4.831 0.031 17 0 "[ . 1 . 2]" 1
970 1 46 ILE MG 1 54 LYS H . . 4.700 4.524 4.420 4.675 . 0 0 "[ . 1 . 2]" 1
971 1 46 ILE MG 1 55 PHE H . . 5.460 5.380 5.225 5.464 0.004 10 0 "[ . 1 . 2]" 1
972 1 46 ILE MG 1 55 PHE HA . . 4.400 3.479 3.292 3.582 . 0 0 "[ . 1 . 2]" 1
973 1 46 ILE MG 1 55 PHE QD . . 3.420 2.609 2.474 2.826 . 0 0 "[ . 1 . 2]" 1
974 1 46 ILE MG 1 55 PHE QE . . 3.890 2.216 2.044 2.431 . 0 0 "[ . 1 . 2]" 1
975 1 46 ILE MG 1 56 TYR H . . 5.160 4.798 4.627 4.897 . 0 0 "[ . 1 . 2]" 1
976 1 47 ASN H 1 48 THR H . . 4.270 3.909 3.781 4.033 . 0 0 "[ . 1 . 2]" 1
977 1 47 ASN H 1 48 THR MG . . 5.290 3.882 3.567 4.067 . 0 0 "[ . 1 . 2]" 1
978 1 47 ASN H 1 53 PRO HB2 . . 4.490 4.409 4.274 4.501 0.011 7 0 "[ . 1 . 2]" 1
979 1 47 ASN H 1 54 LYS H . . 3.970 3.877 3.741 3.979 0.009 18 0 "[ . 1 . 2]" 1
980 1 47 ASN H 1 55 PHE QD . . 4.760 4.086 3.977 4.343 . 0 0 "[ . 1 . 2]" 1
981 1 47 ASN H 1 56 TYR H . . 4.980 4.446 4.283 4.638 . 0 0 "[ . 1 . 2]" 1
982 1 47 ASN H 1 69 TRP HZ3 . . 3.980 3.280 2.249 3.627 . 0 0 "[ . 1 . 2]" 1
983 1 47 ASN HA 1 47 ASN HB2 . . 2.510 2.444 2.393 2.520 0.010 12 0 "[ . 1 . 2]" 1
984 1 47 ASN HA 1 48 THR H . . 2.580 2.185 2.171 2.204 . 0 0 "[ . 1 . 2]" 1
985 1 47 ASN HA 1 48 THR MG . . 4.960 4.136 4.076 4.318 . 0 0 "[ . 1 . 2]" 1
986 1 47 ASN HA 1 49 ARG H . . 4.460 4.260 3.807 4.380 . 0 0 "[ . 1 . 2]" 1
987 1 47 ASN HA 1 69 TRP HH2 . . 5.500 5.102 4.083 5.439 . 0 0 "[ . 1 . 2]" 1
988 1 47 ASN HA 1 69 TRP HZ3 . . 5.160 4.092 3.971 4.221 . 0 0 "[ . 1 . 2]" 1
989 1 47 ASN HB2 1 48 THR H . . 4.770 4.471 4.433 4.547 . 0 0 "[ . 1 . 2]" 1
990 1 47 ASN HB2 1 54 LYS HB2 . . 4.510 4.381 4.161 4.513 0.003 15 0 "[ . 1 . 2]" 1
991 1 47 ASN HB2 1 54 LYS HB3 . . 5.220 4.968 4.700 5.223 0.003 15 0 "[ . 1 . 2]" 1
992 1 47 ASN HB2 1 69 TRP HH2 . . 4.320 3.146 2.392 3.419 . 0 0 "[ . 1 . 2]" 1
993 1 47 ASN HB2 1 69 TRP HZ2 . . 5.350 5.108 3.972 5.351 0.001 2 0 "[ . 1 . 2]" 1
994 1 47 ASN HB2 1 69 TRP HZ3 . . 4.180 2.132 1.997 2.737 . 0 0 "[ . 1 . 2]" 1
995 1 47 ASN HB3 1 54 LYS HA . . 5.500 4.894 4.726 5.099 . 0 0 "[ . 1 . 2]" 1
996 1 47 ASN HB3 1 54 LYS HB2 . . 4.170 2.700 2.475 2.853 . 0 0 "[ . 1 . 2]" 1
997 1 47 ASN HB3 1 54 LYS HB3 . . 4.500 3.450 3.230 3.777 . 0 0 "[ . 1 . 2]" 1
998 1 47 ASN HB3 1 69 TRP HE3 . . 4.510 3.247 3.003 3.533 . 0 0 "[ . 1 . 2]" 1
999 1 47 ASN HB3 1 69 TRP HH2 . . 4.940 4.454 3.504 4.839 . 0 0 "[ . 1 . 2]" 1
1000 1 47 ASN HB3 1 69 TRP HZ3 . . 4.070 2.591 2.241 2.833 . 0 0 "[ . 1 . 2]" 1
1001 1 47 ASN QD 1 54 LYS HB2 . . 4.480 2.687 1.991 4.238 . 0 0 "[ . 1 . 2]" 1
1002 1 47 ASN QD 1 54 LYS QD . . 5.340 3.278 2.643 4.368 . 0 0 "[ . 1 . 2]" 1
1003 1 47 ASN HD21 1 54 LYS HB2 . . 5.140 2.756 2.005 4.513 . 0 0 "[ . 1 . 2]" 1
1004 1 47 ASN HD22 1 54 LYS HB2 . . 5.140 3.988 3.412 5.143 0.003 10 0 "[ . 1 . 2]" 1
1005 1 48 THR H 1 48 THR MG . . 3.410 2.788 2.733 2.950 . 0 0 "[ . 1 . 2]" 1
1006 1 48 THR H 1 49 ARG H . . 3.530 3.472 3.121 3.552 0.022 16 0 "[ . 1 . 2]" 1
1007 1 48 THR H 1 49 ARG QB . . 5.340 4.593 4.196 4.868 . 0 0 "[ . 1 . 2]" 1
1008 1 48 THR H 1 50 LYS H . . 5.490 5.260 5.011 5.314 . 0 0 "[ . 1 . 2]" 1
1009 1 48 THR HA 1 48 THR HB . . 2.550 2.492 2.475 2.552 0.002 13 0 "[ . 1 . 2]" 1
1010 1 48 THR HA 1 48 THR MG . . 2.400 2.226 2.145 2.340 . 0 0 "[ . 1 . 2]" 1
1011 1 48 THR HA 1 53 PRO HA . . 4.030 3.056 2.684 3.203 . 0 0 "[ . 1 . 2]" 1
1012 1 48 THR HA 1 53 PRO HB2 . . 3.250 2.514 2.467 2.582 . 0 0 "[ . 1 . 2]" 1
1013 1 48 THR HB 1 49 ARG HA . . 5.500 4.723 4.679 4.834 . 0 0 "[ . 1 . 2]" 1
1014 1 48 THR HB 1 50 LYS H . . 5.060 4.529 4.381 4.752 . 0 0 "[ . 1 . 2]" 1
1015 1 48 THR HB 1 53 PRO HA . . 5.020 4.891 4.358 5.036 0.016 7 0 "[ . 1 . 2]" 1
1016 1 48 THR HB 1 53 PRO HB2 . . 4.560 4.185 3.825 4.342 . 0 0 "[ . 1 . 2]" 1
1017 1 48 THR MG 1 49 ARG H . . 4.490 4.315 4.304 4.347 . 0 0 "[ . 1 . 2]" 1
1018 1 48 THR MG 1 53 PRO HA . . 4.460 4.306 3.834 4.467 0.007 7 0 "[ . 1 . 2]" 1
1019 1 48 THR MG 1 53 PRO HB2 . . 3.000 2.458 2.063 2.622 . 0 0 "[ . 1 . 2]" 1
1020 1 48 THR MG 1 53 PRO HB3 . . 4.170 2.573 2.141 2.731 . 0 0 "[ . 1 . 2]" 1
1021 1 48 THR MG 1 53 PRO HD3 . . 4.720 4.564 4.118 4.723 0.003 5 0 "[ . 1 . 2]" 1
1022 1 48 THR MG 1 53 PRO HG2 . . 4.770 3.738 3.388 3.867 . 0 0 "[ . 1 . 2]" 1
1023 1 48 THR MG 1 53 PRO HG3 . . 4.160 2.987 2.483 3.142 . 0 0 "[ . 1 . 2]" 1
1024 1 48 THR MG 1 54 LYS H . . 4.000 3.962 3.743 4.013 0.013 16 0 "[ . 1 . 2]" 1
1025 1 48 THR MG 1 55 PHE HZ . . 4.880 3.803 3.621 3.955 . 0 0 "[ . 1 . 2]" 1
1026 1 49 ARG H 1 49 ARG QB . . 2.530 2.485 2.394 2.603 0.073 12 0 "[ . 1 . 2]" 1
1027 1 49 ARG H 1 49 ARG QD . . 5.160 4.323 3.423 4.882 . 0 0 "[ . 1 . 2]" 1
1028 1 49 ARG H 1 49 ARG QG . . 3.360 2.936 2.287 3.362 0.002 2 0 "[ . 1 . 2]" 1
1029 1 49 ARG H 1 50 LYS H . . 2.680 2.192 2.135 2.449 . 0 0 "[ . 1 . 2]" 1
1030 1 49 ARG HA 1 49 ARG QB . . 2.520 2.365 2.172 2.481 . 0 0 "[ . 1 . 2]" 1
1031 1 49 ARG HA 1 49 ARG QD . . 4.300 3.499 2.252 4.319 0.019 12 0 "[ . 1 . 2]" 1
1032 1 49 ARG HA 1 49 ARG HG2 . . 4.110 2.872 2.216 3.800 . 0 0 "[ . 1 . 2]" 1
1033 1 49 ARG HA 1 49 ARG HG3 . . 4.110 3.490 2.698 3.813 . 0 0 "[ . 1 . 2]" 1
1034 1 49 ARG QB 1 49 ARG QD . . 3.150 2.135 1.997 2.321 . 0 0 "[ . 1 . 2]" 1
1035 1 49 ARG QB 1 50 LYS H . . 4.100 3.623 3.522 3.942 . 0 0 "[ . 1 . 2]" 1
1036 1 50 LYS H 1 50 LYS HB2 . . 3.840 2.788 2.565 2.926 . 0 0 "[ . 1 . 2]" 1
1037 1 50 LYS H 1 50 LYS QB . . 3.240 2.618 2.459 2.674 . 0 0 "[ . 1 . 2]" 1
1038 1 50 LYS H 1 50 LYS HB3 . . 3.840 3.225 3.062 3.498 . 0 0 "[ . 1 . 2]" 1
1039 1 50 LYS H 1 50 LYS QG . . 4.420 4.181 3.908 4.335 . 0 0 "[ . 1 . 2]" 1
1040 1 50 LYS H 1 51 ALA H . . 4.520 4.406 4.398 4.409 . 0 0 "[ . 1 . 2]" 1
1041 1 50 LYS HA 1 50 LYS QB . . 2.610 2.514 2.488 2.540 . 0 0 "[ . 1 . 2]" 1
1042 1 50 LYS HA 1 50 LYS HD2 . . 4.840 3.614 2.114 4.521 . 0 0 "[ . 1 . 2]" 1
1043 1 50 LYS HA 1 50 LYS QD . . 4.050 3.276 2.080 3.944 . 0 0 "[ . 1 . 2]" 1
1044 1 50 LYS HA 1 50 LYS HD3 . . 4.840 3.977 2.332 4.643 . 0 0 "[ . 1 . 2]" 1
1045 1 50 LYS HA 1 50 LYS QG . . 2.820 2.182 2.066 2.467 . 0 0 "[ . 1 . 2]" 1
1046 1 50 LYS HA 1 51 ALA H . . 2.700 2.567 2.543 2.640 . 0 0 "[ . 1 . 2]" 1
1047 1 50 LYS HB2 1 51 ALA H . . 3.820 3.795 3.718 3.827 0.007 13 0 "[ . 1 . 2]" 1
1048 1 50 LYS HB3 1 51 ALA H . . 3.820 2.641 2.285 2.884 . 0 0 "[ . 1 . 2]" 1
1049 1 50 LYS QG 1 51 ALA H . . 2.980 2.185 1.936 2.814 . 0 0 "[ . 1 . 2]" 1
1050 1 50 LYS QG 1 53 PRO HA . . 5.500 4.758 4.471 5.297 . 0 0 "[ . 1 . 2]" 1
1051 1 51 ALA H 1 51 ALA MB . . 3.130 2.553 2.543 2.557 . 0 0 "[ . 1 . 2]" 1
1052 1 51 ALA HA 1 52 PRO HA . . 2.400 1.888 1.881 1.912 . 0 0 "[ . 1 . 2]" 1
1053 1 51 ALA HA 1 52 PRO HB2 . . 5.030 4.291 4.262 4.305 . 0 0 "[ . 1 . 2]" 1
