NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
606547 |
2ncp   |
26724 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ncp
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 1628
_Distance_constraint_stats_list.Viol_count 752
_Distance_constraint_stats_list.Viol_total 172.836
_Distance_constraint_stats_list.Viol_max 0.233
_Distance_constraint_stats_list.Viol_rms 0.0041
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0003
_Distance_constraint_stats_list.Viol_average_violations_only 0.0115
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 LYS 0.526 0.193 11 0 "[ . 1 . 2]"
1 4 PRO 0.530 0.193 11 0 "[ . 1 . 2]"
1 5 LYS 0.044 0.014 14 0 "[ . 1 . 2]"
1 6 TYR 1.299 0.079 14 0 "[ . 1 . 2]"
1 7 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 VAL 2.479 0.071 14 0 "[ . 1 . 2]"
1 11 GLU 2.079 0.071 14 0 "[ . 1 . 2]"
1 12 ALA 0.009 0.004 10 0 "[ . 1 . 2]"
1 13 LYS 0.066 0.011 10 0 "[ . 1 . 2]"
1 14 LEU 0.044 0.016 13 0 "[ . 1 . 2]"
1 15 ASP 0.059 0.047 18 0 "[ . 1 . 2]"
1 16 VAL 0.225 0.036 6 0 "[ . 1 . 2]"
1 17 ALA 0.170 0.019 18 0 "[ . 1 . 2]"
1 18 ARG 0.354 0.233 18 0 "[ . 1 . 2]"
1 19 ARG 0.242 0.036 6 0 "[ . 1 . 2]"
1 20 LEU 0.288 0.019 18 0 "[ . 1 . 2]"
1 21 PHE 0.110 0.053 17 0 "[ . 1 . 2]"
1 22 LYS 0.001 0.001 11 0 "[ . 1 . 2]"
1 23 ARG 0.012 0.003 10 0 "[ . 1 . 2]"
1 24 TYR 0.128 0.013 18 0 "[ . 1 . 2]"
1 25 ASP 0.010 0.004 17 0 "[ . 1 . 2]"
1 26 LYS 0.011 0.005 18 0 "[ . 1 . 2]"
1 27 ASP 0.005 0.005 18 0 "[ . 1 . 2]"
1 28 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 GLY 0.003 0.003 17 0 "[ . 1 . 2]"
1 31 GLN 0.192 0.071 17 0 "[ . 1 . 2]"
1 32 LEU 0.195 0.053 17 0 "[ . 1 . 2]"
1 33 GLN 0.021 0.004 18 0 "[ . 1 . 2]"
1 34 ASP 0.001 0.000 16 0 "[ . 1 . 2]"
1 35 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 GLU 0.010 0.005 18 0 "[ . 1 . 2]"
1 37 ILE 0.041 0.028 17 0 "[ . 1 . 2]"
1 38 ALA 0.020 0.005 17 0 "[ . 1 . 2]"
1 39 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 LEU 0.032 0.010 12 0 "[ . 1 . 2]"
1 41 LEU 0.168 0.014 17 0 "[ . 1 . 2]"
1 42 LYS 0.033 0.011 17 0 "[ . 1 . 2]"
1 43 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 THR 0.010 0.006 12 0 "[ . 1 . 2]"
1 45 TYR 0.101 0.011 17 0 "[ . 1 . 2]"
1 46 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 GLU 0.002 0.002 15 0 "[ . 1 . 2]"
1 48 MET 0.026 0.006 11 0 "[ . 1 . 2]"
1 49 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 MET 0.007 0.006 17 0 "[ . 1 . 2]"
1 51 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 ASN 0.213 0.158 10 0 "[ . 1 . 2]"
1 53 PHE 0.011 0.003 17 0 "[ . 1 . 2]"
1 54 THR 0.003 0.003 20 0 "[ . 1 . 2]"
1 55 PRO 0.040 0.005 17 0 "[ . 1 . 2]"
1 56 THR 0.002 0.002 15 0 "[ . 1 . 2]"
1 57 LYS 0.000 0.000 11 0 "[ . 1 . 2]"
1 58 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 ASP 0.093 0.016 16 0 "[ . 1 . 2]"
1 60 VAL 0.068 0.010 18 0 "[ . 1 . 2]"
1 61 LYS 0.138 0.135 13 0 "[ . 1 . 2]"
1 62 ILE 0.129 0.019 13 0 "[ . 1 . 2]"
1 63 TRP 0.134 0.013 15 0 "[ . 1 . 2]"
1 64 LEU 0.115 0.106 12 0 "[ . 1 . 2]"
1 65 GLN 0.126 0.107 12 0 "[ . 1 . 2]"
1 66 MET 0.009 0.003 12 0 "[ . 1 . 2]"
1 67 ALA 0.027 0.009 15 0 "[ . 1 . 2]"
1 68 ASP 0.348 0.107 12 0 "[ . 1 . 2]"
1 69 THR 0.042 0.018 8 0 "[ . 1 . 2]"
1 70 ASN 0.041 0.036 12 0 "[ . 1 . 2]"
1 71 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 ASP 0.002 0.002 4 0 "[ . 1 . 2]"
1 73 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 SER 0.121 0.039 17 0 "[ . 1 . 2]"
1 75 VAL 0.105 0.025 17 0 "[ . 1 . 2]"
1 76 SER 0.101 0.071 17 0 "[ . 1 . 2]"
1 77 LEU 0.033 0.007 16 0 "[ . 1 . 2]"
1 78 GLU 0.028 0.017 5 0 "[ . 1 . 2]"
1 79 GLU 0.073 0.018 8 0 "[ . 1 . 2]"
1 80 TYR 0.149 0.027 8 0 "[ . 1 . 2]"
1 81 GLU 0.179 0.047 15 0 "[ . 1 . 2]"
1 82 ASP 0.121 0.047 15 0 "[ . 1 . 2]"
1 83 LEU 0.071 0.027 8 0 "[ . 1 . 2]"
1 84 ILE 0.257 0.024 13 0 "[ . 1 . 2]"
1 85 ILE 0.198 0.061 15 0 "[ . 1 . 2]"
1 86 LYS 0.047 0.026 20 0 "[ . 1 . 2]"
1 87 SER 0.000 0.000 12 0 "[ . 1 . 2]"
1 88 LEU 0.145 0.130 20 0 "[ . 1 . 2]"
1 89 GLN 0.172 0.053 17 0 "[ . 1 . 2]"
1 90 LYS 0.036 0.021 10 0 "[ . 1 . 2]"
1 91 ALA 0.000 0.000 12 0 "[ . 1 . 2]"
1 92 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 ILE 0.412 0.172 20 0 "[ . 1 . 2]"
1 94 ARG 0.816 0.214 16 0 "[ . 1 . 2]"
1 95 VAL 0.466 0.061 15 0 "[ . 1 . 2]"
1 96 GLU 0.634 0.079 14 0 "[ . 1 . 2]"
1 97 LYS 0.313 0.050 14 0 "[ . 1 . 2]"
1 98 GLN 0.045 0.017 14 0 "[ . 1 . 2]"
1 99 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 LEU 0.003 0.003 8 0 "[ . 1 . 2]"
1 101 VAL 0.003 0.003 8 0 "[ . 1 . 2]"
1 102 PHE 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 2 SER HA 1 3 LYS H . . 3.170 2.332 2.137 2.762 . 0 0 "[ . 1 . 2]" 1
2 1 2 SER QB 1 3 LYS H . . 4.340 3.119 2.131 3.907 . 0 0 "[ . 1 . 2]" 1
3 1 3 LYS H 1 3 LYS QB . . 3.320 2.549 2.168 3.122 . 0 0 "[ . 1 . 2]" 1
4 1 3 LYS H 1 3 LYS QG . . 4.430 3.053 1.935 4.085 . 0 0 "[ . 1 . 2]" 1
5 1 3 LYS H 1 4 PRO QD . . 4.900 4.269 3.391 4.376 . 0 0 "[ . 1 . 2]" 1
6 1 3 LYS HA 1 3 LYS QD . . 4.090 3.691 2.603 4.097 0.007 12 0 "[ . 1 . 2]" 1
7 1 3 LYS HA 1 3 LYS QG . . 3.490 2.604 2.084 3.436 . 0 0 "[ . 1 . 2]" 1
8 1 3 LYS HA 1 4 PRO HD2 . . 2.900 2.417 1.998 2.524 . 0 0 "[ . 1 . 2]" 1
9 1 3 LYS HA 1 4 PRO HD3 . . 2.900 2.377 2.254 2.785 . 0 0 "[ . 1 . 2]" 1
10 1 3 LYS HA 1 4 PRO QG . . 4.450 4.025 3.855 4.083 . 0 0 "[ . 1 . 2]" 1
11 1 3 LYS QB 1 4 PRO QD . . 3.560 2.244 1.930 3.753 0.193 11 0 "[ . 1 . 2]" 1
12 1 3 LYS QG 1 4 PRO QG . . 5.180 4.388 3.067 5.220 0.040 9 0 "[ . 1 . 2]" 1
13 1 4 PRO HA 1 5 LYS H . . 3.010 2.314 2.152 2.632 . 0 0 "[ . 1 . 2]" 1
14 1 4 PRO HB2 1 6 TYR HA . . 5.500 5.164 4.913 5.510 0.010 13 0 "[ . 1 . 2]" 1
15 1 4 PRO HB2 1 6 TYR QD . . 4.000 2.964 2.629 3.919 . 0 0 "[ . 1 . 2]" 1
16 1 4 PRO HB2 1 6 TYR QE . . 4.530 2.784 2.380 3.347 . 0 0 "[ . 1 . 2]" 1
17 1 4 PRO HB3 1 5 LYS H . . 4.240 3.646 3.213 4.140 . 0 0 "[ . 1 . 2]" 1
18 1 4 PRO QG 1 6 TYR QE . . 4.180 3.320 1.991 4.122 . 0 0 "[ . 1 . 2]" 1
19 1 5 LYS H 1 5 LYS HB2 . . 3.160 2.406 2.184 2.722 . 0 0 "[ . 1 . 2]" 1
20 1 5 LYS H 1 5 LYS HG2 . . 5.270 3.965 2.652 4.746 . 0 0 "[ . 1 . 2]" 1
21 1 5 LYS H 1 5 LYS QG . . 4.550 3.460 2.563 4.147 . 0 0 "[ . 1 . 2]" 1
22 1 5 LYS H 1 5 LYS HG3 . . 5.270 3.942 2.698 4.833 . 0 0 "[ . 1 . 2]" 1
23 1 5 LYS H 1 6 TYR H . . 4.550 4.278 3.998 4.543 . 0 0 "[ . 1 . 2]" 1
24 1 5 LYS HA 1 5 LYS QD . . 3.650 2.896 1.994 3.646 . 0 0 "[ . 1 . 2]" 1
25 1 5 LYS HA 1 5 LYS HG2 . . 3.730 3.023 2.234 3.680 . 0 0 "[ . 1 . 2]" 1
26 1 5 LYS HA 1 5 LYS HG3 . . 3.730 2.982 2.163 3.743 0.013 13 0 "[ . 1 . 2]" 1
27 1 5 LYS HA 1 6 TYR QD . . 4.460 4.039 3.317 4.472 0.012 13 0 "[ . 1 . 2]" 1
28 1 5 LYS HB2 1 5 LYS QE . . 4.490 3.445 2.061 4.489 . 0 0 "[ . 1 . 2]" 1
29 1 5 LYS HB2 1 6 TYR H . . 5.020 4.476 4.057 4.576 . 0 0 "[ . 1 . 2]" 1
30 1 5 LYS HB2 1 6 TYR QD . . 5.500 5.177 4.887 5.514 0.014 14 0 "[ . 1 . 2]" 1
31 1 5 LYS HB3 1 5 LYS QE . . 4.400 3.656 2.598 4.386 . 0 0 "[ . 1 . 2]" 1
32 1 5 LYS HB3 1 6 TYR H . . 4.340 3.832 3.084 4.222 . 0 0 "[ . 1 . 2]" 1
33 1 5 LYS HB3 1 6 TYR HA . . 4.790 4.620 4.446 4.784 . 0 0 "[ . 1 . 2]" 1
34 1 5 LYS QD 1 5 LYS QG . . 2.350 2.053 2.018 2.092 . 0 0 "[ . 1 . 2]" 1
35 1 5 LYS QE 1 5 LYS QG . . 2.940 2.206 2.039 2.488 . 0 0 "[ . 1 . 2]" 1
36 1 6 TYR H 1 6 TYR QD . . 4.340 3.121 2.802 3.700 . 0 0 "[ . 1 . 2]" 1
37 1 6 TYR HA 1 6 TYR QD . . 3.100 2.379 2.021 2.701 . 0 0 "[ . 1 . 2]" 1
38 1 6 TYR HA 1 6 TYR QE . . 4.350 4.290 4.167 4.427 0.077 11 0 "[ . 1 . 2]" 1
39 1 6 TYR HA 1 10 VAL HB . . 5.190 4.635 4.430 4.989 . 0 0 "[ . 1 . 2]" 1
40 1 6 TYR HA 1 10 VAL MG1 . . 4.990 4.742 4.554 5.012 0.022 11 0 "[ . 1 . 2]" 1
41 1 6 TYR HA 1 10 VAL MG2 . . 5.500 3.797 3.680 4.223 . 0 0 "[ . 1 . 2]" 1
42 1 6 TYR HA 1 95 VAL QG . . 5.160 3.218 2.801 4.654 . 0 0 "[ . 1 . 2]" 1
43 1 6 TYR HA 1 96 GLU HA . . 5.330 5.204 4.888 5.344 0.014 10 0 "[ . 1 . 2]" 1
44 1 6 TYR HA 1 96 GLU QG . . 4.090 3.269 1.980 4.110 0.020 2 0 "[ . 1 . 2]" 1
45 1 6 TYR QB 1 10 VAL MG1 . . 3.700 3.195 2.653 3.365 . 0 0 "[ . 1 . 2]" 1
46 1 6 TYR QB 1 10 VAL MG2 . . 4.050 3.038 2.016 3.207 . 0 0 "[ . 1 . 2]" 1
47 1 6 TYR HB2 1 7 ASN H . . 4.480 4.182 3.567 4.385 . 0 0 "[ . 1 . 2]" 1
48 1 6 TYR HB2 1 10 VAL HB . . 4.150 4.021 2.637 4.177 0.027 14 0 "[ . 1 . 2]" 1
49 1 6 TYR HB2 1 10 VAL MG2 . . 4.680 4.523 3.112 4.700 0.020 2 0 "[ . 1 . 2]" 1
50 1 6 TYR HB3 1 7 ASN H . . 4.480 3.014 2.424 3.341 . 0 0 "[ . 1 . 2]" 1
51 1 6 TYR HB3 1 10 VAL HB . . 4.150 2.505 2.288 2.851 . 0 0 "[ . 1 . 2]" 1
52 1 6 TYR HB3 1 10 VAL MG2 . . 4.680 3.087 2.042 3.264 . 0 0 "[ . 1 . 2]" 1
53 1 6 TYR QD 1 7 ASN H . . 4.860 4.040 3.427 4.218 . 0 0 "[ . 1 . 2]" 1
54 1 6 TYR QD 1 10 VAL HB . . 3.840 2.811 2.567 3.668 . 0 0 "[ . 1 . 2]" 1
55 1 6 TYR QD 1 10 VAL MG1 . . 3.390 2.056 1.930 2.815 . 0 0 "[ . 1 . 2]" 1
56 1 6 TYR QD 1 10 VAL MG2 . . 3.790 3.357 2.776 3.814 0.024 10 0 "[ . 1 . 2]" 1
57 1 6 TYR QD 1 11 GLU QB . . 5.340 4.732 4.084 5.345 0.005 13 0 "[ . 1 . 2]" 1
58 1 6 TYR QD 1 14 LEU MD1 . . 4.760 2.738 2.128 3.269 . 0 0 "[ . 1 . 2]" 1
59 1 6 TYR QD 1 14 LEU QD . . 3.320 2.715 2.122 3.215 . 0 0 "[ . 1 . 2]" 1
60 1 6 TYR QD 1 14 LEU MD2 . . 4.760 4.586 4.143 4.761 0.001 4 0 "[ . 1 . 2]" 1
61 1 6 TYR QD 1 14 LEU HG . . 5.500 4.795 4.233 5.516 0.016 13 0 "[ . 1 . 2]" 1
62 1 6 TYR QD 1 85 ILE MD . . 3.790 3.073 2.685 3.568 . 0 0 "[ . 1 . 2]" 1
63 1 6 TYR QD 1 85 ILE MG . . 5.500 4.331 3.811 4.998 . 0 0 "[ . 1 . 2]" 1
64 1 6 TYR QD 1 95 VAL QG . . 3.040 2.632 1.992 3.014 . 0 0 "[ . 1 . 2]" 1
65 1 6 TYR QD 1 96 GLU H . . 5.500 4.085 3.117 4.471 . 0 0 "[ . 1 . 2]" 1
66 1 6 TYR QD 1 96 GLU HA . . 5.500 5.444 4.648 5.552 0.052 15 0 "[ . 1 . 2]" 1
67 1 6 TYR QD 1 96 GLU QB . . 5.340 4.527 3.228 5.371 0.031 4 0 "[ . 1 . 2]" 1
68 1 6 TYR QD 1 96 GLU QG . . 4.770 3.997 2.137 4.849 0.079 14 0 "[ . 1 . 2]" 1
69 1 6 TYR QD 1 97 LYS HA . . 4.240 3.635 3.049 4.290 0.050 14 0 "[ . 1 . 2]" 1
70 1 6 TYR QD 1 97 LYS HB2 . . 4.210 4.133 3.955 4.220 0.010 4 0 "[ . 1 . 2]" 1
71 1 6 TYR QD 1 97 LYS QG . . 5.340 4.782 4.083 5.372 0.032 14 0 "[ . 1 . 2]" 1
72 1 6 TYR QE 1 10 VAL MG1 . . 4.220 2.933 2.589 4.205 . 0 0 "[ . 1 . 2]" 1
73 1 6 TYR QE 1 14 LEU MD1 . . 4.640 3.369 2.737 4.104 . 0 0 "[ . 1 . 2]" 1
74 1 6 TYR QE 1 14 LEU QD . . 3.840 3.253 2.703 3.846 0.006 11 0 "[ . 1 . 2]" 1
75 1 6 TYR QE 1 14 LEU MD2 . . 4.640 4.358 3.907 4.644 0.004 11 0 "[ . 1 . 2]" 1
76 1 6 TYR QE 1 85 ILE MD . . 3.350 2.132 1.946 3.344 . 0 0 "[ . 1 . 2]" 1
77 1 6 TYR QE 1 85 ILE QG . . 4.300 2.884 1.997 3.811 . 0 0 "[ . 1 . 2]" 1
78 1 6 TYR QE 1 85 ILE MG . . 3.430 2.758 2.004 3.437 0.007 15 0 "[ . 1 . 2]" 1
79 1 6 TYR QE 1 95 VAL QG . . 3.000 2.546 2.392 3.004 0.004 10 0 "[ . 1 . 2]" 1
80 1 6 TYR QE 1 96 GLU HA . . 5.500 5.390 5.150 5.568 0.068 14 0 "[ . 1 . 2]" 1
81 1 6 TYR QE 1 97 LYS HA . . 4.190 2.510 1.998 3.364 . 0 0 "[ . 1 . 2]" 1
82 1 6 TYR QE 1 97 LYS HB2 . . 3.530 2.215 1.996 2.973 . 0 0 "[ . 1 . 2]" 1
83 1 6 TYR QE 1 97 LYS HB3 . . 4.730 3.572 1.990 4.261 . 0 0 "[ . 1 . 2]" 1
84 1 6 TYR QE 1 97 LYS QD . . 4.760 3.815 1.930 4.778 0.018 11 0 "[ . 1 . 2]" 1
85 1 6 TYR QE 1 97 LYS QE . . 4.560 4.135 2.252 4.564 0.004 18 0 "[ . 1 . 2]" 1
86 1 6 TYR QE 1 97 LYS HG2 . . 4.530 3.146 2.108 3.977 . 0 0 "[ . 1 . 2]" 1
87 1 6 TYR QE 1 97 LYS QG . . 3.820 2.890 2.084 3.743 . 0 0 "[ . 1 . 2]" 1
88 1 6 TYR QE 1 97 LYS HG3 . . 4.530 3.477 2.433 4.565 0.035 4 0 "[ . 1 . 2]" 1
89 1 7 ASN H 1 7 ASN QD . . 5.340 4.059 2.608 4.674 . 0 0 "[ . 1 . 2]" 1
90 1 7 ASN H 1 10 VAL HB . . 4.580 3.853 3.503 4.130 . 0 0 "[ . 1 . 2]" 1
91 1 7 ASN HA 1 8 PRO HB3 . . 4.980 4.870 4.868 4.876 . 0 0 "[ . 1 . 2]" 1
92 1 7 ASN HA 1 8 PRO HD2 . . 3.150 2.513 2.507 2.535 . 0 0 "[ . 1 . 2]" 1
93 1 7 ASN HA 1 8 PRO HG2 . . 4.790 4.605 4.600 4.624 . 0 0 "[ . 1 . 2]" 1
94 1 7 ASN HA 1 8 PRO QG . . 4.200 4.075 4.071 4.090 . 0 0 "[ . 1 . 2]" 1
95 1 7 ASN HA 1 8 PRO HG3 . . 4.790 4.544 4.540 4.559 . 0 0 "[ . 1 . 2]" 1
96 1 7 ASN QB 1 8 PRO QG . . 4.130 3.526 3.459 3.642 . 0 0 "[ . 1 . 2]" 1
97 1 7 ASN QB 1 9 GLU QB . . 4.250 3.041 2.827 3.783 . 0 0 "[ . 1 . 2]" 1
98 1 7 ASN HB2 1 8 PRO HD2 . . 3.680 3.614 3.567 3.646 . 0 0 "[ . 1 . 2]" 1
99 1 7 ASN HB2 1 10 VAL HB . . 5.500 4.231 4.073 4.484 . 0 0 "[ . 1 . 2]" 1
100 1 7 ASN HB3 1 8 PRO HD2 . . 3.680 2.104 1.983 2.297 . 0 0 "[ . 1 . 2]" 1
101 1 7 ASN HB3 1 10 VAL HB . . 5.500 4.918 4.450 5.198 . 0 0 "[ . 1 . 2]" 1
102 1 8 PRO HA 1 11 GLU H . . 4.180 3.954 3.722 4.031 . 0 0 "[ . 1 . 2]" 1
103 1 9 GLU H 1 9 GLU QB . . 3.570 2.368 2.188 2.718 . 0 0 "[ . 1 . 2]" 1
104 1 9 GLU H 1 9 GLU QG . . 4.560 2.850 1.932 4.071 . 0 0 "[ . 1 . 2]" 1
105 1 9 GLU H 1 10 VAL H . . 4.250 2.364 2.340 2.466 . 0 0 "[ . 1 . 2]" 1
106 1 9 GLU HA 1 9 GLU QG . . 3.680 2.642 2.268 3.333 . 0 0 "[ . 1 . 2]" 1
107 1 9 GLU HA 1 12 ALA MB . . 3.340 2.629 2.471 2.900 . 0 0 "[ . 1 . 2]" 1
108 1 10 VAL H 1 10 VAL HB . . 4.170 2.749 2.738 2.780 . 0 0 "[ . 1 . 2]" 1
109 1 10 VAL H 1 10 VAL MG2 . . 4.630 1.993 1.912 2.111 . 0 0 "[ . 1 . 2]" 1
110 1 10 VAL H 1 11 GLU H . . 3.830 2.695 2.488 2.760 . 0 0 "[ . 1 . 2]" 1
111 1 10 VAL HA 1 10 VAL MG1 . . 3.320 2.203 2.107 2.303 . 0 0 "[ . 1 . 2]" 1
112 1 10 VAL HA 1 10 VAL MG2 . . 3.090 2.518 2.491 2.570 . 0 0 "[ . 1 . 2]" 1
113 1 10 VAL HA 1 12 ALA MB . . 5.260 4.436 4.329 4.493 . 0 0 "[ . 1 . 2]" 1
114 1 10 VAL HA 1 13 LYS H . . 4.440 3.680 3.519 3.744 . 0 0 "[ . 1 . 2]" 1
115 1 10 VAL HA 1 13 LYS QB . . 3.920 3.595 3.350 3.763 . 0 0 "[ . 1 . 2]" 1
116 1 10 VAL HA 1 14 LEU QD . . 5.440 4.103 3.526 4.529 . 0 0 "[ . 1 . 2]" 1
117 1 10 VAL HA 1 14 LEU HG . . 5.190 4.231 3.719 4.596 . 0 0 "[ . 1 . 2]" 1
118 1 10 VAL HA 1 84 ILE MG . . 5.500 5.256 4.611 5.507 0.007 10 0 "[ . 1 . 2]" 1
119 1 10 VAL HA 1 88 LEU QD . . 3.760 2.325 1.885 2.897 . 0 0 "[ . 1 . 2]" 1
120 1 10 VAL HA 1 95 VAL MG1 . . 5.500 5.177 4.271 5.511 0.011 2 0 "[ . 1 . 2]" 1
121 1 10 VAL HA 1 95 VAL QG . . 4.740 4.139 3.271 4.577 . 0 0 "[ . 1 . 2]" 1
122 1 10 VAL HA 1 95 VAL MG2 . . 5.500 4.360 3.397 4.895 . 0 0 "[ . 1 . 2]" 1
123 1 10 VAL HB 1 11 GLU H . . 3.720 2.096 2.051 2.343 . 0 0 "[ . 1 . 2]" 1
124 1 10 VAL HB 1 11 GLU HA . . 3.910 3.918 3.887 3.939 0.029 14 0 "[ . 1 . 2]" 1
125 1 10 VAL HB 1 14 LEU QD . . 4.440 3.352 2.506 3.829 . 0 0 "[ . 1 . 2]" 1
126 1 10 VAL MG1 1 11 GLU H . . 4.280 3.419 3.340 3.667 . 0 0 "[ . 1 . 2]" 1
127 1 10 VAL MG1 1 11 GLU HA . . 4.500 3.792 3.682 4.019 . 0 0 "[ . 1 . 2]" 1
128 1 10 VAL MG1 1 13 LYS QB . . 5.070 3.968 3.738 4.227 . 0 0 "[ . 1 . 2]" 1
129 1 10 VAL MG1 1 14 LEU QD . . 3.080 2.191 1.814 2.707 . 0 0 "[ . 1 . 2]" 1
130 1 10 VAL MG1 1 14 LEU HG . . 4.070 2.869 2.128 3.369 . 0 0 "[ . 1 . 2]" 1
131 1 10 VAL MG1 1 85 ILE MD . . 3.300 2.206 1.855 2.826 . 0 0 "[ . 1 . 2]" 1
132 1 10 VAL MG1 1 88 LEU QD . . 3.610 2.260 1.806 3.434 . 0 0 "[ . 1 . 2]" 1
133 1 10 VAL MG1 1 95 VAL HA . . 4.210 3.872 3.476 4.211 0.001 15 0 "[ . 1 . 2]" 1
134 1 10 VAL MG1 1 95 VAL HB . . 4.000 3.059 2.065 4.029 0.029 10 0 "[ . 1 . 2]" 1
135 1 10 VAL MG1 1 95 VAL QG . . 3.330 1.873 1.743 2.108 . 0 0 "[ . 1 . 2]" 1
136 1 10 VAL MG2 1 11 GLU HA . . 5.180 5.240 5.204 5.251 0.071 14 0 "[ . 1 . 2]" 1
137 1 10 VAL MG2 1 11 GLU QB . . 4.610 4.645 4.619 4.671 0.061 13 0 "[ . 1 . 2]" 1
138 1 10 VAL MG2 1 13 LYS H . . 5.500 5.470 5.373 5.511 0.011 10 0 "[ . 1 . 2]" 1
139 1 10 VAL MG2 1 85 ILE MD . . 4.810 4.101 3.634 4.804 . 0 0 "[ . 1 . 2]" 1