1054 1 51 ALA HA 1 52 PRO QB . . 4.250 3.735 3.732 3.737 . 0 0 "[ . 1 . 2]" 1
1055 1 51 ALA HA 1 52 PRO HB3 . . 5.030 4.107 4.101 4.125 . 0 0 "[ . 1 . 2]" 1
1056 1 51 ALA HA 1 52 PRO QG . . 4.890 4.547 4.518 4.559 . 0 0 "[ . 1 . 2]" 1
1057 1 51 ALA HA 1 53 PRO HD2 . . 4.200 3.944 3.926 3.967 . 0 0 "[ . 1 . 2]" 1
1058 1 51 ALA HA 1 53 PRO HD3 . . 4.030 3.035 3.003 3.084 . 0 0 "[ . 1 . 2]" 1
1059 1 51 ALA MB 1 52 PRO HA . . 3.290 3.232 3.111 3.279 . 0 0 "[ . 1 . 2]" 1
1060 1 51 ALA MB 1 52 PRO QB . . 4.820 4.478 4.374 4.519 . 0 0 "[ . 1 . 2]" 1
1061 1 51 ALA MB 1 52 PRO HD2 . . 5.420 4.577 4.561 4.583 . 0 0 "[ . 1 . 2]" 1
1062 1 51 ALA MB 1 52 PRO QD . . 4.710 3.890 3.845 3.907 . 0 0 "[ . 1 . 2]" 1
1063 1 51 ALA MB 1 52 PRO HD3 . . 5.420 4.209 4.140 4.236 . 0 0 "[ . 1 . 2]" 1
1064 1 51 ALA MB 1 53 PRO HA . . 5.500 5.104 5.096 5.111 . 0 0 "[ . 1 . 2]" 1
1065 1 51 ALA MB 1 53 PRO HB3 . . 5.500 5.564 5.539 5.582 0.082 7 0 "[ . 1 . 2]" 1
1066 1 51 ALA MB 1 53 PRO HD2 . . 5.390 5.131 5.040 5.173 . 0 0 "[ . 1 . 2]" 1
1067 1 51 ALA MB 1 53 PRO HD3 . . 4.510 4.175 4.090 4.219 . 0 0 "[ . 1 . 2]" 1
1068 1 52 PRO HA 1 53 PRO HD2 . . 2.770 2.503 2.487 2.528 . 0 0 "[ . 1 . 2]" 1
1069 1 52 PRO HA 1 53 PRO HD3 . . 2.400 2.351 2.343 2.364 . 0 0 "[ . 1 . 2]" 1
1070 1 52 PRO QB 1 53 PRO HD2 . . 3.340 2.077 2.029 2.106 . 0 0 "[ . 1 . 2]" 1
1071 1 52 PRO QB 1 53 PRO HD3 . . 3.590 3.279 3.242 3.302 . 0 0 "[ . 1 . 2]" 1
1072 1 52 PRO QB 1 72 THR HB . . 4.400 4.310 4.175 4.405 0.005 19 0 "[ . 1 . 2]" 1
1073 1 52 PRO QB 1 72 THR MG . . 3.730 2.048 1.911 2.221 . 0 0 "[ . 1 . 2]" 1
1074 1 52 PRO HB2 1 53 PRO HD2 . . 3.810 2.148 2.092 2.182 . 0 0 "[ . 1 . 2]" 1
1075 1 52 PRO HB2 1 53 PRO HD3 . . 4.220 3.575 3.528 3.604 . 0 0 "[ . 1 . 2]" 1
1076 1 52 PRO HB2 1 72 THR HB . . 5.280 4.684 4.586 4.744 . 0 0 "[ . 1 . 2]" 1
1077 1 52 PRO HB2 1 72 THR MG . . 4.300 2.089 1.956 2.264 . 0 0 "[ . 1 . 2]" 1
1078 1 52 PRO HB3 1 53 PRO HD2 . . 3.810 2.758 2.731 2.775 . 0 0 "[ . 1 . 2]" 1
1079 1 52 PRO HB3 1 53 PRO HD3 . . 4.220 3.813 3.781 3.833 . 0 0 "[ . 1 . 2]" 1
1080 1 52 PRO HB3 1 72 THR HB . . 5.280 5.039 4.803 5.237 . 0 0 "[ . 1 . 2]" 1
1081 1 52 PRO HB3 1 72 THR MG . . 4.300 2.949 2.684 3.223 . 0 0 "[ . 1 . 2]" 1
1082 1 52 PRO QG 1 72 THR HB . . 4.700 4.688 4.528 4.708 0.008 8 0 "[ . 1 . 2]" 1
1083 1 52 PRO QG 1 72 THR MG . . 4.390 3.043 2.852 3.247 . 0 0 "[ . 1 . 2]" 1
1084 1 52 PRO QG 1 73 ASP H . . 4.560 3.959 3.750 4.100 . 0 0 "[ . 1 . 2]" 1
1085 1 53 PRO HA 1 54 LYS H . . 2.550 2.496 2.340 2.570 0.020 20 0 "[ . 1 . 2]" 1
1086 1 53 PRO HA 1 72 THR MG . . 5.500 5.298 5.227 5.377 . 0 0 "[ . 1 . 2]" 1
1087 1 53 PRO HB2 1 54 LYS H . . 3.610 2.387 2.215 2.770 . 0 0 "[ . 1 . 2]" 1
1088 1 53 PRO HB3 1 55 PHE QE . . 4.730 4.738 4.733 4.744 0.014 17 0 "[ . 1 . 2]" 1
1089 1 53 PRO HB3 1 55 PHE HZ . . 5.200 4.936 4.784 5.200 . 0 0 "[ . 1 . 2]" 1
1090 1 53 PRO HB3 1 72 THR MG . . 5.500 5.441 5.319 5.502 0.002 11 0 "[ . 1 . 2]" 1
1091 1 53 PRO HD2 1 72 THR MG . . 4.210 2.813 2.710 2.911 . 0 0 "[ . 1 . 2]" 1
1092 1 53 PRO HD3 1 72 THR MG . . 4.950 4.273 4.170 4.375 . 0 0 "[ . 1 . 2]" 1
1093 1 53 PRO HG2 1 55 PHE QE . . 4.440 2.268 2.129 2.441 . 0 0 "[ . 1 . 2]" 1
1094 1 53 PRO HG2 1 55 PHE HZ . . 5.290 2.880 2.746 3.087 . 0 0 "[ . 1 . 2]" 1
1095 1 53 PRO HG2 1 72 THR H . . 5.500 5.218 4.939 5.380 . 0 0 "[ . 1 . 2]" 1
1096 1 53 PRO HG2 1 72 THR MG . . 5.070 3.207 3.054 3.292 . 0 0 "[ . 1 . 2]" 1
1097 1 53 PRO HG3 1 55 PHE QE . . 4.610 3.850 3.732 3.997 . 0 0 "[ . 1 . 2]" 1
1098 1 53 PRO HG3 1 55 PHE HZ . . 5.100 3.546 3.408 3.747 . 0 0 "[ . 1 . 2]" 1
1099 1 54 LYS H 1 54 LYS HB2 . . 3.210 2.496 2.416 2.555 . 0 0 "[ . 1 . 2]" 1
1100 1 54 LYS H 1 54 LYS HG3 . . 3.710 3.353 2.917 3.671 . 0 0 "[ . 1 . 2]" 1
1101 1 54 LYS HA 1 54 LYS HB3 . . 2.870 2.598 2.496 2.663 . 0 0 "[ . 1 . 2]" 1
1102 1 54 LYS HA 1 54 LYS QD . . 4.210 3.958 3.809 4.047 . 0 0 "[ . 1 . 2]" 1
1103 1 54 LYS HA 1 54 LYS QE . . 5.340 4.413 4.195 4.687 . 0 0 "[ . 1 . 2]" 1
1104 1 54 LYS HA 1 54 LYS HG2 . . 2.600 2.409 2.229 2.580 . 0 0 "[ . 1 . 2]" 1
1105 1 54 LYS HA 1 54 LYS HG3 . . 3.060 2.937 2.766 3.064 0.004 14 0 "[ . 1 . 2]" 1
1106 1 54 LYS HA 1 55 PHE H . . 2.850 2.343 2.270 2.377 . 0 0 "[ . 1 . 2]" 1
1107 1 54 LYS HA 1 55 PHE QD . . 4.560 2.903 2.845 2.975 . 0 0 "[ . 1 . 2]" 1
1108 1 54 LYS HA 1 69 TRP HE3 . . 5.210 4.793 4.167 5.052 . 0 0 "[ . 1 . 2]" 1
1109 1 54 LYS HA 1 71 THR HA . . 3.770 2.759 2.552 2.904 . 0 0 "[ . 1 . 2]" 1
1110 1 54 LYS HA 1 71 THR HB . . 5.500 4.936 4.555 5.149 . 0 0 "[ . 1 . 2]" 1
1111 1 54 LYS HA 1 71 THR MG . . 4.460 2.943 2.453 3.185 . 0 0 "[ . 1 . 2]" 1
1112 1 54 LYS HB2 1 55 PHE H . . 4.400 3.903 3.720 4.069 . 0 0 "[ . 1 . 2]" 1
1113 1 54 LYS HB2 1 55 PHE HA . . 5.160 4.876 4.648 5.007 . 0 0 "[ . 1 . 2]" 1
1114 1 54 LYS HB2 1 69 TRP HE3 . . 4.130 3.688 3.457 3.863 . 0 0 "[ . 1 . 2]" 1
1115 1 54 LYS HB2 1 69 TRP HZ3 . . 4.920 4.656 4.176 4.922 0.002 20 0 "[ . 1 . 2]" 1
1116 1 54 LYS HB3 1 54 LYS HE2 . . 5.080 4.206 3.806 4.635 . 0 0 "[ . 1 . 2]" 1
1117 1 54 LYS HB3 1 54 LYS HE3 . . 5.080 4.445 3.828 4.832 . 0 0 "[ . 1 . 2]" 1
1118 1 54 LYS HB3 1 55 PHE H . . 3.970 2.608 2.503 2.826 . 0 0 "[ . 1 . 2]" 1
1119 1 54 LYS HB3 1 55 PHE HA . . 5.260 4.207 4.124 4.348 . 0 0 "[ . 1 . 2]" 1
1120 1 54 LYS HB3 1 69 TRP HB2 . . 5.500 4.413 4.282 4.659 . 0 0 "[ . 1 . 2]" 1
1121 1 54 LYS HB3 1 69 TRP QB . . 4.650 2.794 2.716 2.961 . 0 0 "[ . 1 . 2]" 1
1122 1 54 LYS HB3 1 69 TRP HB3 . . 5.500 2.825 2.747 2.995 . 0 0 "[ . 1 . 2]" 1
1123 1 54 LYS HB3 1 69 TRP HE3 . . 3.680 2.678 2.151 2.952 . 0 0 "[ . 1 . 2]" 1
1124 1 54 LYS HB3 1 69 TRP HZ3 . . 4.960 4.465 3.647 4.869 . 0 0 "[ . 1 . 2]" 1
1125 1 54 LYS HB3 1 71 THR HA . . 5.130 4.682 4.320 4.990 . 0 0 "[ . 1 . 2]" 1
1126 1 54 LYS QD 1 54 LYS HG2 . . 2.620 2.430 2.339 2.479 . 0 0 "[ . 1 . 2]" 1
1127 1 54 LYS QD 1 54 LYS HG3 . . 2.400 2.265 2.213 2.358 . 0 0 "[ . 1 . 2]" 1
1128 1 54 LYS QD 1 69 TRP HA . . 5.500 5.029 4.463 5.447 . 0 0 "[ . 1 . 2]" 1
1129 1 54 LYS QD 1 69 TRP HB2 . . 5.010 3.494 2.993 3.950 . 0 0 "[ . 1 . 2]" 1
1130 1 54 LYS QD 1 69 TRP QB . . 4.330 2.658 2.161 3.035 . 0 0 "[ . 1 . 2]" 1
1131 1 54 LYS QD 1 69 TRP HB3 . . 5.010 2.761 2.198 3.171 . 0 0 "[ . 1 . 2]" 1
1132 1 54 LYS QD 1 69 TRP HE3 . . 4.530 3.853 3.330 4.150 . 0 0 "[ . 1 . 2]" 1
1133 1 54 LYS QE 1 54 LYS HG2 . . 3.560 2.251 2.082 2.516 . 0 0 "[ . 1 . 2]" 1
1134 1 54 LYS QE 1 71 THR HA . . 5.340 4.786 4.169 5.205 . 0 0 "[ . 1 . 2]" 1
1135 1 54 LYS QE 1 71 THR MG . . 3.640 2.530 2.123 2.800 . 0 0 "[ . 1 . 2]" 1
1136 1 54 LYS HE2 1 71 THR MG . . 4.290 3.071 2.322 4.162 . 0 0 "[ . 1 . 2]" 1
1137 1 54 LYS HE3 1 71 THR MG . . 4.290 3.157 2.136 4.163 . 0 0 "[ . 1 . 2]" 1
1138 1 54 LYS HG2 1 55 PHE H . . 4.610 3.686 3.437 4.016 . 0 0 "[ . 1 . 2]" 1
1139 1 54 LYS HG2 1 71 THR H . . 5.500 4.891 4.527 5.214 . 0 0 "[ . 1 . 2]" 1
1140 1 54 LYS HG2 1 71 THR HA . . 4.220 3.411 3.101 3.642 . 0 0 "[ . 1 . 2]" 1
1141 1 55 PHE H 1 55 PHE HB2 . . 3.480 2.803 2.736 2.825 . 0 0 "[ . 1 . 2]" 1
1142 1 55 PHE H 1 55 PHE QD . . 3.890 2.744 2.642 2.771 . 0 0 "[ . 1 . 2]" 1
1143 1 55 PHE H 1 57 VAL MG2 . . 5.500 5.483 5.392 5.506 0.006 12 0 "[ . 1 . 2]" 1
1144 1 55 PHE H 1 69 TRP HA . . 4.340 4.135 4.096 4.235 . 0 0 "[ . 1 . 2]" 1
1145 1 55 PHE H 1 69 TRP HE3 . . 4.210 3.468 2.692 3.725 . 0 0 "[ . 1 . 2]" 1
1146 1 55 PHE H 1 70 ILE H . . 3.920 3.248 2.632 3.525 . 0 0 "[ . 1 . 2]" 1
1147 1 55 PHE H 1 71 THR MG . . 4.610 4.243 3.959 4.486 . 0 0 "[ . 1 . 2]" 1
1148 1 55 PHE H 1 75 ILE MD . . 5.500 4.750 4.597 4.902 . 0 0 "[ . 1 . 2]" 1
1149 1 55 PHE HA 1 55 PHE QD . . 4.180 3.107 3.099 3.121 . 0 0 "[ . 1 . 2]" 1
1150 1 55 PHE HA 1 55 PHE QE . . 5.420 4.738 4.711 4.749 . 0 0 "[ . 1 . 2]" 1
1151 1 55 PHE HA 1 56 TYR H . . 2.600 2.275 2.253 2.293 . 0 0 "[ . 1 . 2]" 1
1152 1 55 PHE HA 1 56 TYR QB . . 4.920 3.980 3.973 3.985 . 0 0 "[ . 1 . 2]" 1
1153 1 55 PHE HA 1 57 VAL MG1 . . 5.290 5.204 5.091 5.253 . 0 0 "[ . 1 . 2]" 1
1154 1 55 PHE HA 1 69 TRP HE3 . . 4.760 3.423 3.050 3.656 . 0 0 "[ . 1 . 2]" 1
1155 1 55 PHE HA 1 69 TRP HZ3 . . 4.250 3.504 2.343 3.958 . 0 0 "[ . 1 . 2]" 1
1156 1 55 PHE HB2 1 56 TYR H . . 3.960 3.835 3.796 3.892 . 0 0 "[ . 1 . 2]" 1
1157 1 55 PHE HB2 1 57 VAL MG1 . . 3.940 3.475 3.391 3.571 . 0 0 "[ . 1 . 2]" 1
1158 1 55 PHE HB2 1 70 ILE H . . 4.430 4.021 3.825 4.146 . 0 0 "[ . 1 . 2]" 1
1159 1 55 PHE HB2 1 70 ILE MD . . 4.320 3.692 3.532 3.797 . 0 0 "[ . 1 . 2]" 1
1160 1 55 PHE HB2 1 70 ILE HG13 . . 3.990 2.903 2.752 2.947 . 0 0 "[ . 1 . 2]" 1
1161 1 55 PHE HB3 1 57 VAL MG1 . . 3.800 3.703 3.599 3.795 . 0 0 "[ . 1 . 2]" 1
1162 1 55 PHE HB3 1 70 ILE HG13 . . 4.490 4.446 4.189 4.494 0.004 17 0 "[ . 1 . 2]" 1
1163 1 55 PHE HB3 1 75 ILE MD . . 4.520 4.342 4.093 4.469 . 0 0 "[ . 1 . 2]" 1
1164 1 55 PHE QD 1 56 TYR H . . 4.600 4.063 4.011 4.098 . 0 0 "[ . 1 . 2]" 1
1165 1 55 PHE QD 1 70 ILE MD . . 4.870 4.781 4.623 4.867 . 0 0 "[ . 1 . 2]" 1
1166 1 55 PHE QD 1 70 ILE HG12 . . 5.500 5.347 5.062 5.494 . 0 0 "[ . 1 . 2]" 1
1167 1 55 PHE QD 1 70 ILE HG13 . . 5.480 4.031 3.820 4.178 . 0 0 "[ . 1 . 2]" 1
1168 1 55 PHE QD 1 72 THR HA . . 4.590 4.487 4.414 4.594 0.004 10 0 "[ . 1 . 2]" 1
1169 1 55 PHE QD 1 72 THR MG . . 5.170 3.751 3.576 3.983 . 0 0 "[ . 1 . 2]" 1
1170 1 55 PHE QD 1 75 ILE MD . . 4.090 2.932 2.782 3.142 . 0 0 "[ . 1 . 2]" 1
1171 1 55 PHE QE 1 72 THR HA . . 4.400 4.385 4.330 4.408 0.008 20 0 "[ . 1 . 2]" 1
1172 1 55 PHE QE 1 72 THR MG . . 4.250 2.561 2.462 2.742 . 0 0 "[ . 1 . 2]" 1
1173 1 55 PHE QE 1 75 ILE MD . . 4.260 3.572 3.406 3.690 . 0 0 "[ . 1 . 2]" 1
1174 1 55 PHE HZ 1 72 THR MG . . 4.320 4.059 3.877 4.174 . 0 0 "[ . 1 . 2]" 1
1175 1 56 TYR H 1 56 TYR HB2 . . 3.730 2.547 2.506 2.579 . 0 0 "[ . 1 . 2]" 1
1176 1 56 TYR H 1 56 TYR QB . . 3.270 2.366 2.354 2.375 . 0 0 "[ . 1 . 2]" 1
1177 1 56 TYR H 1 56 TYR HB3 . . 3.730 2.810 2.777 2.857 . 0 0 "[ . 1 . 2]" 1
1178 1 56 TYR H 1 56 TYR QD . . 4.840 4.196 4.162 4.217 . 0 0 "[ . 1 . 2]" 1
1179 1 56 TYR H 1 69 TRP HZ3 . . 4.660 3.788 3.059 4.098 . 0 0 "[ . 1 . 2]" 1
1180 1 56 TYR HA 1 56 TYR QB . . 2.520 2.467 2.457 2.480 . 0 0 "[ . 1 . 2]" 1
1181 1 56 TYR HA 1 56 TYR QD . . 3.320 2.063 2.006 2.093 . 0 0 "[ . 1 . 2]" 1
1182 1 56 TYR HA 1 57 VAL H . . 2.830 2.140 2.138 2.146 . 0 0 "[ . 1 . 2]" 1
1183 1 56 TYR HA 1 69 TRP HA . . 2.400 2.292 2.240 2.409 0.009 16 0 "[ . 1 . 2]" 1
1184 1 56 TYR HA 1 69 TRP HE3 . . 4.630 3.737 3.482 3.844 . 0 0 "[ . 1 . 2]" 1
1185 1 56 TYR HA 1 70 ILE H . . 4.300 3.374 3.273 3.622 . 0 0 "[ . 1 . 2]" 1
1186 1 56 TYR QB 1 57 VAL H . . 4.440 3.804 3.743 3.848 . 0 0 "[ . 1 . 2]" 1
1187 1 56 TYR QB 1 69 TRP HA . . 4.560 4.087 3.998 4.228 . 0 0 "[ . 1 . 2]" 1
1188 1 56 TYR QB 1 69 TRP HE3 . . 4.770 3.519 3.357 3.867 . 0 0 "[ . 1 . 2]" 1
1189 1 56 TYR QB 1 69 TRP HZ3 . . 5.050 3.199 3.029 3.399 . 0 0 "[ . 1 . 2]" 1
1190 1 56 TYR HB2 1 57 VAL H . . 5.200 4.486 4.445 4.537 . 0 0 "[ . 1 . 2]" 1
1191 1 56 TYR HB2 1 69 TRP HA . . 5.360 4.283 4.175 4.443 . 0 0 "[ . 1 . 2]" 1
1192 1 56 TYR HB2 1 69 TRP HE3 . . 5.430 3.581 3.408 3.959 . 0 0 "[ . 1 . 2]" 1
1193 1 56 TYR HB3 1 57 VAL H . . 5.200 4.110 4.028 4.159 . 0 0 "[ . 1 . 2]" 1
1194 1 56 TYR HB3 1 69 TRP HA . . 5.360 5.167 5.111 5.303 . 0 0 "[ . 1 . 2]" 1
1195 1 56 TYR HB3 1 69 TRP HE3 . . 5.430 5.181 5.040 5.418 . 0 0 "[ . 1 . 2]" 1
1196 1 56 TYR QD 1 57 VAL H . . 4.230 3.452 3.368 3.572 . 0 0 "[ . 1 . 2]" 1
1197 1 56 TYR QD 1 58 HIS HB2 . . 5.500 5.047 4.944 5.222 . 0 0 "[ . 1 . 2]" 1
1198 1 56 TYR QD 1 68 GLU H . . 4.810 4.089 3.976 4.438 . 0 0 "[ . 1 . 2]" 1
1199 1 56 TYR QD 1 68 GLU HA . . 5.180 3.639 3.584 4.130 . 0 0 "[ . 1 . 2]" 1
1200 1 56 TYR QD 1 69 TRP H . . 4.660 3.576 3.503 3.907 . 0 0 "[ . 1 . 2]" 1
1201 1 56 TYR QD 1 69 TRP HA . . 3.840 2.402 2.362 2.548 . 0 0 "[ . 1 . 2]" 1
1202 1 56 TYR QD 1 69 TRP HD1 . . 3.870 3.505 3.384 3.595 . 0 0 "[ . 1 . 2]" 1
1203 1 56 TYR QD 1 69 TRP HE1 . . 4.350 3.751 3.468 3.843 . 0 0 "[ . 1 . 2]" 1
1204 1 56 TYR QE 1 67 ASP HA . . 5.500 5.210 4.758 5.394 . 0 0 "[ . 1 . 2]" 1
1205 1 56 TYR QE 1 67 ASP QB . . 4.220 3.483 2.671 4.242 0.022 11 0 "[ . 1 . 2]" 1
1206 1 56 TYR QE 1 68 GLU HA . . 3.840 2.042 1.991 2.824 . 0 0 "[ . 1 . 2]" 1
1207 1 56 TYR QE 1 68 GLU QB . . 4.890 3.809 3.616 4.545 . 0 0 "[ . 1 . 2]" 1
1208 1 56 TYR QE 1 69 TRP H . . 4.970 3.316 3.192 3.721 . 0 0 "[ . 1 . 2]" 1
1209 1 56 TYR QE 1 69 TRP HD1 . . 4.190 2.755 2.634 2.953 . 0 0 "[ . 1 . 2]" 1
1210 1 56 TYR QE 1 69 TRP HE1 . . 5.040 3.034 2.824 3.436 . 0 0 "[ . 1 . 2]" 1
1211 1 57 VAL H 1 57 VAL MG1 . . 3.830 2.978 2.935 3.063 . 0 0 "[ . 1 . 2]" 1
1212 1 57 VAL H 1 57 VAL MG2 . . 3.410 1.923 1.906 1.997 . 0 0 "[ . 1 . 2]" 1
1213 1 57 VAL H 1 58 HIS HA . . 5.480 5.026 4.929 5.095 . 0 0 "[ . 1 . 2]" 1
1214 1 57 VAL H 1 68 GLU H . . 3.690 3.102 3.029 3.415 . 0 0 "[ . 1 . 2]" 1
1215 1 57 VAL H 1 68 GLU HA . . 5.500 4.856 4.793 4.916 . 0 0 "[ . 1 . 2]" 1
1216 1 57 VAL H 1 69 TRP HA . . 3.880 3.301 3.088 3.390 . 0 0 "[ . 1 . 2]" 1
1217 1 57 VAL H 1 70 ILE MG . . 4.890 3.787 3.668 4.085 . 0 0 "[ . 1 . 2]" 1
1218 1 57 VAL HA 1 57 VAL HB . . 2.550 2.522 2.498 2.538 . 0 0 "[ . 1 . 2]" 1
1219 1 57 VAL HA 1 57 VAL MG1 . . 2.400 2.184 2.145 2.256 . 0 0 "[ . 1 . 2]" 1
1220 1 57 VAL HA 1 58 HIS H . . 2.610 2.317 2.281 2.339 . 0 0 "[ . 1 . 2]" 1
1221 1 57 VAL HA 1 70 ILE HG12 . . 5.090 4.821 4.750 4.968 . 0 0 "[ . 1 . 2]" 1