140 1 10 VAL MG2 1 88 LEU QD . . 3.720 3.331 2.491 3.697 . 0 0 "[ . 1 . 2]" 1
141 1 10 VAL MG2 1 93 ILE HA . . 5.500 5.093 4.619 5.515 0.015 14 0 "[ . 1 . 2]" 1
142 1 10 VAL MG2 1 93 ILE HB . . 4.970 4.249 3.741 4.748 . 0 0 "[ . 1 . 2]" 1
143 1 10 VAL MG2 1 93 ILE MG . . 2.920 2.244 1.888 2.747 . 0 0 "[ . 1 . 2]" 1
144 1 10 VAL MG2 1 95 VAL HA . . 3.150 2.257 1.923 2.711 . 0 0 "[ . 1 . 2]" 1
145 1 10 VAL MG2 1 95 VAL HB . . 3.940 2.768 1.887 3.948 0.008 14 0 "[ . 1 . 2]" 1
146 1 10 VAL MG2 1 95 VAL MG1 . . 3.520 2.871 1.928 3.510 . 0 0 "[ . 1 . 2]" 1
147 1 10 VAL MG2 1 95 VAL QG . . 2.980 1.908 1.700 2.163 . 0 0 "[ . 1 . 2]" 1
148 1 10 VAL MG2 1 95 VAL MG2 . . 3.520 2.006 1.857 2.335 . 0 0 "[ . 1 . 2]" 1
149 1 10 VAL MG2 1 96 GLU H . . 5.500 3.328 2.497 3.934 . 0 0 "[ . 1 . 2]" 1
150 1 11 GLU H 1 11 GLU QB . . 3.620 2.104 2.040 2.210 . 0 0 "[ . 1 . 2]" 1
151 1 11 GLU H 1 11 GLU QG . . 4.470 3.800 3.439 4.040 . 0 0 "[ . 1 . 2]" 1
152 1 11 GLU H 1 12 ALA H . . 3.950 2.758 2.703 2.777 . 0 0 "[ . 1 . 2]" 1
153 1 11 GLU HA 1 11 GLU QG . . 3.630 2.316 2.129 2.688 . 0 0 "[ . 1 . 2]" 1
154 1 11 GLU HA 1 14 LEU H . . 4.030 3.000 2.926 3.242 . 0 0 "[ . 1 . 2]" 1
155 1 11 GLU HA 1 14 LEU HB2 . . 3.990 2.248 1.997 2.613 . 0 0 "[ . 1 . 2]" 1
156 1 11 GLU HA 1 14 LEU QB . . 3.490 2.232 1.988 2.580 . 0 0 "[ . 1 . 2]" 1
157 1 11 GLU HA 1 14 LEU HB3 . . 3.990 3.827 3.633 3.992 0.002 12 0 "[ . 1 . 2]" 1
158 1 11 GLU HA 1 14 LEU QD . . 3.210 2.162 1.931 2.658 . 0 0 "[ . 1 . 2]" 1
159 1 11 GLU HA 1 14 LEU HG . . 4.260 2.818 2.133 3.337 . 0 0 "[ . 1 . 2]" 1
160 1 11 GLU QB 1 12 ALA H . . 3.820 2.835 2.766 2.982 . 0 0 "[ . 1 . 2]" 1
161 1 11 GLU QG 1 14 LEU QD . . 4.340 2.965 2.359 4.145 . 0 0 "[ . 1 . 2]" 1
162 1 12 ALA H 1 12 ALA MB . . 3.260 2.135 2.024 2.234 . 0 0 "[ . 1 . 2]" 1
163 1 12 ALA H 1 13 LYS H . . 3.640 2.735 2.674 2.782 . 0 0 "[ . 1 . 2]" 1
164 1 12 ALA H 1 14 LEU H . . 5.020 3.953 3.846 4.084 . 0 0 "[ . 1 . 2]" 1
165 1 12 ALA HA 1 15 ASP H . . 4.820 3.842 3.656 4.090 . 0 0 "[ . 1 . 2]" 1
166 1 12 ALA HA 1 15 ASP HB2 . . 4.020 3.608 3.315 4.010 . 0 0 "[ . 1 . 2]" 1
167 1 12 ALA HA 1 15 ASP QB . . 3.420 3.234 3.033 3.416 . 0 0 "[ . 1 . 2]" 1
168 1 12 ALA HA 1 15 ASP HB3 . . 4.020 3.695 3.360 4.001 . 0 0 "[ . 1 . 2]" 1
169 1 12 ALA HA 1 16 VAL QG . . 5.190 5.055 4.676 5.194 0.004 10 0 "[ . 1 . 2]" 1
170 1 12 ALA MB 1 13 LYS H . . 3.500 2.720 2.607 2.862 . 0 0 "[ . 1 . 2]" 1
171 1 12 ALA MB 1 15 ASP H . . 5.500 4.829 4.695 4.993 . 0 0 "[ . 1 . 2]" 1
172 1 12 ALA MB 1 15 ASP HB2 . . 5.500 5.047 4.816 5.397 . 0 0 "[ . 1 . 2]" 1
173 1 12 ALA MB 1 15 ASP QB . . 4.620 4.432 4.251 4.556 . 0 0 "[ . 1 . 2]" 1
174 1 12 ALA MB 1 15 ASP HB3 . . 5.500 4.924 4.643 5.132 . 0 0 "[ . 1 . 2]" 1
175 1 13 LYS H 1 13 LYS HB2 . . 4.080 2.467 2.162 2.724 . 0 0 "[ . 1 . 2]" 1
176 1 13 LYS H 1 13 LYS QB . . 3.540 2.270 2.138 2.318 . 0 0 "[ . 1 . 2]" 1
177 1 13 LYS H 1 13 LYS HB3 . . 4.080 2.820 2.484 3.491 . 0 0 "[ . 1 . 2]" 1
178 1 13 LYS H 1 14 LEU H . . 4.800 2.289 2.267 2.349 . 0 0 "[ . 1 . 2]" 1
179 1 13 LYS H 1 14 LEU QD . . 5.270 4.250 3.980 4.458 . 0 0 "[ . 1 . 2]" 1
180 1 13 LYS H 1 84 ILE MG . . 5.300 5.030 4.675 5.304 0.004 17 0 "[ . 1 . 2]" 1
181 1 13 LYS H 1 88 LEU QD . . 5.440 3.551 3.126 4.228 . 0 0 "[ . 1 . 2]" 1
182 1 13 LYS HA 1 13 LYS QG . . 3.190 2.561 2.147 2.918 . 0 0 "[ . 1 . 2]" 1
183 1 13 LYS HA 1 16 VAL HB . . 4.390 4.256 3.937 4.395 0.005 10 0 "[ . 1 . 2]" 1
184 1 13 LYS HA 1 16 VAL QG . . 3.590 2.238 2.016 2.406 . 0 0 "[ . 1 . 2]" 1
185 1 13 LYS QB 1 14 LEU H . . 3.860 2.876 2.571 3.041 . 0 0 "[ . 1 . 2]" 1
186 1 13 LYS QB 1 16 VAL QG . . 4.020 3.804 3.489 3.973 . 0 0 "[ . 1 . 2]" 1
187 1 13 LYS QB 1 84 ILE MG . . 4.050 2.704 2.001 3.237 . 0 0 "[ . 1 . 2]" 1
188 1 13 LYS QB 1 88 LEU QD . . 3.640 1.974 1.728 2.572 . 0 0 "[ . 1 . 2]" 1
189 1 13 LYS QE 1 13 LYS QG . . 2.900 2.172 2.089 2.310 . 0 0 "[ . 1 . 2]" 1
190 1 13 LYS QE 1 84 ILE MG . . 3.960 3.281 1.963 3.963 0.003 10 0 "[ . 1 . 2]" 1
191 1 13 LYS QE 1 88 LEU QD . . 3.770 3.159 1.878 3.776 0.006 10 0 "[ . 1 . 2]" 1
192 1 13 LYS QG 1 16 VAL QG . . 4.310 3.155 2.706 3.985 . 0 0 "[ . 1 . 2]" 1
193 1 13 LYS QG 1 88 LEU QD . . 3.480 2.079 1.781 2.652 . 0 0 "[ . 1 . 2]" 1
194 1 13 LYS HG2 1 84 ILE MG . . 4.270 2.708 1.918 4.272 0.002 7 0 "[ . 1 . 2]" 1
195 1 13 LYS HG3 1 84 ILE MG . . 4.270 2.782 2.092 4.235 . 0 0 "[ . 1 . 2]" 1
196 1 14 LEU H 1 14 LEU QB . . 3.680 2.475 2.345 2.635 . 0 0 "[ . 1 . 2]" 1
197 1 14 LEU H 1 14 LEU MD1 . . 5.130 3.570 3.247 3.818 . 0 0 "[ . 1 . 2]" 1
198 1 14 LEU H 1 14 LEU QD . . 4.130 3.073 2.882 3.223 . 0 0 "[ . 1 . 2]" 1
199 1 14 LEU H 1 14 LEU MD2 . . 5.130 3.383 3.040 3.699 . 0 0 "[ . 1 . 2]" 1
200 1 14 LEU H 1 14 LEU HG . . 4.180 2.258 2.001 2.553 . 0 0 "[ . 1 . 2]" 1
201 1 14 LEU H 1 84 ILE MG . . 4.890 4.532 4.340 4.892 0.002 3 0 "[ . 1 . 2]" 1
202 1 14 LEU HA 1 14 LEU MD1 . . 4.390 3.899 3.813 3.946 . 0 0 "[ . 1 . 2]" 1
203 1 14 LEU HA 1 14 LEU QD . . 3.030 2.136 1.942 2.440 . 0 0 "[ . 1 . 2]" 1
204 1 14 LEU HA 1 14 LEU MD2 . . 4.390 2.147 1.948 2.464 . 0 0 "[ . 1 . 2]" 1
205 1 14 LEU HA 1 17 ALA H . . 4.520 3.364 3.085 3.601 . 0 0 "[ . 1 . 2]" 1
206 1 14 LEU HA 1 17 ALA MB . . 3.780 2.499 2.060 2.721 . 0 0 "[ . 1 . 2]" 1
207 1 14 LEU HA 1 84 ILE MD . . 4.510 4.003 3.634 4.349 . 0 0 "[ . 1 . 2]" 1
208 1 14 LEU HA 1 84 ILE QG . . 4.680 4.441 3.860 4.684 0.004 18 0 "[ . 1 . 2]" 1
209 1 14 LEU HA 1 84 ILE MG . . 4.750 3.898 3.501 4.361 . 0 0 "[ . 1 . 2]" 1
210 1 14 LEU QB 1 15 ASP H . . 3.880 2.775 2.416 2.911 . 0 0 "[ . 1 . 2]" 1
211 1 14 LEU QB 1 15 ASP HA . . 4.830 3.897 3.791 3.954 . 0 0 "[ . 1 . 2]" 1
212 1 14 LEU HB2 1 15 ASP H . . 4.650 2.842 2.455 2.990 . 0 0 "[ . 1 . 2]" 1
213 1 14 LEU HB3 1 15 ASP H . . 4.650 3.891 3.594 4.054 . 0 0 "[ . 1 . 2]" 1
214 1 14 LEU QD 1 15 ASP H . . 4.650 4.139 3.970 4.254 . 0 0 "[ . 1 . 2]" 1
215 1 14 LEU QD 1 17 ALA MB . . 3.950 3.343 3.020 3.640 . 0 0 "[ . 1 . 2]" 1
216 1 14 LEU QD 1 81 GLU HA . . 3.560 2.903 2.409 3.524 . 0 0 "[ . 1 . 2]" 1
217 1 14 LEU QD 1 81 GLU QB . . 4.130 2.484 1.845 3.454 . 0 0 "[ . 1 . 2]" 1
218 1 14 LEU QD 1 81 GLU QG . . 3.630 2.666 1.723 3.629 . 0 0 "[ . 1 . 2]" 1
219 1 14 LEU QD 1 82 ASP H . . 5.050 4.440 4.011 5.015 . 0 0 "[ . 1 . 2]" 1
220 1 14 LEU QD 1 84 ILE H . . 4.610 4.004 3.734 4.424 . 0 0 "[ . 1 . 2]" 1
221 1 14 LEU QD 1 84 ILE HB . . 3.690 2.490 2.109 2.745 . 0 0 "[ . 1 . 2]" 1
222 1 14 LEU QD 1 84 ILE MD . . 3.850 3.099 2.772 3.423 . 0 0 "[ . 1 . 2]" 1
223 1 14 LEU QD 1 84 ILE QG . . 4.360 3.822 3.265 4.228 . 0 0 "[ . 1 . 2]" 1
224 1 14 LEU QD 1 85 ILE HA . . 4.580 3.667 3.072 4.380 . 0 0 "[ . 1 . 2]" 1
225 1 14 LEU QD 1 85 ILE MD . . 2.820 1.746 1.657 1.893 . 0 0 "[ . 1 . 2]" 1
226 1 14 LEU QD 1 85 ILE QG . . 3.590 2.653 2.200 2.983 . 0 0 "[ . 1 . 2]" 1
227 1 14 LEU MD1 1 15 ASP H . . 5.350 4.604 4.368 4.869 . 0 0 "[ . 1 . 2]" 1
228 1 14 LEU MD1 1 85 ILE MD . . 3.370 2.087 1.925 2.518 . 0 0 "[ . 1 . 2]" 1
229 1 14 LEU MD2 1 15 ASP H . . 5.350 4.704 4.522 4.882 . 0 0 "[ . 1 . 2]" 1
230 1 14 LEU MD2 1 85 ILE MD . . 3.370 1.892 1.766 2.053 . 0 0 "[ . 1 . 2]" 1
231 1 14 LEU HG 1 15 ASP H . . 5.500 4.298 3.922 4.497 . 0 0 "[ . 1 . 2]" 1
232 1 15 ASP H 1 15 ASP HB2 . . 3.950 2.373 2.211 2.565 . 0 0 "[ . 1 . 2]" 1
233 1 15 ASP H 1 15 ASP QB . . 3.400 2.224 2.146 2.281 . 0 0 "[ . 1 . 2]" 1
234 1 15 ASP H 1 15 ASP HB3 . . 3.950 2.718 2.556 2.905 . 0 0 "[ . 1 . 2]" 1
235 1 15 ASP H 1 16 VAL H . . 4.150 2.714 2.506 2.941 . 0 0 "[ . 1 . 2]" 1
236 1 15 ASP H 1 16 VAL QG . . 5.260 3.768 3.669 3.903 . 0 0 "[ . 1 . 2]" 1
237 1 15 ASP H 1 17 ALA MB . . 5.500 4.613 4.365 4.822 . 0 0 "[ . 1 . 2]" 1