1222 1 57 VAL HB 1 58 HIS H . . 3.520 2.599 2.538 2.702 . 0 0 "[ . 1 . 2]" 1
1223 1 57 VAL HB 1 68 GLU QG . . 5.500 5.181 4.482 5.508 0.008 11 0 "[ . 1 . 2]" 1
1224 1 57 VAL MG1 1 58 HIS H . . 3.810 3.574 3.506 3.626 . 0 0 "[ . 1 . 2]" 1
1225 1 57 VAL MG1 1 70 ILE HB . . 4.640 4.435 4.347 4.587 . 0 0 "[ . 1 . 2]" 1
1226 1 57 VAL MG1 1 70 ILE MD . . 3.320 1.843 1.800 1.950 . 0 0 "[ . 1 . 2]" 1
1227 1 57 VAL MG1 1 70 ILE HG12 . . 4.080 2.124 1.999 2.313 . 0 0 "[ . 1 . 2]" 1
1228 1 57 VAL MG1 1 70 ILE HG13 . . 3.820 2.987 2.872 3.212 . 0 0 "[ . 1 . 2]" 1
1229 1 57 VAL MG1 1 70 ILE MG . . 3.750 3.385 3.322 3.548 . 0 0 "[ . 1 . 2]" 1
1230 1 57 VAL MG2 1 58 HIS H . . 4.250 3.725 3.636 3.781 . 0 0 "[ . 1 . 2]" 1
1231 1 57 VAL MG2 1 58 HIS HA . . 5.140 3.911 3.822 3.974 . 0 0 "[ . 1 . 2]" 1
1232 1 57 VAL MG2 1 59 TYR QD . . 5.060 4.538 4.299 4.708 . 0 0 "[ . 1 . 2]" 1
1233 1 57 VAL MG2 1 59 TYR QE . . 4.220 3.821 3.613 4.141 . 0 0 "[ . 1 . 2]" 1
1234 1 57 VAL MG2 1 67 ASP HA . . 5.180 3.750 3.604 4.121 . 0 0 "[ . 1 . 2]" 1
1235 1 57 VAL MG2 1 68 GLU H . . 3.710 2.975 2.887 3.062 . 0 0 "[ . 1 . 2]" 1
1236 1 57 VAL MG2 1 68 GLU QB . . 4.710 4.364 3.934 4.608 . 0 0 "[ . 1 . 2]" 1
1237 1 57 VAL MG2 1 68 GLU QG . . 4.330 2.768 2.214 3.050 . 0 0 "[ . 1 . 2]" 1
1238 1 57 VAL MG2 1 70 ILE H . . 5.170 3.029 2.780 3.635 . 0 0 "[ . 1 . 2]" 1
1239 1 57 VAL MG2 1 70 ILE MD . . 3.890 1.968 1.918 2.085 . 0 0 "[ . 1 . 2]" 1
1240 1 57 VAL MG2 1 70 ILE HG12 . . 4.870 1.927 1.903 2.114 . 0 0 "[ . 1 . 2]" 1
1241 1 57 VAL MG2 1 70 ILE HG13 . . 4.460 3.418 3.363 3.631 . 0 0 "[ . 1 . 2]" 1
1242 1 57 VAL MG2 1 70 ILE MG . . 2.400 1.921 1.852 2.118 . 0 0 "[ . 1 . 2]" 1
1243 1 58 HIS H 1 58 HIS HB2 . . 4.190 3.462 3.407 3.496 . 0 0 "[ . 1 . 2]" 1
1244 1 58 HIS H 1 58 HIS HB3 . . 3.820 2.640 2.540 2.679 . 0 0 "[ . 1 . 2]" 1
1245 1 58 HIS H 1 59 TYR H . . 4.360 4.179 4.018 4.299 . 0 0 "[ . 1 . 2]" 1
1246 1 58 HIS HA 1 58 HIS HB2 . . 2.710 2.334 2.322 2.344 . 0 0 "[ . 1 . 2]" 1
1247 1 58 HIS HA 1 59 TYR H . . 3.030 2.146 2.139 2.152 . 0 0 "[ . 1 . 2]" 1
1248 1 58 HIS HA 1 66 LEU H . . 5.500 5.529 5.452 5.571 0.071 11 0 "[ . 1 . 2]" 1
1249 1 58 HIS HA 1 67 ASP H . . 4.200 3.850 3.773 4.240 0.040 16 0 "[ . 1 . 2]" 1
1250 1 58 HIS HA 1 67 ASP HA . . 4.380 2.172 2.097 2.279 . 0 0 "[ . 1 . 2]" 1
1251 1 58 HIS HB2 1 59 TYR H . . 4.460 4.113 4.025 4.245 . 0 0 "[ . 1 . 2]" 1
1252 1 58 HIS HB3 1 58 HIS HD2 . . 3.860 2.720 2.705 2.731 . 0 0 "[ . 1 . 2]" 1
1253 1 58 HIS HD2 1 60 VAL HA . . 4.290 4.301 4.294 4.306 0.016 16 0 "[ . 1 . 2]" 1
1254 1 58 HIS HD2 1 60 VAL MG1 . . 5.500 5.089 4.899 5.242 . 0 0 "[ . 1 . 2]" 1
1255 1 58 HIS HD2 1 60 VAL QG . . 4.250 3.745 3.654 3.838 . 0 0 "[ . 1 . 2]" 1
1256 1 58 HIS HD2 1 60 VAL MG2 . . 5.500 3.857 3.734 3.991 . 0 0 "[ . 1 . 2]" 1
1257 1 59 TYR H 1 59 TYR QD . . 4.360 2.246 1.941 2.756 . 0 0 "[ . 1 . 2]" 1
1258 1 59 TYR H 1 59 TYR QE . . 5.110 4.168 3.972 4.552 . 0 0 "[ . 1 . 2]" 1
1259 1 59 TYR H 1 62 TYR QB . . 4.860 4.235 4.048 4.377 . 0 0 "[ . 1 . 2]" 1
1260 1 59 TYR HA 1 59 TYR QD . . 3.510 2.911 2.571 3.073 . 0 0 "[ . 1 . 2]" 1
1261 1 59 TYR HA 1 59 TYR QE . . 5.040 4.660 4.472 4.744 . 0 0 "[ . 1 . 2]" 1
1262 1 59 TYR HA 1 60 VAL QG . . 4.800 3.707 3.591 3.809 . 0 0 "[ . 1 . 2]" 1
1263 1 59 TYR QB 1 62 TYR HA . . 5.220 4.456 4.287 4.685 . 0 0 "[ . 1 . 2]" 1
1264 1 59 TYR QB 1 62 TYR QD . . 3.520 2.096 1.912 2.601 . 0 0 "[ . 1 . 2]" 1
1265 1 59 TYR QD 1 62 TYR H . . 5.500 4.712 4.506 4.881 . 0 0 "[ . 1 . 2]" 1
1266 1 59 TYR QD 1 66 LEU HB2 . . 4.000 3.433 2.934 3.737 . 0 0 "[ . 1 . 2]" 1
1267 1 59 TYR QD 1 66 LEU HB3 . . 4.000 2.004 1.994 2.078 . 0 0 "[ . 1 . 2]" 1
1268 1 59 TYR QD 1 66 LEU MD1 . . 5.190 3.541 2.223 4.779 . 0 0 "[ . 1 . 2]" 1
1269 1 59 TYR QD 1 66 LEU QD . . 3.790 3.109 2.217 3.584 . 0 0 "[ . 1 . 2]" 1
1270 1 59 TYR QD 1 66 LEU MD2 . . 5.190 4.249 2.376 4.765 . 0 0 "[ . 1 . 2]" 1
1271 1 59 TYR QD 1 67 ASP HA . . 5.390 3.229 2.886 3.816 . 0 0 "[ . 1 . 2]" 1
1272 1 59 TYR QE 1 66 LEU HA . . 5.500 4.927 4.598 5.308 . 0 0 "[ . 1 . 2]" 1
1273 1 59 TYR QE 1 66 LEU QB . . 4.040 3.600 3.024 4.037 . 0 0 "[ . 1 . 2]" 1
1274 1 59 TYR QE 1 66 LEU QD . . 3.990 3.481 2.258 3.891 . 0 0 "[ . 1 . 2]" 1
1275 1 59 TYR QE 1 67 ASP HA . . 5.500 3.893 3.271 4.753 . 0 0 "[ . 1 . 2]" 1
1276 1 59 TYR QE 1 68 GLU QB . . 5.500 4.526 3.185 5.452 . 0 0 "[ . 1 . 2]" 1
1277 1 59 TYR QE 1 68 GLU QG . . 3.710 2.907 2.536 3.715 0.005 11 0 "[ . 1 . 2]" 1
1278 1 59 TYR QE 1 70 ILE MD . . 5.500 5.448 5.300 5.505 0.005 13 0 "[ . 1 . 2]" 1
1279 1 59 TYR QE 1 70 ILE MG . . 4.980 4.445 4.221 4.699 . 0 0 "[ . 1 . 2]" 1
1280 1 60 VAL HA 1 60 VAL MG1 . . 2.550 2.294 2.202 2.385 . 0 0 "[ . 1 . 2]" 1
1281 1 60 VAL HA 1 60 VAL QG . . 2.200 2.064 2.035 2.117 . 0 0 "[ . 1 . 2]" 1
1282 1 60 VAL HA 1 60 VAL MG2 . . 2.550 2.346 2.274 2.441 . 0 0 "[ . 1 . 2]" 1
1283 1 60 VAL HA 1 62 TYR H . . 4.640 3.889 3.773 3.976 . 0 0 "[ . 1 . 2]" 1
1284 1 60 VAL HB 1 61 ASN H . . 5.130 2.777 2.432 2.935 . 0 0 "[ . 1 . 2]" 1
1285 1 60 VAL QG 1 61 ASN H . . 3.850 3.335 3.171 3.425 . 0 0 "[ . 1 . 2]" 1
1286 1 60 VAL QG 1 61 ASN QD . . 4.230 3.897 3.173 4.234 0.004 4 0 "[ . 1 . 2]" 1
1287 1 60 VAL QG 1 62 TYR H . . 5.440 4.384 4.269 4.454 . 0 0 "[ . 1 . 2]" 1
1288 1 61 ASN H 1 61 ASN QD . . 5.340 3.014 1.931 3.960 . 0 0 "[ . 1 . 2]" 1
1289 1 61 ASN H 1 62 TYR H . . 4.010 2.543 2.448 2.660 . 0 0 "[ . 1 . 2]" 1
1290 1 61 ASN H 1 62 TYR HA . . 5.500 5.203 5.127 5.293 . 0 0 "[ . 1 . 2]" 1
1291 1 62 TYR H 1 62 TYR QD . . 4.450 3.178 2.356 3.727 . 0 0 "[ . 1 . 2]" 1
1292 1 62 TYR H 1 62 TYR QE . . 5.500 4.999 4.560 5.512 0.012 11 0 "[ . 1 . 2]" 1
1293 1 62 TYR HA 1 62 TYR QD . . 4.000 2.540 2.045 3.143 . 0 0 "[ . 1 . 2]" 1
1294 1 62 TYR HA 1 63 ASN H . . 3.410 2.652 2.606 2.690 . 0 0 "[ . 1 . 2]" 1
1295 1 62 TYR HA 1 63 ASN QB . . 5.200 4.674 4.493 4.948 . 0 0 "[ . 1 . 2]" 1
1296 1 62 TYR HA 1 63 ASN QD . . 4.890 3.780 3.105 4.657 . 0 0 "[ . 1 . 2]" 1
1297 1 62 TYR HA 1 66 LEU QD . . 4.750 4.148 3.867 4.647 . 0 0 "[ . 1 . 2]" 1
1298 1 62 TYR QB 1 63 ASN H . . 3.540 1.935 1.925 2.015 . 0 0 "[ . 1 . 2]" 1
1299 1 62 TYR QB 1 63 ASN QD . . 4.550 3.944 3.460 4.553 0.003 11 0 "[ . 1 . 2]" 1
1300 1 62 TYR QB 1 66 LEU H . . 5.500 4.190 4.080 4.332 . 0 0 "[ . 1 . 2]" 1
1301 1 62 TYR QB 1 66 LEU MD1 . . 4.760 3.228 1.816 3.534 . 0 0 "[ . 1 . 2]" 1
1302 1 62 TYR QB 1 66 LEU QD . . 3.500 2.210 1.813 2.751 . 0 0 "[ . 1 . 2]" 1
1303 1 62 TYR QB 1 66 LEU MD2 . . 4.760 2.366 1.907 4.084 . 0 0 "[ . 1 . 2]" 1
1304 1 62 TYR QD 1 63 ASN H . . 4.940 3.540 2.968 3.860 . 0 0 "[ . 1 . 2]" 1
1305 1 62 TYR QD 1 66 LEU MD1 . . 4.960 3.597 2.397 3.920 . 0 0 "[ . 1 . 2]" 1
1306 1 62 TYR QD 1 66 LEU QD . . 3.610 2.864 2.198 3.369 . 0 0 "[ . 1 . 2]" 1
1307 1 62 TYR QD 1 66 LEU MD2 . . 4.960 3.177 2.221 4.045 . 0 0 "[ . 1 . 2]" 1
1308 1 62 TYR QE 1 66 LEU QD . . 5.440 3.749 3.206 4.176 . 0 0 "[ . 1 . 2]" 1
1309 1 63 ASN H 1 63 ASN QB . . 3.530 2.331 2.180 2.674 . 0 0 "[ . 1 . 2]" 1
1310 1 63 ASN H 1 66 LEU QD . . 4.590 2.808 2.233 3.610 . 0 0 "[ . 1 . 2]" 1
1311 1 63 ASN HA 1 63 ASN QB . . 2.510 2.415 2.262 2.489 . 0 0 "[ . 1 . 2]" 1
1312 1 63 ASN HA 1 63 ASN QD . . 4.250 3.215 2.026 3.863 . 0 0 "[ . 1 . 2]" 1
1313 1 63 ASN QB 1 66 LEU H . . 5.340 3.785 3.682 3.898 . 0 0 "[ . 1 . 2]" 1
1314 1 63 ASN QB 1 66 LEU QD . . 4.180 3.121 2.550 4.187 0.007 11 0 "[ . 1 . 2]" 1
1315 1 63 ASN HB2 1 65 ARG H . . 4.750 2.846 2.296 3.149 . 0 0 "[ . 1 . 2]" 1
1316 1 63 ASN HB2 1 65 ARG QG . . 4.100 2.130 1.896 2.416 . 0 0 "[ . 1 . 2]" 1
1317 1 63 ASN HB3 1 65 ARG H . . 4.750 2.509 2.224 3.072 . 0 0 "[ . 1 . 2]" 1
1318 1 63 ASN HB3 1 65 ARG QG . . 4.100 2.837 2.177 3.626 . 0 0 "[ . 1 . 2]" 1
1319 1 63 ASN QD 1 65 ARG QG . . 4.860 3.954 3.074 4.850 . 0 0 "[ . 1 . 2]" 1
1320 1 64 LYS H 1 64 LYS QB . . 3.680 2.404 2.224 2.627 . 0 0 "[ . 1 . 2]" 1
1321 1 64 LYS H 1 64 LYS HG2 . . 5.210 3.446 2.199 4.618 . 0 0 "[ . 1 . 2]" 1
1322 1 64 LYS H 1 64 LYS QG . . 4.440 2.890 2.073 4.054 . 0 0 "[ . 1 . 2]" 1
1323 1 64 LYS H 1 64 LYS HG3 . . 5.210 3.392 2.139 4.531 . 0 0 "[ . 1 . 2]" 1
1324 1 64 LYS H 1 65 ARG H . . 4.420 2.582 2.539 2.627 . 0 0 "[ . 1 . 2]" 1
1325 1 64 LYS HA 1 64 LYS QB . . 2.420 2.322 2.179 2.424 0.004 10 0 "[ . 1 . 2]" 1
1326 1 64 LYS HA 1 64 LYS QD . . 4.030 3.653 2.083 4.031 0.001 6 0 "[ . 1 . 2]" 1
1327 1 64 LYS QB 1 64 LYS QD . . 3.280 2.096 1.962 2.451 . 0 0 "[ . 1 . 2]" 1
1328 1 64 LYS QB 1 64 LYS QE . . 4.400 3.161 2.035 3.657 . 0 0 "[ . 1 . 2]" 1
1329 1 64 LYS HB2 1 64 LYS QD . . 3.920 2.665 2.103 3.262 . 0 0 "[ . 1 . 2]" 1
1330 1 64 LYS HB3 1 64 LYS QD . . 3.920 2.494 1.983 3.415 . 0 0 "[ . 1 . 2]" 1
1331 1 64 LYS QE 1 64 LYS HG2 . . 3.370 2.648 2.100 3.370 . 0 0 "[ . 1 . 2]" 1
1332 1 64 LYS QE 1 64 LYS QG . . 2.940 2.168 2.052 2.386 . 0 0 "[ . 1 . 2]" 1
1333 1 64 LYS QE 1 64 LYS HG3 . . 3.370 2.546 2.126 3.368 . 0 0 "[ . 1 . 2]" 1
1334 1 65 ARG H 1 65 ARG QG . . 2.400 2.118 1.960 2.258 . 0 0 "[ . 1 . 2]" 1
1335 1 65 ARG H 1 66 LEU H . . 3.710 2.536 2.519 2.644 . 0 0 "[ . 1 . 2]" 1
1336 1 65 ARG HA 1 65 ARG QB . . 2.420 2.180 2.177 2.181 . 0 0 "[ . 1 . 2]" 1
1337 1 65 ARG HA 1 65 ARG QD . . 4.730 4.303 3.852 4.518 . 0 0 "[ . 1 . 2]" 1
1338 1 65 ARG HA 1 65 ARG QG . . 3.500 3.346 3.332 3.403 . 0 0 "[ . 1 . 2]" 1
1339 1 65 ARG QB 1 65 ARG QD . . 3.210 2.207 2.045 2.409 . 0 0 "[ . 1 . 2]" 1
1340 1 65 ARG QB 1 67 ASP H . . 5.340 5.161 4.849 5.234 . 0 0 "[ . 1 . 2]" 1
1341 1 65 ARG QG 1 66 LEU H . . 3.070 2.919 2.601 3.080 0.010 16 0 "[ . 1 . 2]" 1
1342 1 65 ARG QG 1 66 LEU HA . . 4.130 3.773 3.606 4.048 . 0 0 "[ . 1 . 2]" 1
1343 1 65 ARG QG 1 66 LEU QD . . 3.760 2.334 1.940 3.377 . 0 0 "[ . 1 . 2]" 1
1344 1 66 LEU H 1 66 LEU QB . . 3.360 2.209 2.184 2.306 . 0 0 "[ . 1 . 2]" 1
1345 1 66 LEU H 1 66 LEU MD1 . . 4.350 4.007 3.205 4.317 . 0 0 "[ . 1 . 2]" 1
1346 1 66 LEU H 1 66 LEU QD . . 3.800 2.981 2.550 3.639 . 0 0 "[ . 1 . 2]" 1
1347 1 66 LEU H 1 66 LEU MD2 . . 4.350 3.278 2.575 4.392 0.042 19 0 "[ . 1 . 2]" 1
1348 1 66 LEU H 1 67 ASP H . . 2.400 2.121 2.069 2.255 . 0 0 "[ . 1 . 2]" 1
1349 1 66 LEU H 1 67 ASP QB . . 4.710 4.144 3.912 4.545 . 0 0 "[ . 1 . 2]" 1
1350 1 66 LEU HA 1 66 LEU QD . . 2.390 2.080 1.908 2.392 0.002 19 0 "[ . 1 . 2]" 1
1351 1 66 LEU HA 1 66 LEU HG . . 3.720 3.340 2.358 3.671 . 0 0 "[ . 1 . 2]" 1
1352 1 66 LEU QB 1 66 LEU HG . . 2.440 2.236 2.167 2.474 0.034 11 0 "[ . 1 . 2]" 1
1353 1 66 LEU QB 1 67 ASP H . . 3.570 3.013 2.936 3.352 . 0 0 "[ . 1 . 2]" 1
1354 1 66 LEU HB2 1 67 ASP H . . 4.130 3.331 3.134 3.736 . 0 0 "[ . 1 . 2]" 1
1355 1 66 LEU HB3 1 67 ASP H . . 4.130 3.489 3.110 3.899 . 0 0 "[ . 1 . 2]" 1
1356 1 67 ASP H 1 67 ASP QB . . 3.600 2.379 2.254 2.557 . 0 0 "[ . 1 . 2]" 1
1357 1 67 ASP HA 1 68 GLU H . . 2.690 2.356 2.147 2.405 . 0 0 "[ . 1 . 2]" 1
1358 1 67 ASP QB 1 68 GLU H . . 4.040 2.588 2.427 3.766 . 0 0 "[ . 1 . 2]" 1
1359 1 68 GLU H 1 68 GLU QB . . 3.520 3.324 3.172 3.388 . 0 0 "[ . 1 . 2]" 1
1360 1 68 GLU H 1 68 GLU QG . . 4.050 2.694 2.539 2.818 . 0 0 "[ . 1 . 2]" 1
1361 1 68 GLU HA 1 68 GLU QB . . 2.400 2.179 2.175 2.180 . 0 0 "[ . 1 . 2]" 1
1362 1 68 GLU HA 1 69 TRP H . . 2.690 2.610 2.400 2.725 0.035 11 0 "[ . 1 . 2]" 1
1363 1 68 GLU QB 1 69 TRP H . . 2.950 2.033 1.934 2.450 . 0 0 "[ . 1 . 2]" 1
1364 1 68 GLU QB 1 70 ILE MG . . 4.470 3.987 3.618 4.328 . 0 0 "[ . 1 . 2]" 1
1365 1 68 GLU QG 1 69 TRP H . . 4.690 3.214 2.669 3.413 . 0 0 "[ . 1 . 2]" 1
1366 1 68 GLU QG 1 70 ILE MG . . 4.090 2.374 2.004 2.657 . 0 0 "[ . 1 . 2]" 1
1367 1 69 TRP H 1 69 TRP QB . . 3.530 2.462 2.307 2.516 . 0 0 "[ . 1 . 2]" 1
1368 1 69 TRP H 1 69 TRP HD1 . . 3.760 2.609 2.393 3.229 . 0 0 "[ . 1 . 2]" 1
1369 1 69 TRP H 1 70 ILE H . . 4.670 4.326 4.209 4.548 . 0 0 "[ . 1 . 2]" 1
1370 1 69 TRP HA 1 69 TRP HD1 . . 4.500 4.085 4.039 4.171 . 0 0 "[ . 1 . 2]" 1
1371 1 69 TRP HA 1 69 TRP HE3 . . 3.780 3.327 3.016 3.460 . 0 0 "[ . 1 . 2]" 1
1372 1 69 TRP HA 1 70 ILE H . . 2.960 2.164 2.141 2.241 . 0 0 "[ . 1 . 2]" 1
1373 1 69 TRP HA 1 70 ILE MG . . 5.040 3.833 3.542 3.965 . 0 0 "[ . 1 . 2]" 1
1374 1 69 TRP QB 1 69 TRP HE1 . . 4.620 4.451 4.423 4.463 . 0 0 "[ . 1 . 2]" 1
1375 1 69 TRP QB 1 69 TRP HE3 . . 3.680 2.498 2.455 2.624 . 0 0 "[ . 1 . 2]" 1
1376 1 69 TRP QB 1 70 ILE H . . 4.200 3.384 2.812 3.617 . 0 0 "[ . 1 . 2]" 1
1377 1 69 TRP HE3 1 70 ILE H . . 4.730 4.389 3.557 4.722 . 0 0 "[ . 1 . 2]" 1
1378 1 70 ILE H 1 70 ILE MD . . 4.390 3.849 3.774 4.059 . 0 0 "[ . 1 . 2]" 1
1379 1 70 ILE H 1 70 ILE HG12 . . 4.100 2.268 2.137 2.635 . 0 0 "[ . 1 . 2]" 1
1380 1 70 ILE H 1 70 ILE HG13 . . 3.680 2.739 2.628 2.899 . 0 0 "[ . 1 . 2]" 1
1381 1 70 ILE H 1 70 ILE MG . . 4.260 2.744 2.576 3.046 . 0 0 "[ . 1 . 2]" 1
1382 1 70 ILE H 1 71 THR H . . 5.260 4.517 4.417 4.557 . 0 0 "[ . 1 . 2]" 1
1383 1 70 ILE H 1 74 ARG HB2 . . 5.500 5.454 5.377 5.526 0.026 11 0 "[ . 1 . 2]" 1
1384 1 70 ILE H 1 74 ARG HD2 . . 5.500 5.275 5.106 5.491 . 0 0 "[ . 1 . 2]" 1
1385 1 70 ILE HA 1 70 ILE HB . . 2.550 2.461 2.456 2.470 . 0 0 "[ . 1 . 2]" 1
1386 1 70 ILE HA 1 70 ILE MD . . 4.410 4.160 4.145 4.168 . 0 0 "[ . 1 . 2]" 1
1387 1 70 ILE HA 1 70 ILE MG . . 2.400 2.333 2.229 2.398 . 0 0 "[ . 1 . 2]" 1
1388 1 70 ILE HA 1 71 THR H . . 2.600 2.353 2.282 2.422 . 0 0 "[ . 1 . 2]" 1
1389 1 70 ILE HA 1 71 THR MG . . 4.840 4.111 3.997 4.396 . 0 0 "[ . 1 . 2]" 1