238 1 15 ASP HA 1 18 ARG QB . . 3.900 3.268 2.420 3.905 0.005 8 0 "[ . 1 . 2]" 1
239 1 15 ASP HA 1 18 ARG QD . . 3.320 2.718 1.991 3.367 0.047 18 0 "[ . 1 . 2]" 1
240 1 15 ASP HA 1 18 ARG QG . . 4.490 3.093 1.963 4.489 . 0 0 "[ . 1 . 2]" 1
241 1 15 ASP QB 1 16 VAL QG . . 4.940 3.791 3.603 4.001 . 0 0 "[ . 1 . 2]" 1
242 1 15 ASP QB 1 18 ARG QD . . 5.180 4.428 3.740 4.985 . 0 0 "[ . 1 . 2]" 1
243 1 15 ASP HB2 1 16 VAL H . . 4.450 3.669 3.397 3.959 . 0 0 "[ . 1 . 2]" 1
244 1 15 ASP HB3 1 16 VAL H . . 4.450 2.467 2.160 2.905 . 0 0 "[ . 1 . 2]" 1
245 1 16 VAL H 1 16 VAL HB . . 3.550 2.590 2.476 2.765 . 0 0 "[ . 1 . 2]" 1
246 1 16 VAL H 1 16 VAL MG1 . . 4.440 2.082 1.981 2.167 . 0 0 "[ . 1 . 2]" 1
247 1 16 VAL H 1 16 VAL QG . . 3.360 2.072 1.974 2.154 . 0 0 "[ . 1 . 2]" 1
248 1 16 VAL H 1 16 VAL MG2 . . 4.440 3.772 3.755 3.799 . 0 0 "[ . 1 . 2]" 1
249 1 16 VAL H 1 17 ALA H . . 4.190 2.544 2.307 2.722 . 0 0 "[ . 1 . 2]" 1
250 1 16 VAL HA 1 16 VAL MG1 . . 3.220 3.202 3.201 3.203 . 0 0 "[ . 1 . 2]" 1
251 1 16 VAL HA 1 16 VAL QG . . 2.750 2.220 2.151 2.320 . 0 0 "[ . 1 . 2]" 1
252 1 16 VAL HA 1 16 VAL MG2 . . 3.220 2.265 2.186 2.381 . 0 0 "[ . 1 . 2]" 1
253 1 16 VAL HA 1 19 ARG H . . 4.350 3.730 3.491 3.927 . 0 0 "[ . 1 . 2]" 1
254 1 16 VAL HA 1 19 ARG QB . . 3.820 3.702 3.343 3.833 0.013 5 0 "[ . 1 . 2]" 1
255 1 16 VAL HA 1 19 ARG QD . . 4.740 2.726 1.912 4.152 . 0 0 "[ . 1 . 2]" 1
256 1 16 VAL HA 1 19 ARG QG . . 4.590 3.184 2.093 3.822 . 0 0 "[ . 1 . 2]" 1
257 1 16 VAL HB 1 17 ALA H . . 4.270 4.087 3.967 4.140 . 0 0 "[ . 1 . 2]" 1
258 1 16 VAL QG 1 17 ALA H . . 4.160 2.317 2.227 2.402 . 0 0 "[ . 1 . 2]" 1
259 1 16 VAL QG 1 17 ALA HA . . 4.030 3.075 2.977 3.146 . 0 0 "[ . 1 . 2]" 1
260 1 16 VAL QG 1 17 ALA MB . . 3.180 2.893 2.730 3.084 . 0 0 "[ . 1 . 2]" 1
261 1 16 VAL QG 1 19 ARG QB . . 4.150 3.921 3.164 4.186 0.036 6 0 "[ . 1 . 2]" 1
262 1 16 VAL QG 1 19 ARG QD . . 4.010 2.964 1.893 4.013 0.003 14 0 "[ . 1 . 2]" 1
263 1 16 VAL QG 1 20 LEU H . . 4.760 4.288 3.839 4.760 . 3 0 "[ . 1 . 2]" 1
264 1 16 VAL MG1 1 17 ALA H . . 5.230 2.336 2.241 2.422 . 0 0 "[ . 1 . 2]" 1
265 1 16 VAL MG1 1 17 ALA HA . . 5.130 3.247 3.076 3.400 . 0 0 "[ . 1 . 2]" 1
266 1 16 VAL MG2 1 17 ALA H . . 5.230 3.846 3.718 3.959 . 0 0 "[ . 1 . 2]" 1
267 1 16 VAL MG2 1 17 ALA HA . . 5.130 3.834 3.618 4.035 . 0 0 "[ . 1 . 2]" 1
268 1 17 ALA H 1 17 ALA MB . . 3.580 2.229 2.090 2.291 . 0 0 "[ . 1 . 2]" 1
269 1 17 ALA H 1 18 ARG H . . 4.670 2.469 2.334 2.761 . 0 0 "[ . 1 . 2]" 1
270 1 17 ALA HA 1 20 LEU H . . 4.790 3.377 3.119 3.648 . 0 0 "[ . 1 . 2]" 1
271 1 17 ALA HA 1 20 LEU HB2 . . 4.330 3.402 2.784 3.689 . 0 0 "[ . 1 . 2]" 1
272 1 17 ALA HA 1 20 LEU QB . . 3.670 2.691 2.334 2.915 . 0 0 "[ . 1 . 2]" 1
273 1 17 ALA HA 1 20 LEU HB3 . . 4.330 2.893 2.369 4.336 0.006 2 0 "[ . 1 . 2]" 1
274 1 17 ALA HA 1 20 LEU QD . . 4.510 3.430 2.763 3.774 . 0 0 "[ . 1 . 2]" 1
275 1 17 ALA HA 1 80 TYR QE . . 3.710 3.464 3.118 3.706 . 0 0 "[ . 1 . 2]" 1
276 1 17 ALA HA 1 84 ILE MD . . 4.510 4.458 4.140 4.521 0.011 15 0 "[ . 1 . 2]" 1
277 1 17 ALA MB 1 18 ARG H . . 4.260 2.727 2.411 3.006 . 0 0 "[ . 1 . 2]" 1
278 1 17 ALA MB 1 18 ARG QG . . 4.340 3.835 3.337 4.349 0.009 18 0 "[ . 1 . 2]" 1
279 1 17 ALA MB 1 20 LEU QB . . 4.570 3.734 3.576 3.888 . 0 0 "[ . 1 . 2]" 1
280 1 17 ALA MB 1 20 LEU QD . . 5.290 3.932 3.589 4.139 . 0 0 "[ . 1 . 2]" 1
281 1 17 ALA MB 1 20 LEU HG . . 5.500 5.489 5.198 5.519 0.019 18 0 "[ . 1 . 2]" 1
282 1 17 ALA MB 1 80 TYR QD . . 3.740 3.591 3.341 3.745 0.005 18 0 "[ . 1 . 2]" 1
283 1 17 ALA MB 1 80 TYR QE . . 3.070 2.596 2.348 2.902 . 0 0 "[ . 1 . 2]" 1
284 1 17 ALA MB 1 81 GLU HA . . 5.020 3.526 3.243 4.152 . 0 0 "[ . 1 . 2]" 1
285 1 17 ALA MB 1 84 ILE MD . . 3.290 2.255 1.904 2.441 . 0 0 "[ . 1 . 2]" 1
286 1 17 ALA MB 1 84 ILE QG . . 4.030 2.816 2.371 3.087 . 0 0 "[ . 1 . 2]" 1
287 1 17 ALA MB 1 84 ILE MG . . 3.600 3.506 3.267 3.604 0.004 7 0 "[ . 1 . 2]" 1
288 1 18 ARG H 1 18 ARG QB . . 3.480 2.333 2.159 2.612 . 0 0 "[ . 1 . 2]" 1
289 1 18 ARG H 1 18 ARG HD2 . . 5.330 4.252 2.275 5.051 . 0 0 "[ . 1 . 2]" 1
290 1 18 ARG H 1 18 ARG QD . . 4.450 3.710 2.258 4.263 . 0 0 "[ . 1 . 2]" 1
291 1 18 ARG H 1 18 ARG HD3 . . 5.330 4.292 2.760 5.078 . 0 0 "[ . 1 . 2]" 1
292 1 18 ARG H 1 18 ARG QG . . 3.790 2.621 1.997 3.471 . 0 0 "[ . 1 . 2]" 1
293 1 18 ARG H 1 19 ARG H . . 4.050 2.729 2.585 2.841 . 0 0 "[ . 1 . 2]" 1
294 1 18 ARG H 1 77 LEU QD . . 4.630 4.311 3.837 4.634 0.004 17 0 "[ . 1 . 2]" 1
295 1 18 ARG HA 1 18 ARG HD2 . . 5.130 4.378 3.205 5.141 0.011 8 0 "[ . 1 . 2]" 1
296 1 18 ARG HA 1 18 ARG HD3 . . 5.130 4.573 3.901 5.363 0.233 18 0 "[ . 1 . 2]" 1
297 1 18 ARG HA 1 21 PHE H . . 4.260 3.429 3.219 3.790 . 0 0 "[ . 1 . 2]" 1
298 1 18 ARG HA 1 21 PHE HB2 . . 4.070 3.203 2.944 3.779 . 0 0 "[ . 1 . 2]" 1
299 1 18 ARG HA 1 21 PHE HB3 . . 4.860 3.197 2.760 3.509 . 0 0 "[ . 1 . 2]" 1
300 1 18 ARG HA 1 77 LEU MD1 . . 4.340 3.058 1.957 4.347 0.007 16 0 "[ . 1 . 2]" 1
301 1 18 ARG HA 1 77 LEU QD . . 3.290 2.475 1.951 2.954 . 0 0 "[ . 1 . 2]" 1
302 1 18 ARG HA 1 77 LEU MD2 . . 4.340 3.071 2.105 4.340 0.000 13 0 "[ . 1 . 2]" 1
303 1 18 ARG HA 1 77 LEU HG . . 5.500 4.762 4.075 5.435 . 0 0 "[ . 1 . 2]" 1
304 1 18 ARG HA 1 80 TYR QD . . 4.790 4.273 3.614 4.792 0.002 10 0 "[ . 1 . 2]" 1
305 1 18 ARG HA 1 80 TYR QE . . 5.060 4.636 4.048 5.059 . 0 0 "[ . 1 . 2]" 1
306 1 18 ARG QB 1 18 ARG QD . . 3.190 2.174 1.948 2.394 . 0 0 "[ . 1 . 2]" 1
307 1 18 ARG QB 1 77 LEU QD . . 4.180 2.939 2.022 3.589 . 0 0 "[ . 1 . 2]" 1
308 1 18 ARG QD 1 77 LEU QD . . 3.910 3.182 2.400 3.697 . 0 0 "[ . 1 . 2]" 1
309 1 18 ARG HD2 1 77 LEU MD1 . . 5.500 3.944 2.489 5.097 . 0 0 "[ . 1 . 2]" 1
310 1 18 ARG HD2 1 77 LEU MD2 . . 5.500 4.497 3.261 5.453 . 0 0 "[ . 1 . 2]" 1
311 1 18 ARG HD3 1 77 LEU MD1 . . 5.500 4.194 3.355 5.309 . 0 0 "[ . 1 . 2]" 1
312 1 18 ARG HD3 1 77 LEU MD2 . . 5.500 4.707 3.580 5.503 0.003 18 0 "[ . 1 . 2]" 1
313 1 18 ARG QG 1 77 LEU QD . . 3.720 2.541 1.781 3.727 0.007 6 0 "[ . 1 . 2]" 1
314 1 19 ARG H 1 19 ARG QB . . 3.300 2.465 2.268 2.629 . 0 0 "[ . 1 . 2]" 1
315 1 19 ARG H 1 19 ARG QG . . 3.440 2.276 1.923 2.679 . 0 0 "[ . 1 . 2]" 1
316 1 19 ARG H 1 20 LEU H . . 3.970 2.612 2.345 2.825 . 0 0 "[ . 1 . 2]" 1
317 1 19 ARG HA 1 19 ARG QB . . 2.330 2.246 2.167 2.326 . 0 0 "[ . 1 . 2]" 1
318 1 19 ARG HA 1 19 ARG HD2 . . 5.500 4.756 4.442 4.984 . 0 0 "[ . 1 . 2]" 1
319 1 19 ARG HA 1 19 ARG QD . . 4.780 4.250 3.563 4.463 . 0 0 "[ . 1 . 2]" 1
320 1 19 ARG HA 1 19 ARG HD3 . . 5.500 4.909 3.725 5.507 0.007 15 0 "[ . 1 . 2]" 1
321 1 19 ARG HA 1 19 ARG HG2 . . 3.940 3.098 2.561 3.877 . 0 0 "[ . 1 . 2]" 1
322 1 19 ARG HA 1 19 ARG QG . . 3.430 2.892 2.488 3.342 . 0 0 "[ . 1 . 2]" 1
323 1 19 ARG HA 1 19 ARG HG3 . . 3.940 3.564 3.129 3.889 . 0 0 "[ . 1 . 2]" 1
324 1 19 ARG QB 1 20 LEU H . . 3.670 3.052 2.387 3.611 . 0 0 "[ . 1 . 2]" 1
325 1 19 ARG HB2 1 20 LEU H . . 4.310 3.326 2.420 4.216 . 0 0 "[ . 1 . 2]" 1
326 1 19 ARG HB3 1 20 LEU H . . 4.310 3.885 3.634 4.072 . 0 0 "[ . 1 . 2]" 1
327 1 19 ARG QG 1 20 LEU H . . 3.840 3.091 2.071 3.849 0.009 8 0 "[ . 1 . 2]" 1
328 1 20 LEU H 1 20 LEU HB2 . . 3.670 2.556 2.167 2.729 . 0 0 "[ . 1 . 2]" 1
329 1 20 LEU H 1 20 LEU HB3 . . 3.670 2.531 2.387 3.481 . 0 0 "[ . 1 . 2]" 1
330 1 20 LEU H 1 20 LEU QD . . 5.180 3.701 3.452 3.776 . 0 0 "[ . 1 . 2]" 1
331 1 20 LEU H 1 21 PHE H . . 4.380 2.498 2.349 2.734 . 0 0 "[ . 1 . 2]" 1
332 1 20 LEU H 1 40 LEU QD . . 5.440 5.373 4.961 5.441 0.001 10 0 "[ . 1 . 2]" 1
333 1 20 LEU HA 1 20 LEU MD1 . . 3.970 2.232 2.077 3.806 . 0 0 "[ . 1 . 2]" 1
334 1 20 LEU HA 1 20 LEU QD . . 3.130 2.134 2.059 2.364 . 0 0 "[ . 1 . 2]" 1
335 1 20 LEU HA 1 20 LEU MD2 . . 3.970 3.753 2.068 3.967 . 0 0 "[ . 1 . 2]" 1