1390 1 70 ILE HA 1 74 ARG HD2 . . 4.770 2.481 2.296 2.625 . 0 0 "[ . 1 . 2]" 1
1391 1 70 ILE HB 1 70 ILE MD . . 2.400 2.299 2.201 2.361 . 0 0 "[ . 1 . 2]" 1
1392 1 70 ILE HB 1 71 THR H . . 2.900 2.501 2.335 2.687 . 0 0 "[ . 1 . 2]" 1
1393 1 70 ILE HB 1 71 THR HA . . 5.460 4.611 4.554 4.668 . 0 0 "[ . 1 . 2]" 1
1394 1 70 ILE HB 1 74 ARG HB2 . . 2.710 2.003 1.981 2.054 . 0 0 "[ . 1 . 2]" 1
1395 1 70 ILE HB 1 74 ARG HB3 . . 4.050 2.366 2.262 2.452 . 0 0 "[ . 1 . 2]" 1
1396 1 70 ILE HB 1 74 ARG HD2 . . 4.010 2.830 2.610 3.084 . 0 0 "[ . 1 . 2]" 1
1397 1 70 ILE HB 1 74 ARG HD3 . . 3.840 3.582 3.280 3.829 . 0 0 "[ . 1 . 2]" 1
1398 1 70 ILE MD 1 70 ILE MG . . 3.100 2.139 1.967 2.328 . 0 0 "[ . 1 . 2]" 1
1399 1 70 ILE MD 1 74 ARG HA . . 5.310 4.645 4.528 4.741 . 0 0 "[ . 1 . 2]" 1
1400 1 70 ILE MD 1 74 ARG HB2 . . 4.420 3.141 2.930 3.373 . 0 0 "[ . 1 . 2]" 1
1401 1 70 ILE MD 1 74 ARG HB3 . . 4.210 3.209 3.081 3.302 . 0 0 "[ . 1 . 2]" 1
1402 1 70 ILE MD 1 74 ARG HD2 . . 4.970 4.606 4.391 4.853 . 0 0 "[ . 1 . 2]" 1
1403 1 70 ILE MD 1 74 ARG HD3 . . 5.210 4.820 4.605 5.068 . 0 0 "[ . 1 . 2]" 1
1404 1 70 ILE MD 1 74 ARG HG2 . . 5.500 5.371 5.216 5.504 0.004 16 0 "[ . 1 . 2]" 1
1405 1 70 ILE MD 1 74 ARG HG3 . . 5.320 5.130 4.929 5.322 0.002 16 0 "[ . 1 . 2]" 1
1406 1 70 ILE HG12 1 71 THR H . . 5.500 4.851 4.727 4.964 . 0 0 "[ . 1 . 2]" 1
1407 1 70 ILE HG13 1 70 ILE MG . . 3.670 3.184 3.169 3.194 . 0 0 "[ . 1 . 2]" 1
1408 1 70 ILE MG 1 71 THR H . . 3.790 3.681 3.628 3.754 . 0 0 "[ . 1 . 2]" 1
1409 1 70 ILE MG 1 74 ARG H . . 5.500 5.497 5.475 5.510 0.010 5 0 "[ . 1 . 2]" 1
1410 1 70 ILE MG 1 74 ARG HB2 . . 5.500 3.489 3.457 3.520 . 0 0 "[ . 1 . 2]" 1
1411 1 70 ILE MG 1 74 ARG HB3 . . 4.720 2.938 2.788 3.003 . 0 0 "[ . 1 . 2]" 1
1412 1 70 ILE MG 1 74 ARG HD2 . . 4.790 2.674 2.448 2.909 . 0 0 "[ . 1 . 2]" 1
1413 1 70 ILE MG 1 74 ARG HD3 . . 4.940 2.960 2.569 3.308 . 0 0 "[ . 1 . 2]" 1
1414 1 70 ILE MG 1 74 ARG HE . . 4.960 4.697 4.230 4.963 0.003 8 0 "[ . 1 . 2]" 1
1415 1 70 ILE MG 1 74 ARG HG2 . . 5.500 4.672 4.590 4.742 . 0 0 "[ . 1 . 2]" 1
1416 1 70 ILE MG 1 74 ARG HG3 . . 5.010 4.500 4.411 4.561 . 0 0 "[ . 1 . 2]" 1
1417 1 71 THR H 1 71 THR MG . . 4.540 3.188 3.088 3.329 . 0 0 "[ . 1 . 2]" 1
1418 1 71 THR H 1 74 ARG H . . 4.520 3.514 3.426 3.586 . 0 0 "[ . 1 . 2]" 1
1419 1 71 THR H 1 74 ARG HD2 . . 4.070 2.549 2.436 2.622 . 0 0 "[ . 1 . 2]" 1
1420 1 71 THR H 1 75 ILE HG13 . . 4.890 4.628 4.493 4.780 . 0 0 "[ . 1 . 2]" 1
1421 1 71 THR HA 1 71 THR HB . . 2.990 2.665 2.634 2.721 . 0 0 "[ . 1 . 2]" 1
1422 1 71 THR HA 1 71 THR MG . . 2.400 2.187 1.968 2.241 . 0 0 "[ . 1 . 2]" 1
1423 1 71 THR HA 1 72 THR H . . 3.070 2.532 2.518 2.556 . 0 0 "[ . 1 . 2]" 1
1424 1 71 THR HA 1 74 ARG HG3 . . 5.500 4.930 4.878 4.969 . 0 0 "[ . 1 . 2]" 1
1425 1 71 THR HB 1 72 THR H . . 3.500 2.156 2.093 2.221 . 0 0 "[ . 1 . 2]" 1
1426 1 71 THR HB 1 72 THR MG . . 5.040 3.736 3.609 3.974 . 0 0 "[ . 1 . 2]" 1
1427 1 71 THR HB 1 73 ASP H . . 4.040 2.649 2.561 2.731 . 0 0 "[ . 1 . 2]" 1
1428 1 71 THR MG 1 72 THR MG . . 3.910 3.873 3.805 3.912 0.002 16 0 "[ . 1 . 2]" 1
1429 1 72 THR H 1 72 THR HB . . 3.740 3.610 3.604 3.616 . 0 0 "[ . 1 . 2]" 1
1430 1 72 THR H 1 72 THR MG . . 3.880 1.993 1.918 2.123 . 0 0 "[ . 1 . 2]" 1
1431 1 72 THR H 1 73 ASP H . . 3.640 2.798 2.767 2.824 . 0 0 "[ . 1 . 2]" 1
1432 1 72 THR H 1 74 ARG H . . 4.780 3.940 3.912 3.963 . 0 0 "[ . 1 . 2]" 1
1433 1 72 THR H 1 74 ARG HG3 . . 5.500 5.499 5.459 5.510 0.010 11 0 "[ . 1 . 2]" 1
1434 1 72 THR H 1 75 ILE MD . . 5.400 3.698 3.494 3.911 . 0 0 "[ . 1 . 2]" 1
1435 1 72 THR HA 1 72 THR HB . . 2.640 2.417 2.393 2.459 . 0 0 "[ . 1 . 2]" 1
1436 1 72 THR HA 1 72 THR MG . . 2.560 2.381 2.309 2.421 . 0 0 "[ . 1 . 2]" 1
1437 1 72 THR HA 1 74 ARG H . . 5.180 3.705 3.674 3.732 . 0 0 "[ . 1 . 2]" 1
1438 1 72 THR HA 1 75 ILE H . . 4.810 3.663 3.447 3.855 . 0 0 "[ . 1 . 2]" 1
1439 1 72 THR HA 1 75 ILE HB . . 4.760 3.052 2.937 3.131 . 0 0 "[ . 1 . 2]" 1
1440 1 72 THR HA 1 75 ILE MD . . 3.280 1.925 1.900 1.963 . 0 0 "[ . 1 . 2]" 1
1441 1 72 THR HA 1 75 ILE HG12 . . 4.600 4.267 4.159 4.314 . 0 0 "[ . 1 . 2]" 1
1442 1 72 THR HA 1 75 ILE HG13 . . 4.140 3.092 2.887 3.186 . 0 0 "[ . 1 . 2]" 1
1443 1 72 THR HB 1 75 ILE MD . . 4.960 3.606 3.494 3.694 . 0 0 "[ . 1 . 2]" 1
1444 1 72 THR HB 1 75 ILE HG13 . . 5.450 5.367 5.130 5.457 0.007 16 0 "[ . 1 . 2]" 1
1445 1 72 THR MG 1 73 ASP H . . 3.910 3.746 3.674 3.847 . 0 0 "[ . 1 . 2]" 1
1446 1 72 THR MG 1 75 ILE MD . . 4.240 2.960 2.840 3.077 . 0 0 "[ . 1 . 2]" 1
1447 1 72 THR MG 1 75 ILE HG13 . . 5.500 4.829 4.689 4.925 . 0 0 "[ . 1 . 2]" 1
1448 1 73 ASP H 1 73 ASP QB . . 2.850 2.345 2.195 2.660 . 0 0 "[ . 1 . 2]" 1
1449 1 73 ASP H 1 74 ARG H . . 3.640 2.607 2.593 2.629 . 0 0 "[ . 1 . 2]" 1
1450 1 73 ASP H 1 74 ARG HG2 . . 5.500 5.455 5.407 5.502 0.002 15 0 "[ . 1 . 2]" 1
1451 1 73 ASP H 1 74 ARG HG3 . . 5.060 4.465 4.442 4.499 . 0 0 "[ . 1 . 2]" 1
1452 1 73 ASP H 1 75 ILE HB . . 5.500 5.459 5.427 5.508 0.008 11 0 "[ . 1 . 2]" 1
1453 1 73 ASP HA 1 73 ASP QB . . 2.460 2.403 2.278 2.459 . 0 0 "[ . 1 . 2]" 1
1454 1 73 ASP QB 1 74 ARG H . . 4.390 3.143 3.096 3.180 . 0 0 "[ . 1 . 2]" 1
1455 1 74 ARG H 1 74 ARG HB3 . . 3.920 3.639 3.630 3.649 . 0 0 "[ . 1 . 2]" 1
1456 1 74 ARG H 1 74 ARG HD2 . . 5.030 4.788 4.730 4.848 . 0 0 "[ . 1 . 2]" 1
1457 1 74 ARG H 1 74 ARG HG2 . . 3.740 3.601 3.567 3.651 . 0 0 "[ . 1 . 2]" 1
1458 1 74 ARG H 1 74 ARG HG3 . . 3.140 2.952 2.881 3.005 . 0 0 "[ . 1 . 2]" 1
1459 1 74 ARG H 1 75 ILE HG12 . . 5.500 5.166 5.056 5.249 . 0 0 "[ . 1 . 2]" 1
1460 1 74 ARG H 1 75 ILE HG13 . . 4.240 3.434 3.349 3.511 . 0 0 "[ . 1 . 2]" 1
1461 1 74 ARG HA 1 74 ARG HB3 . . 2.890 2.524 2.507 2.538 . 0 0 "[ . 1 . 2]" 1
1462 1 74 ARG HA 1 74 ARG HD2 . . 4.670 4.572 4.480 4.670 . 0 0 "[ . 1 . 2]" 1
1463 1 74 ARG HA 1 74 ARG HD3 . . 4.270 3.922 3.872 3.977 . 0 0 "[ . 1 . 2]" 1
1464 1 74 ARG HA 1 74 ARG HG2 . . 2.710 2.329 2.305 2.360 . 0 0 "[ . 1 . 2]" 1
1465 1 74 ARG HA 1 74 ARG HG3 . . 4.090 3.313 3.280 3.333 . 0 0 "[ . 1 . 2]" 1
1466 1 74 ARG HA 1 75 ILE HG13 . . 5.500 4.806 4.713 4.916 . 0 0 "[ . 1 . 2]" 1
1467 1 74 ARG HB2 1 74 ARG HD2 . . 3.350 2.783 2.672 2.912 . 0 0 "[ . 1 . 2]" 1
1468 1 74 ARG HB2 1 74 ARG HD3 . . 3.520 3.343 3.161 3.489 . 0 0 "[ . 1 . 2]" 1
1469 1 74 ARG HB2 1 74 ARG HG3 . . 2.570 2.293 2.282 2.305 . 0 0 "[ . 1 . 2]" 1
1470 1 74 ARG HB2 1 75 ILE H . . 4.070 3.721 3.551 3.893 . 0 0 "[ . 1 . 2]" 1
1471 1 74 ARG HB2 1 75 ILE HA . . 4.940 4.764 4.691 4.822 . 0 0 "[ . 1 . 2]" 1
1472 1 74 ARG HB2 1 75 ILE HG13 . . 4.940 3.489 3.444 3.585 . 0 0 "[ . 1 . 2]" 1
1473 1 74 ARG HB3 1 74 ARG HD2 . . 4.180 2.741 2.560 2.956 . 0 0 "[ . 1 . 2]" 1
1474 1 74 ARG HB3 1 74 ARG HE . . 4.780 4.463 4.213 4.629 . 0 0 "[ . 1 . 2]" 1
1475 1 74 ARG HB3 1 75 ILE H . . 4.780 4.289 4.203 4.378 . 0 0 "[ . 1 . 2]" 1
1476 1 75 ILE H 1 75 ILE HB . . 2.920 2.566 2.518 2.613 . 0 0 "[ . 1 . 2]" 1
1477 1 75 ILE H 1 75 ILE MD . . 3.880 3.677 3.541 3.849 . 0 0 "[ . 1 . 2]" 1
1478 1 75 ILE H 1 75 ILE HG12 . . 4.150 4.012 3.865 4.116 . 0 0 "[ . 1 . 2]" 1
1479 1 75 ILE H 1 75 ILE HG13 . . 3.090 2.683 2.544 2.809 . 0 0 "[ . 1 . 2]" 1
1480 1 75 ILE H 1 76 ASN H . . 4.610 4.506 4.455 4.543 . 0 0 "[ . 1 . 2]" 1
1481 1 75 ILE HA 1 75 ILE MD . . 4.260 3.878 3.860 3.885 . 0 0 "[ . 1 . 2]" 1
1482 1 75 ILE HA 1 75 ILE HG12 . . 3.920 2.695 2.610 2.736 . 0 0 "[ . 1 . 2]" 1
1483 1 75 ILE HA 1 75 ILE HG13 . . 4.140 2.813 2.768 2.901 . 0 0 "[ . 1 . 2]" 1
1484 1 75 ILE HA 1 75 ILE MG . . 2.400 2.356 2.302 2.401 0.001 16 0 "[ . 1 . 2]" 1
1485 1 75 ILE HA 1 76 ASN H . . 2.500 2.222 2.197 2.238 . 0 0 "[ . 1 . 2]" 1
1486 1 75 ILE HB 1 75 ILE MD . . 2.540 2.190 2.154 2.260 . 0 0 "[ . 1 . 2]" 1
1487 1 75 ILE MD 1 75 ILE MG . . 2.400 2.262 2.122 2.336 . 0 0 "[ . 1 . 2]" 1
1488 1 75 ILE MD 1 77 LEU HG . . 5.500 4.999 4.544 5.510 0.010 20 0 "[ . 1 . 2]" 1
1489 1 75 ILE HG12 1 76 ASN H . . 4.470 4.267 4.225 4.311 . 0 0 "[ . 1 . 2]" 1
1490 1 75 ILE MG 1 76 ASN H . . 3.010 2.169 1.980 2.275 . 0 0 "[ . 1 . 2]" 1
1491 1 75 ILE MG 1 76 ASN HA . . 4.460 3.764 3.695 3.838 . 0 0 "[ . 1 . 2]" 1
1492 1 75 ILE MG 1 77 LEU H . . 4.410 3.754 3.667 3.854 . 0 0 "[ . 1 . 2]" 1
1493 1 75 ILE MG 1 77 LEU HG . . 4.860 3.301 2.375 4.391 . 0 0 "[ . 1 . 2]" 1
1494 1 76 ASN H 1 76 ASN HB2 . . 3.930 2.587 2.467 2.814 . 0 0 "[ . 1 . 2]" 1
1495 1 76 ASN H 1 76 ASN QB . . 3.250 2.393 2.342 2.503 . 0 0 "[ . 1 . 2]" 1
1496 1 76 ASN H 1 76 ASN HB3 . . 3.930 2.975 2.548 3.683 . 0 0 "[ . 1 . 2]" 1
1497 1 76 ASN H 1 77 LEU H . . 4.710 4.223 4.189 4.249 . 0 0 "[ . 1 . 2]" 1
1498 1 76 ASN HA 1 77 LEU H . . 2.440 2.166 2.159 2.176 . 0 0 "[ . 1 . 2]" 1
1499 1 76 ASN HA 1 78 ASP H . . 4.430 3.414 3.313 3.470 . 0 0 "[ . 1 . 2]" 1
1500 1 76 ASN QB 1 77 LEU H . . 4.120 3.827 3.540 3.941 . 0 0 "[ . 1 . 2]" 1
1501 1 76 ASN QB 1 78 ASP H . . 5.340 3.338 2.788 3.656 . 0 0 "[ . 1 . 2]" 1
1502 1 76 ASN QB 1 79 LYS H . . 4.400 3.574 3.130 3.871 . 0 0 "[ . 1 . 2]" 1
1503 1 76 ASN QB 1 79 LYS HB2 . . 5.180 3.419 3.003 3.635 . 0 0 "[ . 1 . 2]" 1
1504 1 76 ASN QB 1 79 LYS QD . . 4.670 3.232 2.627 3.861 . 0 0 "[ . 1 . 2]" 1
1505 1 76 ASN HB2 1 77 LEU H . . 4.680 4.513 4.390 4.595 . 0 0 "[ . 1 . 2]" 1
1506 1 76 ASN HB3 1 77 LEU H . . 4.680 4.147 3.726 4.380 . 0 0 "[ . 1 . 2]" 1
1507 1 76 ASN QD 1 78 ASP QB . . 4.440 3.256 2.141 4.443 0.003 20 0 "[ . 1 . 2]" 1
1508 1 76 ASN QD 1 79 LYS QD . . 3.380 2.637 1.803 3.235 . 0 0 "[ . 1 . 2]" 1
1509 1 76 ASN QD 1 79 LYS QE . . 3.780 3.232 2.463 3.786 0.006 17 0 "[ . 1 . 2]" 1
1510 1 77 LEU H 1 77 LEU QB . . 3.440 2.271 2.202 2.382 . 0 0 "[ . 1 . 2]" 1
1511 1 77 LEU H 1 77 LEU QD . . 4.750 2.918 2.264 3.485 . 0 0 "[ . 1 . 2]" 1
1512 1 77 LEU H 1 78 ASP QB . . 4.900 4.039 3.924 4.184 . 0 0 "[ . 1 . 2]" 1
1513 1 77 LEU H 1 79 LYS H . . 4.680 4.590 4.462 4.666 . 0 0 "[ . 1 . 2]" 1
1514 1 77 LEU HA 1 77 LEU QB . . 2.590 2.439 2.381 2.478 . 0 0 "[ . 1 . 2]" 1
1515 1 77 LEU HA 1 77 LEU QD . . 2.380 2.098 1.956 2.293 . 0 0 "[ . 1 . 2]" 1
1516 1 77 LEU HA 1 77 LEU HG . . 3.920 3.234 2.698 3.703 . 0 0 "[ . 1 . 2]" 1
1517 1 77 LEU QB 1 77 LEU QD . . 2.830 1.942 1.863 2.027 . 0 0 "[ . 1 . 2]" 1
1518 1 77 LEU QB 1 78 ASP H . . 4.130 3.671 3.601 3.710 . 0 0 "[ . 1 . 2]" 1
1519 1 77 LEU QD 1 78 ASP H . . 4.920 4.244 3.949 4.531 . 0 0 "[ . 1 . 2]" 1
1520 1 77 LEU QD 1 81 VAL MG2 . . 3.500 3.276 3.116 3.499 . 0 0 "[ . 1 . 2]" 1
1521 1 78 ASP H 1 78 ASP HB2 . . 3.510 2.514 2.245 2.927 . 0 0 "[ . 1 . 2]" 1
1522 1 78 ASP H 1 78 ASP QB . . 2.870 2.319 2.216 2.386 . 0 0 "[ . 1 . 2]" 1
1523 1 78 ASP H 1 78 ASP HB3 . . 3.510 3.006 2.459 3.511 0.001 20 0 "[ . 1 . 2]" 1
1524 1 78 ASP H 1 79 LYS H . . 2.510 2.107 2.102 2.112 . 0 0 "[ . 1 . 2]" 1
1525 1 78 ASP H 1 79 LYS QD . . 4.800 4.109 3.536 4.807 0.007 12 0 "[ . 1 . 2]" 1
1526 1 78 ASP HA 1 78 ASP QB . . 2.530 2.454 2.329 2.526 . 0 0 "[ . 1 . 2]" 1
1527 1 78 ASP QB 1 79 LYS H . . 3.960 2.992 2.934 3.067 . 0 0 "[ . 1 . 2]" 1
1528 1 79 LYS H 1 79 LYS HB2 . . 3.640 2.267 2.238 2.302 . 0 0 "[ . 1 . 2]" 1
1529 1 79 LYS H 1 79 LYS HB3 . . 3.760 3.483 3.286 3.556 . 0 0 "[ . 1 . 2]" 1
1530 1 79 LYS H 1 79 LYS QD . . 3.700 3.138 2.615 3.686 . 0 0 "[ . 1 . 2]" 1
1531 1 79 LYS H 1 80 GLU H . . 4.770 4.546 4.536 4.559 . 0 0 "[ . 1 . 2]" 1
1532 1 79 LYS HA 1 79 LYS HB3 . . 2.880 2.692 2.631 2.825 . 0 0 "[ . 1 . 2]" 1
1533 1 79 LYS HA 1 79 LYS HD2 . . 4.920 3.609 2.965 4.150 . 0 0 "[ . 1 . 2]" 1
1534 1 79 LYS HA 1 79 LYS QD . . 4.110 3.401 2.880 3.873 . 0 0 "[ . 1 . 2]" 1
1535 1 79 LYS HA 1 79 LYS HD3 . . 4.920 4.190 3.621 4.638 . 0 0 "[ . 1 . 2]" 1
1536 1 79 LYS HA 1 79 LYS HG2 . . 4.000 3.279 2.923 3.550 . 0 0 "[ . 1 . 2]" 1
1537 1 79 LYS HA 1 79 LYS HG3 . . 2.510 2.158 2.029 2.253 . 0 0 "[ . 1 . 2]" 1
1538 1 79 LYS HA 1 80 GLU H . . 2.400 2.244 2.221 2.302 . 0 0 "[ . 1 . 2]" 1
1539 1 79 LYS HA 1 80 GLU QG . . 4.670 3.701 3.584 4.140 . 0 0 "[ . 1 . 2]" 1
1540 1 79 LYS HB2 1 79 LYS QD . . 2.920 2.093 2.033 2.204 . 0 0 "[ . 1 . 2]" 1
1541 1 79 LYS HB2 1 79 LYS QE . . 4.130 3.767 3.008 3.999 . 0 0 "[ . 1 . 2]" 1
1542 1 79 LYS HB3 1 79 LYS QD . . 3.660 3.070 2.803 3.267 . 0 0 "[ . 1 . 2]" 1
1543 1 79 LYS HB3 1 80 GLU H . . 3.000 2.992 2.826 3.008 0.008 7 0 "[ . 1 . 2]" 1
1544 1 79 LYS QD 1 79 LYS QE . . 2.350 2.027 1.987 2.067 . 0 0 "[ . 1 . 2]" 1
1545 1 79 LYS QE 1 79 LYS HG2 . . 3.550 2.310 2.033 3.225 . 0 0 "[ . 1 . 2]" 1
1546 1 79 LYS HE2 1 79 LYS HG2 . . 4.150 3.231 2.171 3.793 . 0 0 "[ . 1 . 2]" 1
1547 1 79 LYS HE3 1 79 LYS HG2 . . 4.150 2.601 2.051 3.835 . 0 0 "[ . 1 . 2]" 1
1548 1 79 LYS HG3 1 80 GLU H . . 3.910 3.718 3.245 3.915 0.005 14 0 "[ . 1 . 2]" 1
1549 1 80 GLU H 1 80 GLU QG . . 2.740 2.033 1.923 2.510 . 0 0 "[ . 1 . 2]" 1
1550 1 80 GLU HA 1 80 GLU HB3 . . 2.570 2.418 2.395 2.453 . 0 0 "[ . 1 . 2]" 1
1551 1 80 GLU HA 1 80 GLU QG . . 2.610 2.482 2.384 2.535 . 0 0 "[ . 1 . 2]" 1
1552 1 80 GLU HA 1 81 VAL H . . 2.570 2.272 2.222 2.364 . 0 0 "[ . 1 . 2]" 1
1553 1 80 GLU HA 1 81 VAL MG2 . . 4.610 3.558 3.385 3.735 . 0 0 "[ . 1 . 2]" 1
1554 1 80 GLU HB2 1 82 LEU QD . . 5.140 3.952 3.719 4.193 . 0 0 "[ . 1 . 2]" 1
1555 1 80 GLU HB3 1 80 GLU QG . . 2.750 2.373 2.135 2.483 . 0 0 "[ . 1 . 2]" 1
1556 1 80 GLU HB3 1 81 VAL H . . 3.450 2.791 2.541 2.942 . 0 0 "[ . 1 . 2]" 1
1557 1 80 GLU HB3 1 82 LEU QD . . 4.830 4.221 3.917 4.380 . 0 0 "[ . 1 . 2]" 1
1558 1 80 GLU QG 1 82 LEU QD . . 5.360 5.254 4.991 5.366 0.006 11 0 "[ . 1 . 2]" 1