336 1 20 LEU HA 1 20 LEU HG . . 3.280 3.195 2.819 3.272 . 0 0 "[ . 1 . 2]" 1
337 1 20 LEU HA 1 23 ARG H . . 4.090 3.434 3.206 3.587 . 0 0 "[ . 1 . 2]" 1
338 1 20 LEU HA 1 23 ARG HB3 . . 3.640 2.622 2.112 2.989 . 0 0 "[ . 1 . 2]" 1
339 1 20 LEU HA 1 23 ARG QD . . 3.930 3.036 2.733 3.923 . 0 0 "[ . 1 . 2]" 1
340 1 20 LEU HA 1 23 ARG HG2 . . 4.750 4.643 4.125 4.753 0.003 10 0 "[ . 1 . 2]" 1
341 1 20 LEU HA 1 23 ARG QG . . 4.180 4.040 3.409 4.182 0.002 7 0 "[ . 1 . 2]" 1
342 1 20 LEU HA 1 23 ARG HG3 . . 4.750 4.497 3.501 4.752 0.002 2 0 "[ . 1 . 2]" 1
343 1 20 LEU HA 1 24 TYR QD . . 4.260 4.170 3.367 4.263 0.003 3 0 "[ . 1 . 2]" 1
344 1 20 LEU HA 1 24 TYR QE . . 4.540 4.499 4.056 4.553 0.013 18 0 "[ . 1 . 2]" 1
345 1 20 LEU QB 1 21 PHE H . . 4.140 2.778 2.583 2.916 . 0 0 "[ . 1 . 2]" 1
346 1 20 LEU QB 1 24 TYR QD . . 5.340 4.704 2.948 4.896 . 0 0 "[ . 1 . 2]" 1
347 1 20 LEU QB 1 40 LEU QD . . 3.990 3.477 2.393 3.712 . 0 0 "[ . 1 . 2]" 1
348 1 20 LEU QB 1 80 TYR QE . . 3.980 3.100 2.874 3.434 . 0 0 "[ . 1 . 2]" 1
349 1 20 LEU HB2 1 24 TYR QE . . 5.500 5.246 4.883 5.311 . 0 0 "[ . 1 . 2]" 1
350 1 20 LEU HB3 1 24 TYR QE . . 5.500 5.377 3.572 5.510 0.010 15 0 "[ . 1 . 2]" 1
351 1 20 LEU QD 1 23 ARG HB3 . . 5.280 2.600 2.397 3.349 . 0 0 "[ . 1 . 2]" 1
352 1 20 LEU QD 1 23 ARG QD . . 3.740 2.200 1.955 2.793 . 0 0 "[ . 1 . 2]" 1
353 1 20 LEU QD 1 24 TYR QD . . 3.490 2.707 2.386 3.259 . 0 0 "[ . 1 . 2]" 1
354 1 20 LEU QD 1 24 TYR QE . . 2.910 1.898 1.880 1.925 . 0 0 "[ . 1 . 2]" 1
355 1 20 LEU QD 1 32 LEU QD . . 4.640 4.510 4.338 4.642 0.002 2 0 "[ . 1 . 2]" 1
356 1 20 LEU QD 1 40 LEU HA . . 4.190 3.609 3.418 3.756 . 0 0 "[ . 1 . 2]" 1
357 1 20 LEU QD 1 40 LEU QD . . 3.210 2.520 2.176 2.883 . 0 0 "[ . 1 . 2]" 1
358 1 20 LEU QD 1 43 ASP QB . . 3.120 1.970 1.832 2.238 . 0 0 "[ . 1 . 2]" 1
359 1 20 LEU QD 1 44 THR HA . . 4.040 2.360 1.978 2.776 . 0 0 "[ . 1 . 2]" 1
360 1 20 LEU QD 1 44 THR HB . . 5.440 3.778 3.451 4.229 . 0 0 "[ . 1 . 2]" 1
361 1 20 LEU QD 1 47 GLU QG . . 4.310 2.746 2.081 3.590 . 0 0 "[ . 1 . 2]" 1
362 1 20 LEU QD 1 80 TYR QE . . 4.360 3.395 3.029 3.574 . 0 0 "[ . 1 . 2]" 1
363 1 20 LEU MD1 1 24 TYR QD . . 4.580 2.821 2.397 4.316 . 0 0 "[ . 1 . 2]" 1
364 1 20 LEU MD1 1 24 TYR QE . . 3.600 1.981 1.887 3.400 . 0 0 "[ . 1 . 2]" 1
365 1 20 LEU MD1 1 43 ASP HA . . 5.240 4.521 4.246 4.891 . 0 0 "[ . 1 . 2]" 1
366 1 20 LEU MD1 1 43 ASP HB2 . . 4.530 3.043 2.225 4.149 . 0 0 "[ . 1 . 2]" 1
367 1 20 LEU MD1 1 43 ASP HB3 . . 4.530 2.109 1.970 2.604 . 0 0 "[ . 1 . 2]" 1
368 1 20 LEU MD1 1 44 THR HA . . 4.740 4.049 2.689 4.622 . 0 0 "[ . 1 . 2]" 1
369 1 20 LEU MD1 1 80 TYR QE . . 5.240 5.118 3.613 5.250 0.010 17 0 "[ . 1 . 2]" 1
370 1 20 LEU MD2 1 24 TYR QD . . 4.580 4.409 2.545 4.584 0.004 3 0 "[ . 1 . 2]" 1
371 1 20 LEU MD2 1 24 TYR QE . . 3.600 3.510 1.895 3.605 0.005 10 0 "[ . 1 . 2]" 1
372 1 20 LEU MD2 1 43 ASP HA . . 5.240 4.752 4.462 5.194 . 0 0 "[ . 1 . 2]" 1
373 1 20 LEU MD2 1 43 ASP HB2 . . 4.530 4.034 3.076 4.516 . 0 0 "[ . 1 . 2]" 1
374 1 20 LEU MD2 1 43 ASP HB3 . . 4.530 2.803 1.992 3.313 . 0 0 "[ . 1 . 2]" 1
375 1 20 LEU MD2 1 44 THR HA . . 4.740 2.458 1.984 4.339 . 0 0 "[ . 1 . 2]" 1
376 1 20 LEU MD2 1 80 TYR QE . . 5.240 3.519 3.048 5.133 . 0 0 "[ . 1 . 2]" 1
377 1 20 LEU HG 1 24 TYR QD . . 5.110 3.351 2.971 5.113 0.003 2 0 "[ . 1 . 2]" 1
378 1 20 LEU HG 1 24 TYR QE . . 4.620 3.355 2.878 4.626 0.006 2 0 "[ . 1 . 2]" 1
379 1 21 PHE H 1 21 PHE HB2 . . 4.140 2.463 2.374 2.625 . 0 0 "[ . 1 . 2]" 1
380 1 21 PHE H 1 21 PHE HB3 . . 3.990 2.609 2.474 2.696 . 0 0 "[ . 1 . 2]" 1
381 1 21 PHE H 1 21 PHE QD . . 4.390 4.174 4.149 4.192 . 0 0 "[ . 1 . 2]" 1
382 1 21 PHE H 1 22 LYS H . . 4.070 2.829 2.618 2.963 . 0 0 "[ . 1 . 2]" 1
383 1 21 PHE H 1 80 TYR QE . . 4.650 3.736 3.249 4.054 . 0 0 "[ . 1 . 2]" 1
384 1 21 PHE HA 1 21 PHE QD . . 3.800 3.025 2.629 3.124 . 0 0 "[ . 1 . 2]" 1
385 1 21 PHE HA 1 24 TYR QD . . 4.960 4.033 3.789 4.328 . 0 0 "[ . 1 . 2]" 1
386 1 21 PHE HA 1 32 LEU MD1 . . 4.640 2.803 2.392 3.391 . 0 0 "[ . 1 . 2]" 1
387 1 21 PHE HA 1 32 LEU QD . . 4.060 2.652 2.362 2.988 . 0 0 "[ . 1 . 2]" 1
388 1 21 PHE HA 1 32 LEU MD2 . . 4.640 3.440 2.756 3.893 . 0 0 "[ . 1 . 2]" 1
389 1 21 PHE HA 1 40 LEU QD . . 3.240 2.931 2.405 3.240 . 0 0 "[ . 1 . 2]" 1
390 1 21 PHE HA 1 80 TYR QD . . 4.610 4.298 3.955 4.595 . 0 0 "[ . 1 . 2]" 1
391 1 21 PHE HA 1 80 TYR QE . . 4.630 4.043 3.504 4.407 . 0 0 "[ . 1 . 2]" 1
392 1 21 PHE HB2 1 22 LYS H . . 4.330 3.633 3.487 3.816 . 0 0 "[ . 1 . 2]" 1
393 1 21 PHE HB2 1 32 LEU QD . . 4.760 3.817 3.530 4.228 . 0 0 "[ . 1 . 2]" 1
394 1 21 PHE HB2 1 40 LEU QD . . 4.940 4.188 3.467 4.441 . 0 0 "[ . 1 . 2]" 1
395 1 21 PHE HB2 1 77 LEU QD . . 4.040 2.776 2.306 3.525 . 0 0 "[ . 1 . 2]" 1
396 1 21 PHE HB2 1 80 TYR QD . . 3.980 2.677 2.001 3.069 . 0 0 "[ . 1 . 2]" 1
397 1 21 PHE HB2 1 80 TYR QE . . 4.000 3.272 2.423 3.619 . 0 0 "[ . 1 . 2]" 1
398 1 21 PHE HB3 1 22 LYS H . . 3.870 2.230 2.039 2.580 . 0 0 "[ . 1 . 2]" 1
399 1 21 PHE HB3 1 22 LYS QD . . 5.340 4.757 2.508 5.206 . 0 0 "[ . 1 . 2]" 1
400 1 21 PHE HB3 1 22 LYS QG . . 5.340 3.556 2.994 5.019 . 0 0 "[ . 1 . 2]" 1
401 1 21 PHE HB3 1 40 LEU QD . . 5.310 5.120 4.541 5.311 0.001 2 0 "[ . 1 . 2]" 1
402 1 21 PHE HB3 1 77 LEU QD . . 4.400 2.547 2.092 3.437 . 0 0 "[ . 1 . 2]" 1
403 1 21 PHE HB3 1 80 TYR QD . . 4.730 4.290 3.423 4.695 . 0 0 "[ . 1 . 2]" 1
404 1 21 PHE HB3 1 80 TYR QE . . 5.330 4.875 4.043 5.265 . 0 0 "[ . 1 . 2]" 1
405 1 21 PHE QD 1 22 LYS HA . . 3.750 2.930 2.661 3.616 . 0 0 "[ . 1 . 2]" 1
406 1 21 PHE QD 1 22 LYS HB2 . . 4.550 4.392 3.432 4.551 0.001 11 0 "[ . 1 . 2]" 1
407 1 21 PHE QD 1 22 LYS QG . . 3.690 2.823 2.153 3.467 . 0 0 "[ . 1 . 2]" 1
408 1 21 PHE QD 1 25 ASP H . . 5.460 4.457 3.849 5.290 . 0 0 "[ . 1 . 2]" 1
409 1 21 PHE QD 1 25 ASP HB2 . . 4.920 3.322 2.608 4.155 . 0 0 "[ . 1 . 2]" 1
410 1 21 PHE QD 1 30 GLY QA . . 5.340 4.250 3.673 5.139 . 0 0 "[ . 1 . 2]" 1
411 1 21 PHE QD 1 32 LEU MD1 . . 4.360 2.707 2.202 3.225 . 0 0 "[ . 1 . 2]" 1
412 1 21 PHE QD 1 32 LEU QD . . 3.380 2.560 2.059 3.019 . 0 0 "[ . 1 . 2]" 1
413 1 21 PHE QD 1 32 LEU MD2 . . 4.360 3.652 2.097 4.202 . 0 0 "[ . 1 . 2]" 1
414 1 21 PHE QD 1 32 LEU HG . . 4.650 4.004 3.631 4.703 0.053 17 0 "[ . 1 . 2]" 1
415 1 21 PHE QD 1 40 LEU MD1 . . 5.400 4.073 2.511 4.910 . 0 0 "[ . 1 . 2]" 1
416 1 21 PHE QD 1 40 LEU QD . . 4.170 3.672 2.458 4.025 . 0 0 "[ . 1 . 2]" 1
417 1 21 PHE QD 1 40 LEU MD2 . . 5.400 4.390 3.502 5.070 . 0 0 "[ . 1 . 2]" 1
418 1 21 PHE QD 1 75 VAL MG1 . . 4.910 4.264 3.697 4.537 . 0 0 "[ . 1 . 2]" 1
419 1 21 PHE QD 1 77 LEU HA . . 4.320 3.284 2.868 4.025 . 0 0 "[ . 1 . 2]" 1
420 1 21 PHE QD 1 77 LEU MD1 . . 4.830 3.817 2.087 4.456 . 0 0 "[ . 1 . 2]" 1
421 1 21 PHE QD 1 77 LEU QD . . 3.650 2.656 2.007 3.321 . 0 0 "[ . 1 . 2]" 1
422 1 21 PHE QD 1 77 LEU MD2 . . 4.830 3.186 2.010 4.806 . 0 0 "[ . 1 . 2]" 1
423 1 21 PHE QD 1 80 TYR HA . . 5.500 5.222 4.658 5.497 . 0 0 "[ . 1 . 2]" 1
424 1 21 PHE QD 1 80 TYR QB . . 4.390 2.624 2.161 3.057 . 0 0 "[ . 1 . 2]" 1
425 1 21 PHE QD 1 80 TYR QD . . 3.140 2.312 2.000 2.959 . 0 0 "[ . 1 . 2]" 1
426 1 21 PHE QD 1 80 TYR QE . . 3.960 3.809 3.437 3.962 0.002 18 0 "[ . 1 . 2]" 1
427 1 21 PHE QE 1 22 LYS QG . . 5.340 4.301 3.576 4.767 . 0 0 "[ . 1 . 2]" 1
428 1 21 PHE QE 1 25 ASP HB2 . . 5.290 3.266 2.550 4.101 . 0 0 "[ . 1 . 2]" 1
429 1 21 PHE QE 1 25 ASP HB3 . . 4.800 3.824 3.400 4.686 . 0 0 "[ . 1 . 2]" 1
430 1 21 PHE QE 1 30 GLY HA2 . . 4.650 2.458 2.086 3.538 . 0 0 "[ . 1 . 2]" 1
431 1 21 PHE QE 1 30 GLY QA . . 3.970 2.431 2.075 3.435 . 0 0 "[ . 1 . 2]" 1
432 1 21 PHE QE 1 30 GLY HA3 . . 4.650 3.945 3.575 4.653 0.003 17 0 "[ . 1 . 2]" 1
433 1 21 PHE QE 1 31 GLN HA . . 4.010 3.669 3.371 3.991 . 0 0 "[ . 1 . 2]" 1
434 1 21 PHE QE 1 32 LEU H . . 5.330 3.789 3.125 4.438 . 0 0 "[ . 1 . 2]" 1
435 1 21 PHE QE 1 32 LEU QB . . 5.340 3.756 1.979 4.330 . 0 0 "[ . 1 . 2]" 1
436 1 21 PHE QE 1 32 LEU MD1 . . 4.310 2.586 2.320 3.057 . 0 0 "[ . 1 . 2]" 1
437 1 21 PHE QE 1 32 LEU QD . . 3.500 2.479 2.014 2.758 . 0 0 "[ . 1 . 2]" 1
438 1 21 PHE QE 1 32 LEU MD2 . . 4.310 3.581 2.119 4.312 0.002 2 0 "[ . 1 . 2]" 1
439 1 21 PHE QE 1 32 LEU HG . . 4.600 3.133 2.635 4.204 . 0 0 "[ . 1 . 2]" 1
440 1 21 PHE QE 1 40 LEU QD . . 5.440 4.494 3.718 5.022 . 0 0 "[ . 1 . 2]" 1
441 1 21 PHE QE 1 75 VAL MG1 . . 4.180 3.051 2.422 3.805 . 0 0 "[ . 1 . 2]" 1
442 1 21 PHE QE 1 76 SER HA . . 4.250 3.264 2.221 4.017 . 0 0 "[ . 1 . 2]" 1
443 1 21 PHE QE 1 77 LEU H . . 5.500 3.765 3.159 4.242 . 0 0 "[ . 1 . 2]" 1
444 1 21 PHE QE 1 77 LEU HA . . 4.020 3.247 2.851 3.883 . 0 0 "[ . 1 . 2]" 1
445 1 21 PHE QE 1 77 LEU QB . . 5.340 3.971 2.381 4.722 . 0 0 "[ . 1 . 2]" 1
446 1 21 PHE QE 1 77 LEU QD . . 4.500 3.445 3.052 4.054 . 0 0 "[ . 1 . 2]" 1
447 1 21 PHE QE 1 80 TYR QB . . 4.260 2.595 2.375 3.168 . 0 0 "[ . 1 . 2]" 1
448 1 21 PHE HZ 1 30 GLY QA . . 5.100 3.642 2.845 4.484 . 0 0 "[ . 1 . 2]" 1
449 1 21 PHE HZ 1 31 GLN H . . 4.400 3.949 3.561 4.353 . 0 0 "[ . 1 . 2]" 1
450 1 21 PHE HZ 1 31 GLN HA . . 3.670 2.435 1.998 3.026 . 0 0 "[ . 1 . 2]" 1
451 1 21 PHE HZ 1 32 LEU H . . 4.470 3.274 2.484 4.084 . 0 0 "[ . 1 . 2]" 1
452 1 21 PHE HZ 1 32 LEU MD1 . . 5.160 3.697 2.764 4.368 . 0 0 "[ . 1 . 2]" 1
453 1 21 PHE HZ 1 32 LEU QD . . 4.130 3.455 2.724 4.068 . 0 0 "[ . 1 . 2]" 1
454 1 21 PHE HZ 1 32 LEU MD2 . . 5.160 4.246 3.751 5.030 . 0 0 "[ . 1 . 2]" 1
455 1 21 PHE HZ 1 32 LEU HG . . 5.500 3.262 2.628 5.529 0.029 17 0 "[ . 1 . 2]" 1
456 1 21 PHE HZ 1 76 SER HA . . 3.920 2.449 2.000 3.268 . 0 0 "[ . 1 . 2]" 1
457 1 21 PHE HZ 1 76 SER QB . . 5.110 4.345 3.236 4.886 . 0 0 "[ . 1 . 2]" 1
458 1 21 PHE HZ 1 77 LEU H . . 4.340 3.636 3.078 4.234 . 0 0 "[ . 1 . 2]" 1
459 1 21 PHE HZ 1 77 LEU HA . . 4.640 4.219 3.436 4.638 . 0 0 "[ . 1 . 2]" 1
460 1 22 LYS H 1 22 LYS HB2 . . 3.300 2.250 2.102 2.528 . 0 0 "[ . 1 . 2]" 1
461 1 22 LYS H 1 22 LYS QG . . 3.860 2.790 2.120 3.723 . 0 0 "[ . 1 . 2]" 1
462 1 22 LYS HA 1 25 ASP H . . 3.980 2.852 2.694 3.056 . 0 0 "[ . 1 . 2]" 1
463 1 22 LYS HA 1 25 ASP HB2 . . 4.180 3.057 2.561 3.707 . 0 0 "[ . 1 . 2]" 1
464 1 22 LYS HA 1 25 ASP HB3 . . 3.930 2.132 2.004 2.433 . 0 0 "[ . 1 . 2]" 1
465 1 22 LYS HB2 1 22 LYS QE . . 4.870 3.372 2.168 4.469 . 0 0 "[ . 1 . 2]" 1
466 1 22 LYS HB2 1 23 ARG H . . 3.530 3.081 2.955 3.528 . 0 0 "[ . 1 . 2]" 1
467 1 23 ARG H 1 23 ARG HB3 . . 3.010 2.663 2.439 2.976 . 0 0 "[ . 1 . 2]" 1
468 1 23 ARG H 1 23 ARG HG2 . . 4.970 4.467 4.277 4.578 . 0 0 "[ . 1 . 2]" 1
469 1 23 ARG H 1 23 ARG QG . . 4.220 3.922 3.750 3.973 . 0 0 "[ . 1 . 2]" 1
470 1 23 ARG H 1 23 ARG HG3 . . 4.970 4.356 4.071 4.509 . 0 0 "[ . 1 . 2]" 1
471 1 23 ARG HA 1 23 ARG QD . . 4.750 4.060 3.422 4.280 . 0 0 "[ . 1 . 2]" 1
472 1 23 ARG HA 1 23 ARG HG2 . . 4.030 2.954 2.254 3.469 . 0 0 "[ . 1 . 2]" 1
473 1 23 ARG HA 1 23 ARG QG . . 3.400 2.417 2.227 2.569 . 0 0 "[ . 1 . 2]" 1
474 1 23 ARG HA 1 23 ARG HG3 . . 4.030 2.637 2.356 3.472 . 0 0 "[ . 1 . 2]" 1
475 1 23 ARG HB3 1 23 ARG QD . . 3.210 2.382 2.181 2.623 . 0 0 "[ . 1 . 2]" 1
476 1 23 ARG HB3 1 24 TYR H . . 3.600 2.898 2.657 3.004 . 0 0 "[ . 1 . 2]" 1
477 1 23 ARG HB3 1 24 TYR QD . . 4.210 2.923 2.448 3.596 . 0 0 "[ . 1 . 2]" 1
478 1 23 ARG HB3 1 24 TYR QE . . 4.190 3.826 3.376 4.190 0.000 2 0 "[ . 1 . 2]" 1
479 1 23 ARG QD 1 24 TYR QD . . 4.540 3.835 3.270 4.184 . 0 0 "[ . 1 . 2]" 1
480 1 23 ARG QD 1 24 TYR QE . . 3.390 3.191 2.949 3.391 0.001 10 0 "[ . 1 . 2]" 1
481 1 23 ARG QG 1 24 TYR H . . 5.100 3.983 3.421 4.450 . 0 0 "[ . 1 . 2]" 1
482 1 23 ARG QG 1 24 TYR QD . . 4.750 4.043 3.357 4.686 . 0 0 "[ . 1 . 2]" 1
483 1 23 ARG QG 1 24 TYR QE . . 5.220 4.240 3.429 4.818 . 0 0 "[ . 1 . 2]" 1
484 1 24 TYR H 1 24 TYR HB2 . . 3.850 2.399 2.349 2.467 . 0 0 "[ . 1 . 2]" 1
485 1 24 TYR H 1 24 TYR QB . . 3.310 2.368 2.320 2.431 . 0 0 "[ . 1 . 2]" 1
486 1 24 TYR H 1 24 TYR HB3 . . 3.850 3.630 3.592 3.675 . 0 0 "[ . 1 . 2]" 1
487 1 24 TYR H 1 24 TYR QD . . 4.090 2.940 2.679 3.281 . 0 0 "[ . 1 . 2]" 1
488 1 24 TYR H 1 24 TYR QE . . 5.400 5.000 4.785 5.179 . 0 0 "[ . 1 . 2]" 1
489 1 24 TYR H 1 25 ASP H . . 3.420 2.048 1.964 2.187 . 0 0 "[ . 1 . 2]" 1
490 1 24 TYR H 1 32 LEU QD . . 4.500 3.788 3.354 4.129 . 0 0 "[ . 1 . 2]" 1
491 1 24 TYR H 1 40 LEU QD . . 4.650 4.469 4.154 4.646 . 0 0 "[ . 1 . 2]" 1
492 1 24 TYR HA 1 24 TYR QD . . 3.210 2.837 2.454 3.048 . 0 0 "[ . 1 . 2]" 1
493 1 24 TYR HA 1 24 TYR QE . . 4.640 4.529 4.429 4.600 . 0 0 "[ . 1 . 2]" 1
494 1 24 TYR QB 1 25 ASP H . . 4.340 2.848 2.629 3.008 . 0 0 "[ . 1 . 2]" 1
495 1 24 TYR QB 1 32 LEU QD . . 4.340 2.423 2.116 3.232 . 0 0 "[ . 1 . 2]" 1
496 1 24 TYR QB 1 40 LEU H . . 5.160 4.656 3.916 5.013 . 0 0 "[ . 1 . 2]" 1
497 1 24 TYR QB 1 40 LEU QD . . 4.630 3.189 2.742 3.579 . 0 0 "[ . 1 . 2]" 1
498 1 24 TYR QD 1 32 LEU QD . . 4.500 3.729 3.497 4.283 . 0 0 "[ . 1 . 2]" 1
499 1 24 TYR QD 1 39 GLY QA . . 5.120 3.677 2.949 4.201 . 0 0 "[ . 1 . 2]" 1
500 1 24 TYR QD 1 40 LEU HA . . 4.100 3.384 2.705 3.711 . 0 0 "[ . 1 . 2]" 1
501 1 24 TYR QD 1 40 LEU QB . . 4.770 3.647 3.104 3.991 . 0 0 "[ . 1 . 2]" 1
502 1 24 TYR QD 1 40 LEU QD . . 3.560 2.629 2.332 3.023 . 0 0 "[ . 1 . 2]" 1
503 1 24 TYR QE 1 39 GLY QA . . 3.810 2.739 2.277 3.476 . 0 0 "[ . 1 . 2]" 1
504 1 24 TYR QE 1 40 LEU HA . . 3.790 2.811 2.501 3.090 . 0 0 "[ . 1 . 2]" 1
505 1 24 TYR QE 1 40 LEU QB . . 5.340 4.186 3.469 4.533 . 0 0 "[ . 1 . 2]" 1
506 1 24 TYR QE 1 40 LEU QD . . 3.840 3.241 2.833 3.760 . 0 0 "[ . 1 . 2]" 1
507 1 24 TYR QE 1 43 ASP H . . 4.550 3.986 3.603 4.476 . 0 0 "[ . 1 . 2]" 1
508 1 24 TYR QE 1 43 ASP HB2 . . 4.020 2.995 2.095 3.426 . 0 0 "[ . 1 . 2]" 1
509 1 24 TYR QE 1 43 ASP QB . . 3.450 2.451 2.066 3.026 . 0 0 "[ . 1 . 2]" 1
510 1 24 TYR QE 1 43 ASP HB3 . . 4.020 2.802 2.278 4.010 . 0 0 "[ . 1 . 2]" 1
511 1 25 ASP H 1 25 ASP HB2 . . 3.310 2.449 2.337 2.620 . 0 0 "[ . 1 . 2]" 1
512 1 25 ASP H 1 25 ASP HB3 . . 3.330 2.679 2.533 2.808 . 0 0 "[ . 1 . 2]" 1
513 1 25 ASP H 1 32 LEU QD . . 4.110 3.144 2.796 3.528 . 0 0 "[ . 1 . 2]" 1
514 1 25 ASP HA 1 26 LYS H . . 3.210 2.398 2.258 2.578 . 0 0 "[ . 1 . 2]" 1
515 1 25 ASP HA 1 26 LYS QB . . 5.030 4.389 4.238 4.586 . 0 0 "[ . 1 . 2]" 1
516 1 25 ASP HA 1 32 LEU HA . . 5.250 4.869 4.438 5.165 . 0 0 "[ . 1 . 2]" 1
517 1 25 ASP HA 1 32 LEU QD . . 3.380 3.158 2.895 3.372 . 0 0 "[ . 1 . 2]" 1
518 1 25 ASP HB2 1 26 LYS H . . 4.980 4.644 4.618 4.664 . 0 0 "[ . 1 . 2]" 1
519 1 25 ASP HB2 1 32 LEU MD1 . . 4.380 4.134 2.323 4.382 0.002 19 0 "[ . 1 . 2]" 1
520 1 25 ASP HB2 1 32 LEU QD . . 3.580 2.488 1.978 2.847 . 0 0 "[ . 1 . 2]" 1
521 1 25 ASP HB2 1 32 LEU MD2 . . 4.380 2.704 1.982 4.384 0.004 17 0 "[ . 1 . 2]" 1
522 1 25 ASP HB3 1 32 LEU QD . . 4.150 3.898 3.484 4.151 0.001 7 0 "[ . 1 . 2]" 1
523 1 26 LYS H 1 26 LYS QB . . 3.020 2.277 2.169 2.456 . 0 0 "[ . 1 . 2]" 1
524 1 26 LYS H 1 26 LYS HG2 . . 5.370 4.139 2.352 4.677 . 0 0 "[ . 1 . 2]" 1
525 1 26 LYS H 1 26 LYS QG . . 4.580 3.594 2.327 4.085 . 0 0 "[ . 1 . 2]" 1
526 1 26 LYS H 1 26 LYS HG3 . . 5.370 4.043 2.661 4.616 . 0 0 "[ . 1 . 2]" 1
527 1 26 LYS H 1 32 LEU QD . . 5.440 4.852 4.472 5.131 . 0 0 "[ . 1 . 2]" 1
528 1 26 LYS H 1 36 GLU HG2 . . 5.500 4.793 3.706 5.505 0.005 18 0 "[ . 1 . 2]" 1
529 1 26 LYS H 1 36 GLU QG . . 4.820 4.297 3.613 4.751 . 0 0 "[ . 1 . 2]" 1
530 1 26 LYS H 1 36 GLU HG3 . . 5.500 5.160 4.084 5.484 . 0 0 "[ . 1 . 2]" 1