1559 1 81 VAL H 1 81 VAL HB . . 3.430 2.545 2.479 2.649 . 0 0 "[ . 1 . 2]" 1
1560 1 81 VAL H 1 81 VAL MG1 . . 4.040 3.806 3.778 3.836 . 0 0 "[ . 1 . 2]" 1
1561 1 81 VAL H 1 81 VAL MG2 . . 3.620 2.617 2.352 2.788 . 0 0 "[ . 1 . 2]" 1
1562 1 81 VAL H 1 83 TYR QE . . 5.030 4.767 4.481 4.998 . 0 0 "[ . 1 . 2]" 1
1563 1 81 VAL HA 1 81 VAL MG1 . . 3.330 2.370 2.284 2.410 . 0 0 "[ . 1 . 2]" 1
1564 1 81 VAL HA 1 81 VAL MG2 . . 2.400 2.300 2.244 2.415 0.015 7 0 "[ . 1 . 2]" 1
1565 1 81 VAL HA 1 82 LEU H . . 2.600 2.223 2.197 2.288 . 0 0 "[ . 1 . 2]" 1
1566 1 81 VAL HA 1 82 LEU QD . . 4.890 3.879 3.492 4.351 . 0 0 "[ . 1 . 2]" 1
1567 1 81 VAL HB 1 82 LEU H . . 5.250 3.962 3.688 4.049 . 0 0 "[ . 1 . 2]" 1
1568 1 81 VAL HB 1 82 LEU QD . . 5.440 5.226 4.938 5.454 0.014 19 0 "[ . 1 . 2]" 1
1569 1 81 VAL HB 1 83 TYR QE . . 3.270 2.555 2.265 2.765 . 0 0 "[ . 1 . 2]" 1
1570 1 81 VAL MG1 1 82 LEU H . . 3.450 2.247 2.058 2.364 . 0 0 "[ . 1 . 2]" 1
1571 1 81 VAL MG1 1 83 TYR HA . . 5.280 4.081 3.944 4.263 . 0 0 "[ . 1 . 2]" 1
1572 1 81 VAL MG1 1 83 TYR QD . . 4.360 3.055 2.824 3.456 . 0 0 "[ . 1 . 2]" 1
1573 1 81 VAL MG1 1 83 TYR QE . . 3.510 2.610 2.370 3.078 . 0 0 "[ . 1 . 2]" 1
1574 1 81 VAL MG2 1 82 LEU H . . 3.930 3.877 3.838 3.956 0.026 11 0 "[ . 1 . 2]" 1
1575 1 81 VAL MG2 1 83 TYR QE . . 4.420 3.692 3.506 3.884 . 0 0 "[ . 1 . 2]" 1
1576 1 82 LEU H 1 82 LEU HB3 . . 3.890 3.397 3.281 3.634 . 0 0 "[ . 1 . 2]" 1
1577 1 82 LEU H 1 83 TYR H . . 4.680 4.454 4.423 4.484 . 0 0 "[ . 1 . 2]" 1
1578 1 82 LEU HA 1 82 LEU MD1 . . 3.870 2.704 2.080 3.822 . 0 0 "[ . 1 . 2]" 1
1579 1 82 LEU HA 1 82 LEU QD . . 3.230 2.142 1.948 2.589 . 0 0 "[ . 1 . 2]" 1
1580 1 82 LEU HA 1 82 LEU MD2 . . 3.870 2.586 2.049 3.739 . 0 0 "[ . 1 . 2]" 1
1581 1 82 LEU HA 1 82 LEU HG . . 4.180 3.179 2.332 3.650 . 0 0 "[ . 1 . 2]" 1
1582 1 82 LEU HA 1 83 TYR H . . 2.490 2.157 2.143 2.178 . 0 0 "[ . 1 . 2]" 1
1583 1 82 LEU HB2 1 82 LEU MD1 . . 3.620 2.704 2.099 3.193 . 0 0 "[ . 1 . 2]" 1
1584 1 82 LEU HB2 1 82 LEU MD2 . . 3.620 2.582 2.269 3.192 . 0 0 "[ . 1 . 2]" 1
1585 1 82 LEU HB3 1 82 LEU QD . . 3.030 2.171 2.085 2.276 . 0 0 "[ . 1 . 2]" 1
1586 1 82 LEU HB3 1 83 TYR H . . 4.000 3.427 3.237 3.597 . 0 0 "[ . 1 . 2]" 1
1587 1 82 LEU QD 1 83 TYR H . . 4.650 3.083 2.353 3.878 . 0 0 "[ . 1 . 2]" 1
1588 1 82 LEU HG 1 83 TYR H . . 5.190 4.591 3.217 5.133 . 0 0 "[ . 1 . 2]" 1
1589 1 83 TYR H 1 83 TYR HB2 . . 3.130 2.490 2.369 2.636 . 0 0 "[ . 1 . 2]" 1
1590 1 83 TYR H 1 83 TYR QD . . 3.520 3.189 2.911 3.489 . 0 0 "[ . 1 . 2]" 1
1591 1 83 TYR H 1 83 TYR QE . . 5.400 5.248 5.063 5.342 . 0 0 "[ . 1 . 2]" 1
1592 1 83 TYR H 1 84 PRO QD . . 5.340 4.363 4.349 4.369 . 0 0 "[ . 1 . 2]" 1
1593 1 83 TYR HA 1 83 TYR QD . . 4.160 2.853 2.507 3.019 . 0 0 "[ . 1 . 2]" 1
1594 1 83 TYR HA 1 84 PRO HD2 . . 3.160 2.468 2.436 2.497 . 0 0 "[ . 1 . 2]" 1
1595 1 83 TYR HA 1 84 PRO QD . . 2.600 2.129 2.110 2.147 . 0 0 "[ . 1 . 2]" 1
1596 1 83 TYR HA 1 84 PRO HD3 . . 3.160 2.327 2.312 2.340 . 0 0 "[ . 1 . 2]" 1
1597 1 83 TYR HA 1 84 PRO QG . . 4.360 4.045 4.024 4.064 . 0 0 "[ . 1 . 2]" 1
1598 1 83 TYR HB2 1 84 PRO QD . . 4.230 3.478 3.470 3.484 . 0 0 "[ . 1 . 2]" 1
1599 1 83 TYR HB3 1 84 PRO HD2 . . 4.330 1.972 1.957 1.988 . 0 0 "[ . 1 . 2]" 1
1600 1 83 TYR HB3 1 84 PRO QD . . 3.610 1.961 1.946 1.976 . 0 0 "[ . 1 . 2]" 1
1601 1 83 TYR HB3 1 84 PRO HD3 . . 4.330 3.427 3.415 3.438 . 0 0 "[ . 1 . 2]" 1
1602 1 83 TYR HB3 1 84 PRO QG . . 5.290 3.546 3.522 3.574 . 0 0 "[ . 1 . 2]" 1
1603 1 83 TYR QD 1 84 PRO HD2 . . 4.800 2.162 1.978 2.407 . 0 0 "[ . 1 . 2]" 1
1604 1 83 TYR QD 1 84 PRO QD . . 3.970 2.128 1.961 2.343 . 0 0 "[ . 1 . 2]" 1
1605 1 83 TYR QD 1 84 PRO HD3 . . 4.800 3.227 3.118 3.449 . 0 0 "[ . 1 . 2]" 1
1606 1 84 PRO HA 1 85 LYS H . . 2.400 2.292 2.175 2.399 . 0 0 "[ . 1 . 2]" 1
1607 1 84 PRO HA 1 85 LYS HA . . 4.440 4.403 4.375 4.445 0.005 13 0 "[ . 1 . 2]" 1
1608 1 84 PRO HA 1 85 LYS QB . . 4.600 4.051 3.952 4.489 . 0 0 "[ . 1 . 2]" 1
1609 1 84 PRO QB 1 85 LYS H . . 3.460 2.811 2.540 3.162 . 0 0 "[ . 1 . 2]" 1
1610 1 84 PRO QB 1 86 LEU QD . . 5.140 2.885 2.311 3.829 . 0 0 "[ . 1 . 2]" 1
1611 1 84 PRO QD 1 86 LEU QD . . 5.280 4.802 4.170 5.281 0.001 9 0 "[ . 1 . 2]" 1
1612 1 84 PRO QG 1 86 LEU QD . . 5.440 3.347 2.633 3.853 . 0 0 "[ . 1 . 2]" 1
1613 1 85 LYS H 1 85 LYS QB . . 2.940 2.496 2.355 2.956 0.016 8 0 "[ . 1 . 2]" 1
1614 1 85 LYS H 1 85 LYS HG2 . . 5.490 4.446 2.233 4.867 . 0 0 "[ . 1 . 2]" 1
1615 1 85 LYS H 1 85 LYS QG . . 4.750 3.881 2.213 4.158 . 0 0 "[ . 1 . 2]" 1
1616 1 85 LYS H 1 85 LYS HG3 . . 5.490 4.376 3.613 4.538 . 0 0 "[ . 1 . 2]" 1
1617 1 85 LYS HA 1 85 LYS QD . . 3.500 2.840 1.985 3.528 0.028 10 0 "[ . 1 . 2]" 1
1618 1 85 LYS HA 1 85 LYS HG2 . . 4.110 3.712 3.529 3.816 . 0 0 "[ . 1 . 2]" 1
1619 1 85 LYS HA 1 85 LYS HG3 . . 4.110 2.780 2.329 4.234 0.124 8 0 "[ . 1 . 2]" 1
1620 1 85 LYS HA 1 86 LEU H . . 2.400 2.157 2.141 2.242 . 0 0 "[ . 1 . 2]" 1
1621 1 85 LYS QB 1 85 LYS QD . . 3.450 2.130 1.970 2.327 . 0 0 "[ . 1 . 2]" 1
1622 1 85 LYS QB 1 86 LEU H . . 3.860 3.710 2.830 3.859 . 0 0 "[ . 1 . 2]" 1
1623 1 85 LYS QG 1 86 LEU H . . 4.470 2.899 2.040 4.242 . 0 0 "[ . 1 . 2]" 1
1624 1 85 LYS HG2 1 86 LEU H . . 5.190 4.348 3.324 4.743 . 0 0 "[ . 1 . 2]" 1
1625 1 85 LYS HG3 1 86 LEU H . . 5.190 3.012 2.058 5.116 . 0 0 "[ . 1 . 2]" 1
1626 1 86 LEU H 1 86 LEU QB . . 2.670 2.428 2.244 2.671 0.001 20 0 "[ . 1 . 2]" 1
1627 1 86 LEU H 1 86 LEU QD . . 4.070 3.031 2.579 3.842 . 0 0 "[ . 1 . 2]" 1
1628 1 86 LEU HA 1 86 LEU QB . . 2.540 2.445 2.334 2.487 . 0 0 "[ . 1 . 2]" 1
1629 1 86 LEU HA 1 86 LEU QD . . 2.390 2.198 1.899 2.394 0.004 11 0 "[ . 1 . 2]" 1
1630 1 86 LEU HA 1 87 LYS H . . 2.400 2.240 2.138 2.386 . 0 0 "[ . 1 . 2]" 1
1631 1 86 LEU QB 1 87 LYS H . . 3.670 3.029 2.504 3.668 . 0 0 "[ . 1 . 2]" 1
1632 1 86 LEU QD 1 87 LYS H . . 3.960 3.416 2.496 3.954 . 0 0 "[ . 1 . 2]" 1
1633 1 87 LYS H 1 87 LYS QB . . 2.820 2.606 2.268 2.854 0.034 9 0 "[ . 1 . 2]" 1
1634 1 87 LYS HA 1 87 LYS QD . . 4.850 3.426 2.076 4.459 . 0 0 "[ . 1 . 2]" 1
1635 1 87 LYS HA 1 88 ALA H . . 2.400 2.269 2.144 2.407 0.007 3 0 "[ . 1 . 2]" 1
1636 1 87 LYS QB 1 87 LYS QD . . 2.720 2.198 1.986 2.548 . 0 0 "[ . 1 . 2]" 1
1637 1 87 LYS QB 1 88 ALA H . . 4.020 3.455 2.464 4.020 0.000 9 0 "[ . 1 . 2]" 1
1638 1 88 ALA H 1 88 ALA MB . . 3.420 2.317 2.115 2.699 . 0 0 "[ . 1 . 2]" 1
1639 1 88 ALA HA 1 89 THR H . . 2.480 2.250 2.140 2.453 . 0 0 "[ . 1 . 2]" 1
1640 1 88 ALA MB 1 89 THR H . . 3.970 3.064 2.410 3.702 . 0 0 "[ . 1 . 2]" 1
1641 1 89 THR H 1 89 THR MG . . 4.460 3.276 1.912 3.973 . 0 0 "[ . 1 . 2]" 1
1642 1 90 ASP HA 1 90 ASP QB . . 2.550 2.344 2.176 2.472 . 0 0 "[ . 1 . 2]" 1
stop_
save_