531 1 26 LYS HA 1 26 LYS QD . . 3.630 3.058 2.037 3.630 0.000 15 0 "[ . 1 . 2]" 1
532 1 26 LYS HA 1 26 LYS HG2 . . 3.980 3.185 2.211 3.718 . 0 0 "[ . 1 . 2]" 1
533 1 26 LYS HA 1 26 LYS HG3 . . 3.980 2.824 2.185 3.788 . 0 0 "[ . 1 . 2]" 1
534 1 26 LYS QB 1 27 ASP H . . 3.390 2.916 2.769 3.395 0.005 18 0 "[ . 1 . 2]" 1
535 1 26 LYS QB 1 27 ASP HA . . 5.270 4.023 3.921 4.269 . 0 0 "[ . 1 . 2]" 1
536 1 26 LYS HG2 1 27 ASP H . . 5.500 4.878 4.314 5.481 . 0 0 "[ . 1 . 2]" 1
537 1 26 LYS HG3 1 27 ASP H . . 5.500 4.782 4.394 5.291 . 0 0 "[ . 1 . 2]" 1
538 1 27 ASP H 1 27 ASP QB . . 3.500 2.302 2.185 2.679 . 0 0 "[ . 1 . 2]" 1
539 1 27 ASP H 1 28 GLY H . . 3.920 2.554 2.476 2.569 . 0 0 "[ . 1 . 2]" 1
540 1 27 ASP H 1 28 GLY QA . . 4.880 4.433 4.363 4.453 . 0 0 "[ . 1 . 2]" 1
541 1 29 SER H 1 29 SER QB . . 3.470 2.514 2.226 2.822 . 0 0 "[ . 1 . 2]" 1
542 1 29 SER H 1 30 GLY H . . 3.600 2.385 2.026 2.518 . 0 0 "[ . 1 . 2]" 1
543 1 29 SER H 1 31 GLN H . . 4.560 3.871 3.652 4.068 . 0 0 "[ . 1 . 2]" 1
544 1 29 SER HA 1 29 SER QB . . 2.580 2.265 2.182 2.473 . 0 0 "[ . 1 . 2]" 1
545 1 30 GLY H 1 31 GLN H . . 3.450 2.417 2.315 2.688 . 0 0 "[ . 1 . 2]" 1
546 1 30 GLY QA 1 31 GLN HA . . 4.910 4.011 4.002 4.039 . 0 0 "[ . 1 . 2]" 1
547 1 31 GLN H 1 31 GLN QG . . 4.260 3.701 1.941 4.060 . 0 0 "[ . 1 . 2]" 1
548 1 31 GLN HA 1 31 GLN QG . . 3.720 2.343 2.161 3.422 . 0 0 "[ . 1 . 2]" 1
549 1 31 GLN HA 1 32 LEU H . . 3.420 2.214 2.161 2.482 . 0 0 "[ . 1 . 2]" 1
550 1 31 GLN HA 1 32 LEU HA . . 4.740 4.379 4.360 4.405 . 0 0 "[ . 1 . 2]" 1
551 1 31 GLN HA 1 74 SER HB2 . . 4.860 4.319 3.385 4.861 0.001 19 0 "[ . 1 . 2]" 1
552 1 31 GLN HA 1 74 SER QB . . 4.250 3.768 3.307 4.263 0.013 17 0 "[ . 1 . 2]" 1
553 1 31 GLN HA 1 74 SER HB3 . . 4.860 4.365 3.405 4.868 0.008 16 0 "[ . 1 . 2]" 1
554 1 31 GLN HA 1 76 SER HA . . 3.340 2.688 1.989 3.022 . 0 0 "[ . 1 . 2]" 1
555 1 31 GLN HA 1 76 SER QB . . 4.460 4.163 3.518 4.460 0.000 7 0 "[ . 1 . 2]" 1
556 1 31 GLN HB3 1 32 LEU H . . 3.780 3.184 2.775 3.661 . 0 0 "[ . 1 . 2]" 1
557 1 31 GLN HB3 1 74 SER HA . . 4.440 3.989 3.027 4.479 0.039 17 0 "[ . 1 . 2]" 1
558 1 31 GLN HB3 1 74 SER HB2 . . 3.820 2.820 2.032 3.646 . 0 0 "[ . 1 . 2]" 1
559 1 31 GLN HB3 1 74 SER QB . . 3.190 2.170 1.940 2.731 . 0 0 "[ . 1 . 2]" 1
560 1 31 GLN HB3 1 74 SER HB3 . . 3.820 2.414 2.022 3.529 . 0 0 "[ . 1 . 2]" 1
561 1 31 GLN HB3 1 75 VAL H . . 5.000 3.908 2.630 4.567 . 0 0 "[ . 1 . 2]" 1
562 1 31 GLN HB3 1 76 SER HA . . 5.170 4.726 2.307 5.173 0.003 18 0 "[ . 1 . 2]" 1
563 1 31 GLN QG 1 32 LEU H . . 5.340 3.697 3.361 4.442 . 0 0 "[ . 1 . 2]" 1
564 1 31 GLN QG 1 74 SER QB . . 3.540 2.138 1.928 2.447 . 0 0 "[ . 1 . 2]" 1
565 1 31 GLN QG 1 76 SER HA . . 4.160 3.147 2.561 4.231 0.071 17 0 "[ . 1 . 2]" 1
566 1 31 GLN HG2 1 74 SER HA . . 5.500 4.712 3.871 5.485 . 0 0 "[ . 1 . 2]" 1
567 1 31 GLN HG2 1 74 SER HB2 . . 4.670 2.415 2.002 3.772 . 0 0 "[ . 1 . 2]" 1
568 1 31 GLN HG2 1 74 SER HB3 . . 4.670 3.016 2.030 3.439 . 0 0 "[ . 1 . 2]" 1
569 1 31 GLN HG3 1 74 SER HA . . 5.500 5.321 4.349 5.502 0.002 7 0 "[ . 1 . 2]" 1
570 1 31 GLN HG3 1 74 SER HB2 . . 4.670 3.276 2.206 4.182 . 0 0 "[ . 1 . 2]" 1
571 1 31 GLN HG3 1 74 SER HB3 . . 4.670 3.851 2.224 4.667 . 0 0 "[ . 1 . 2]" 1
572 1 32 LEU H 1 32 LEU HG . . 4.820 2.935 2.515 4.693 . 0 0 "[ . 1 . 2]" 1
573 1 32 LEU H 1 74 SER QB . . 4.490 3.644 2.499 4.242 . 0 0 "[ . 1 . 2]" 1
574 1 32 LEU H 1 75 VAL H . . 4.350 2.504 1.955 3.239 . 0 0 "[ . 1 . 2]" 1
575 1 32 LEU H 1 75 VAL HB . . 5.500 3.377 2.654 3.728 . 0 0 "[ . 1 . 2]" 1
576 1 32 LEU HA 1 32 LEU MD1 . . 4.090 3.736 2.129 3.963 . 0 0 "[ . 1 . 2]" 1
577 1 32 LEU HA 1 32 LEU QD . . 3.130 2.140 1.974 2.329 . 0 0 "[ . 1 . 2]" 1
578 1 32 LEU HA 1 32 LEU MD2 . . 4.090 2.312 1.980 3.779 . 0 0 "[ . 1 . 2]" 1
579 1 32 LEU HA 1 32 LEU HG . . 4.230 2.951 2.650 3.204 . 0 0 "[ . 1 . 2]" 1
580 1 32 LEU HA 1 33 GLN H . . 3.400 2.165 2.140 2.182 . 0 0 "[ . 1 . 2]" 1
581 1 32 LEU HA 1 33 GLN QG . . 5.180 4.205 3.820 5.166 . 0 0 "[ . 1 . 2]" 1
582 1 32 LEU HA 1 36 GLU HA . . 5.330 5.282 5.119 5.331 0.001 20 0 "[ . 1 . 2]" 1
583 1 32 LEU HA 1 36 GLU QB . . 4.020 2.400 2.214 2.484 . 0 0 "[ . 1 . 2]" 1
584 1 32 LEU HA 1 36 GLU HG2 . . 5.500 3.857 3.129 4.538 . 0 0 "[ . 1 . 2]" 1
585 1 32 LEU HA 1 36 GLU HG3 . . 5.500 4.098 2.852 4.773 . 0 0 "[ . 1 . 2]" 1
586 1 32 LEU HA 1 37 ILE MD . . 4.930 4.715 4.398 4.819 . 0 0 "[ . 1 . 2]" 1
587 1 32 LEU HA 1 75 VAL HB . . 5.500 5.299 4.577 5.503 0.003 6 0 "[ . 1 . 2]" 1
588 1 32 LEU QB 1 37 ILE MD . . 4.180 3.091 2.681 3.369 . 0 0 "[ . 1 . 2]" 1
589 1 32 LEU QB 1 37 ILE HG12 . . 5.010 2.624 2.278 2.894 . 0 0 "[ . 1 . 2]" 1
590 1 32 LEU QB 1 37 ILE HG13 . . 4.860 2.231 2.020 2.408 . 0 0 "[ . 1 . 2]" 1
591 1 32 LEU QB 1 40 LEU QD . . 5.180 3.372 3.104 3.742 . 0 0 "[ . 1 . 2]" 1
592 1 32 LEU QB 1 75 VAL H . . 5.340 3.221 2.790 3.664 . 0 0 "[ . 1 . 2]" 1
593 1 32 LEU QB 1 75 VAL HA . . 5.180 4.985 4.565 5.187 0.007 16 0 "[ . 1 . 2]" 1
594 1 32 LEU QB 1 75 VAL HB . . 5.070 2.545 2.160 2.733 . 0 0 "[ . 1 . 2]" 1
595 1 32 LEU QB 1 75 VAL MG1 . . 4.230 3.878 3.238 4.109 . 0 0 "[ . 1 . 2]" 1
596 1 32 LEU HB2 1 37 ILE HA . . 5.310 4.587 3.873 5.249 . 0 0 "[ . 1 . 2]" 1
597 1 32 LEU HB2 1 37 ILE MD . . 4.820 3.480 2.824 4.189 . 0 0 "[ . 1 . 2]" 1
598 1 32 LEU HB3 1 37 ILE HA . . 5.310 3.455 3.111 3.900 . 0 0 "[ . 1 . 2]" 1
599 1 32 LEU HB3 1 37 ILE MD . . 4.820 3.569 2.827 3.900 . 0 0 "[ . 1 . 2]" 1
600 1 32 LEU QD 1 33 GLN H . . 4.160 3.758 3.520 4.012 . 0 0 "[ . 1 . 2]" 1
601 1 32 LEU QD 1 36 GLU H . . 5.280 4.718 4.364 5.051 . 0 0 "[ . 1 . 2]" 1
602 1 32 LEU QD 1 36 GLU HA . . 4.500 4.071 3.731 4.503 0.003 17 0 "[ . 1 . 2]" 1
603 1 32 LEU QD 1 36 GLU QB . . 3.540 2.015 1.838 2.368 . 0 0 "[ . 1 . 2]" 1
604 1 32 LEU QD 1 36 GLU QG . . 4.370 2.926 2.546 3.442 . 0 0 "[ . 1 . 2]" 1
605 1 32 LEU QD 1 37 ILE HA . . 3.810 3.237 2.593 3.562 . 0 0 "[ . 1 . 2]" 1
606 1 32 LEU QD 1 37 ILE MD . . 4.260 4.029 3.720 4.237 . 0 0 "[ . 1 . 2]" 1
607 1 32 LEU QD 1 40 LEU QD . . 3.200 1.885 1.702 2.120 . 0 0 "[ . 1 . 2]" 1
608 1 32 LEU QD 1 40 LEU HG . . 4.410 4.084 3.650 4.403 . 0 0 "[ . 1 . 2]" 1
609 1 32 LEU QD 1 63 TRP HH2 . . 4.320 3.672 3.166 3.917 . 0 0 "[ . 1 . 2]" 1
610 1 32 LEU QD 1 63 TRP HZ2 . . 5.440 5.319 4.702 5.442 0.002 13 0 "[ . 1 . 2]" 1
611 1 32 LEU QD 1 63 TRP HZ3 . . 4.530 4.098 3.704 4.511 . 0 0 "[ . 1 . 2]" 1
612 1 32 LEU QD 1 75 VAL HA . . 5.440 5.267 4.967 5.465 0.025 17 0 "[ . 1 . 2]" 1
613 1 32 LEU QD 1 75 VAL HB . . 4.120 3.019 2.641 3.371 . 0 0 "[ . 1 . 2]" 1
614 1 32 LEU QD 1 75 VAL MG1 . . 3.810 3.337 3.113 3.491 . 0 0 "[ . 1 . 2]" 1
615 1 32 LEU QD 1 75 VAL MG2 . . 4.590 3.948 3.577 4.368 . 0 0 "[ . 1 . 2]" 1
616 1 32 LEU QD 1 80 TYR QD . . 4.750 3.661 3.449 3.973 . 0 0 "[ . 1 . 2]" 1
617 1 32 LEU QD 1 80 TYR QE . . 4.380 4.084 3.760 4.358 . 0 0 "[ . 1 . 2]" 1
618 1 32 LEU MD1 1 37 ILE HA . . 4.410 3.643 2.877 4.438 0.028 17 0 "[ . 1 . 2]" 1
619 1 32 LEU MD1 1 37 ILE MD . . 5.120 4.362 3.884 5.097 . 0 0 "[ . 1 . 2]" 1
620 1 32 LEU MD2 1 37 ILE HA . . 4.410 3.871 2.610 4.411 0.001 14 0 "[ . 1 . 2]" 1
621 1 32 LEU MD2 1 37 ILE MD . . 5.120 4.867 4.010 5.119 . 0 0 "[ . 1 . 2]" 1
622 1 33 GLN H 1 33 GLN QB . . 3.640 2.334 2.176 2.519 . 0 0 "[ . 1 . 2]" 1
623 1 33 GLN H 1 36 GLU QB . . 4.100 2.248 1.940 2.559 . 0 0 "[ . 1 . 2]" 1
624 1 33 GLN H 1 37 ILE HG13 . . 4.370 4.154 3.736 4.370 0.000 15 0 "[ . 1 . 2]" 1
625 1 33 GLN HA 1 33 GLN HG2 . . 3.650 2.500 2.201 3.574 . 0 0 "[ . 1 . 2]" 1
626 1 33 GLN HA 1 33 GLN HG3 . . 3.650 3.153 2.290 3.651 0.001 18 0 "[ . 1 . 2]" 1
627 1 33 GLN HA 1 34 ASP H . . 3.040 2.526 2.481 2.589 . 0 0 "[ . 1 . 2]" 1
628 1 33 GLN HA 1 37 ILE MD . . 3.700 3.279 3.067 3.583 . 0 0 "[ . 1 . 2]" 1
629 1 33 GLN HA 1 64 LEU MD1 . . 5.380 3.587 2.599 4.905 . 0 0 "[ . 1 . 2]" 1
630 1 33 GLN HA 1 64 LEU QD . . 4.360 3.405 2.584 4.242 . 0 0 "[ . 1 . 2]" 1
631 1 33 GLN HA 1 64 LEU MD2 . . 5.380 4.871 3.724 5.336 . 0 0 "[ . 1 . 2]" 1
632 1 33 GLN HA 1 74 SER HA . . 3.880 3.206 2.786 3.483 . 0 0 "[ . 1 . 2]" 1
633 1 33 GLN HA 1 74 SER HB2 . . 5.370 5.341 5.106 5.374 0.004 16 0 "[ . 1 . 2]" 1
634 1 33 GLN HA 1 74 SER QB . . 4.490 3.867 3.545 4.119 . 0 0 "[ . 1 . 2]" 1
635 1 33 GLN HA 1 74 SER HB3 . . 5.370 3.974 3.616 4.277 . 0 0 "[ . 1 . 2]" 1
636 1 33 GLN QB 1 34 ASP H . . 3.300 2.156 2.031 2.227 . 0 0 "[ . 1 . 2]" 1
637 1 33 GLN QB 1 35 ASP H . . 3.990 2.510 2.370 2.575 . 0 0 "[ . 1 . 2]" 1
638 1 33 GLN QB 1 36 GLU H . . 3.990 2.811 2.586 2.981 . 0 0 "[ . 1 . 2]" 1
639 1 33 GLN QB 1 74 SER HA . . 5.340 5.164 4.759 5.344 0.004 18 0 "[ . 1 . 2]" 1
640 1 33 GLN HB2 1 34 ASP H . . 3.830 3.490 3.207 3.681 . 0 0 "[ . 1 . 2]" 1
641 1 33 GLN HB3 1 34 ASP H . . 3.830 2.177 2.044 2.249 . 0 0 "[ . 1 . 2]" 1
642 1 33 GLN QG 1 34 ASP H . . 4.230 3.710 3.267 4.003 . 0 0 "[ . 1 . 2]" 1
643 1 33 GLN QG 1 37 ILE MD . . 5.340 4.938 4.646 5.197 . 0 0 "[ . 1 . 2]" 1
644 1 33 GLN QG 1 74 SER HA . . 4.340 4.160 3.519 4.331 . 0 0 "[ . 1 . 2]" 1
645 1 33 GLN QG 1 74 SER QB . . 4.050 3.583 2.811 4.038 . 0 0 "[ . 1 . 2]" 1
646 1 34 ASP H 1 34 ASP QB . . 3.240 2.404 2.181 2.681 . 0 0 "[ . 1 . 2]" 1
647 1 34 ASP H 1 37 ILE MD . . 3.840 3.470 3.182 3.708 . 0 0 "[ . 1 . 2]" 1
648 1 34 ASP HA 1 34 ASP QB . . 2.630 2.257 2.174 2.459 . 0 0 "[ . 1 . 2]" 1
649 1 34 ASP HA 1 37 ILE MD . . 2.990 2.274 1.971 2.650 . 0 0 "[ . 1 . 2]" 1
650 1 34 ASP HA 1 37 ILE HG13 . . 5.040 3.961 3.734 4.246 . 0 0 "[ . 1 . 2]" 1
651 1 34 ASP HA 1 37 ILE MG . . 4.490 4.167 4.000 4.403 . 0 0 "[ . 1 . 2]" 1
652 1 34 ASP HA 1 38 ALA MB . . 5.360 4.951 4.475 5.360 0.000 4 0 "[ . 1 . 2]" 1
653 1 34 ASP HA 1 60 VAL MG1 . . 2.910 2.474 1.966 2.910 0.000 16 0 "[ . 1 . 2]" 1
654 1 34 ASP HA 1 64 LEU QD . . 3.720 2.758 2.111 3.675 . 0 0 "[ . 1 . 2]" 1
655 1 34 ASP QB 1 60 VAL MG1 . . 3.790 3.092 2.593 3.669 . 0 0 "[ . 1 . 2]" 1
656 1 34 ASP QB 1 64 LEU QD . . 3.900 3.186 2.625 3.880 . 0 0 "[ . 1 . 2]" 1
657 1 35 ASP H 1 35 ASP QB . . 3.020 2.368 2.168 2.709 . 0 0 "[ . 1 . 2]" 1
658 1 35 ASP H 1 36 GLU H . . 3.510 2.536 2.400 2.659 . 0 0 "[ . 1 . 2]" 1
659 1 35 ASP HA 1 35 ASP QB . . 2.560 2.367 2.174 2.489 . 0 0 "[ . 1 . 2]" 1
660 1 35 ASP HA 1 38 ALA H . . 4.060 3.493 3.256 3.770 . 0 0 "[ . 1 . 2]" 1
661 1 35 ASP HA 1 38 ALA MB . . 3.280 2.732 2.521 3.128 . 0 0 "[ . 1 . 2]" 1
662 1 35 ASP QB 1 36 GLU H . . 4.470 2.511 2.234 3.488 . 0 0 "[ . 1 . 2]" 1
663 1 35 ASP QB 1 38 ALA MB . . 4.660 4.231 3.837 4.554 . 0 0 "[ . 1 . 2]" 1
664 1 36 GLU H 1 36 GLU QG . . 3.170 2.809 2.004 3.168 . 0 0 "[ . 1 . 2]" 1
665 1 36 GLU H 1 37 ILE H . . 4.250 2.657 2.324 2.880 . 0 0 "[ . 1 . 2]" 1
666 1 36 GLU HA 1 36 GLU HG2 . . 3.850 3.034 2.368 3.574 . 0 0 "[ . 1 . 2]" 1
667 1 36 GLU HA 1 36 GLU QG . . 3.320 2.425 2.192 3.118 . 0 0 "[ . 1 . 2]" 1
668 1 36 GLU HA 1 36 GLU HG3 . . 3.850 2.769 2.264 3.811 . 0 0 "[ . 1 . 2]" 1
669 1 37 ILE H 1 37 ILE MD . . 4.500 3.236 3.074 3.409 . 0 0 "[ . 1 . 2]" 1
670 1 37 ILE H 1 37 ILE HG12 . . 4.290 3.643 3.418 3.773 . 0 0 "[ . 1 . 2]" 1
671 1 37 ILE H 1 37 ILE HG13 . . 4.270 2.179 1.953 2.339 . 0 0 "[ . 1 . 2]" 1
672 1 37 ILE H 1 37 ILE MG . . 4.520 3.767 3.763 3.773 . 0 0 "[ . 1 . 2]" 1
673 1 37 ILE H 1 60 VAL MG1 . . 5.130 3.872 3.571 4.297 . 0 0 "[ . 1 . 2]" 1
674 1 37 ILE HA 1 37 ILE MD . . 3.890 3.882 3.878 3.884 . 0 0 "[ . 1 . 2]" 1
675 1 37 ILE HA 1 37 ILE HG12 . . 4.250 2.755 2.691 2.819 . 0 0 "[ . 1 . 2]" 1
676 1 37 ILE HA 1 37 ILE MG . . 3.570 2.389 2.349 2.400 . 0 0 "[ . 1 . 2]" 1
677 1 37 ILE HA 1 40 LEU HB2 . . 4.050 2.800 2.556 3.216 . 0 0 "[ . 1 . 2]" 1
678 1 37 ILE HA 1 40 LEU QB . . 3.540 2.080 1.939 2.253 . 0 0 "[ . 1 . 2]" 1
679 1 37 ILE HA 1 40 LEU HB3 . . 4.050 2.157 2.000 2.400 . 0 0 "[ . 1 . 2]" 1
680 1 37 ILE HA 1 40 LEU MD1 . . 4.970 4.133 3.711 4.630 . 0 0 "[ . 1 . 2]" 1
681 1 37 ILE HA 1 40 LEU QD . . 4.100 2.603 2.423 2.799 . 0 0 "[ . 1 . 2]" 1
682 1 37 ILE HA 1 40 LEU MD2 . . 4.970 2.635 2.434 2.841 . 0 0 "[ . 1 . 2]" 1
683 1 37 ILE HA 1 40 LEU HG . . 4.840 4.558 3.944 4.842 0.002 17 0 "[ . 1 . 2]" 1
684 1 37 ILE HA 1 41 LEU QD . . 4.810 4.144 3.999 4.291 . 0 0 "[ . 1 . 2]" 1
685 1 37 ILE HA 1 41 LEU HG . . 5.500 4.201 3.949 4.486 . 0 0 "[ . 1 . 2]" 1
686 1 37 ILE HA 1 60 VAL MG2 . . 5.360 5.268 5.044 5.361 0.001 12 0 "[ . 1 . 2]" 1
687 1 37 ILE HB 1 37 ILE MD . . 3.630 2.272 2.124 2.361 . 0 0 "[ . 1 . 2]" 1
688 1 37 ILE HB 1 38 ALA H . . 3.760 2.792 2.571 2.990 . 0 0 "[ . 1 . 2]" 1
689 1 37 ILE HB 1 38 ALA HA . . 5.140 4.224 4.187 4.258 . 0 0 "[ . 1 . 2]" 1
690 1 37 ILE HB 1 41 LEU QD . . 5.070 4.288 3.744 4.677 . 0 0 "[ . 1 . 2]" 1
691 1 37 ILE HB 1 60 VAL MG1 . . 3.540 2.038 1.893 2.275 . 0 0 "[ . 1 . 2]" 1
692 1 37 ILE HB 1 60 VAL MG2 . . 4.610 3.723 3.326 4.124 . 0 0 "[ . 1 . 2]" 1
693 1 37 ILE HB 1 64 LEU QD . . 5.200 3.986 3.703 4.286 . 0 0 "[ . 1 . 2]" 1
694 1 37 ILE MD 1 37 ILE MG . . 3.220 2.212 2.042 2.394 . 0 0 "[ . 1 . 2]" 1
695 1 37 ILE MD 1 40 LEU QD . . 5.440 4.241 3.940 4.567 . 0 0 "[ . 1 . 2]" 1
696 1 37 ILE MD 1 41 LEU QD . . 5.440 4.465 4.063 4.826 . 0 0 "[ . 1 . 2]" 1
697 1 37 ILE MD 1 63 TRP HE3 . . 3.860 3.032 2.418 3.536 . 0 0 "[ . 1 . 2]" 1
698 1 37 ILE MD 1 63 TRP HZ3 . . 3.810 2.774 2.205 3.361 . 0 0 "[ . 1 . 2]" 1
699 1 37 ILE MD 1 64 LEU H . . 4.740 4.322 3.801 4.676 . 0 0 "[ . 1 . 2]" 1
700 1 37 ILE MD 1 64 LEU HA . . 3.720 3.335 2.809 3.701 . 0 0 "[ . 1 . 2]" 1
701 1 37 ILE MD 1 64 LEU QB . . 3.840 2.601 1.958 3.272 . 0 0 "[ . 1 . 2]" 1
702 1 37 ILE MD 1 64 LEU HG . . 4.350 2.430 1.915 4.204 . 0 0 "[ . 1 . 2]" 1
703 1 37 ILE MD 1 74 SER HA . . 4.660 3.676 2.964 4.245 . 0 0 "[ . 1 . 2]" 1
704 1 37 ILE MD 1 75 VAL HB . . 4.270 3.588 3.103 4.015 . 0 0 "[ . 1 . 2]" 1
705 1 37 ILE HG13 1 63 TRP HZ3 . . 4.820 4.182 3.870 4.596 . 0 0 "[ . 1 . 2]" 1
706 1 37 ILE MG 1 38 ALA H . . 4.180 3.564 3.392 3.707 . 0 0 "[ . 1 . 2]" 1
707 1 37 ILE MG 1 38 ALA HA . . 4.520 3.539 3.412 3.656 . 0 0 "[ . 1 . 2]" 1
708 1 37 ILE MG 1 38 ALA MB . . 5.020 4.356 4.194 4.490 . 0 0 "[ . 1 . 2]" 1
709 1 37 ILE MG 1 40 LEU QB . . 4.390 2.897 2.595 3.286 . 0 0 "[ . 1 . 2]" 1
710 1 37 ILE MG 1 40 LEU QD . . 4.050 2.472 2.084 3.162 . 0 0 "[ . 1 . 2]" 1
711 1 37 ILE MG 1 41 LEU H . . 4.330 3.430 3.041 3.915 . 0 0 "[ . 1 . 2]" 1
712 1 37 ILE MG 1 41 LEU HB2 . . 5.470 4.391 3.934 5.042 . 0 0 "[ . 1 . 2]" 1
713 1 37 ILE MG 1 41 LEU QB . . 4.640 4.084 3.674 4.642 0.002 6 0 "[ . 1 . 2]" 1
714 1 37 ILE MG 1 41 LEU HB3 . . 5.470 4.867 4.404 5.429 . 0 0 "[ . 1 . 2]" 1
715 1 37 ILE MG 1 41 LEU MD1 . . 4.150 2.668 1.888 3.141 . 0 0 "[ . 1 . 2]" 1
716 1 37 ILE MG 1 41 LEU QD . . 3.480 2.312 1.876 2.611 . 0 0 "[ . 1 . 2]" 1
717 1 37 ILE MG 1 41 LEU MD2 . . 4.150 2.618 2.331 3.267 . 0 0 "[ . 1 . 2]" 1
718 1 37 ILE MG 1 41 LEU HG . . 4.470 2.415 1.941 3.028 . 0 0 "[ . 1 . 2]" 1
719 1 37 ILE MG 1 60 VAL HA . . 3.920 3.508 3.295 3.706 . 0 0 "[ . 1 . 2]" 1
720 1 37 ILE MG 1 60 VAL HB . . 5.140 4.478 4.269 4.771 . 0 0 "[ . 1 . 2]" 1
721 1 37 ILE MG 1 60 VAL MG1 . . 3.010 2.018 1.847 2.309 . 0 0 "[ . 1 . 2]" 1
722 1 37 ILE MG 1 60 VAL MG2 . . 3.390 3.065 2.819 3.276 . 0 0 "[ . 1 . 2]" 1
723 1 37 ILE MG 1 63 TRP HB2 . . 4.790 4.594 4.218 4.789 . 0 0 "[ . 1 . 2]" 1
724 1 37 ILE MG 1 63 TRP HB3 . . 4.630 3.329 3.002 3.518 . 0 0 "[ . 1 . 2]" 1
725 1 37 ILE MG 1 63 TRP HE3 . . 3.560 2.175 1.943 2.422 . 0 0 "[ . 1 . 2]" 1
726 1 37 ILE MG 1 63 TRP HZ3 . . 4.180 2.556 2.138 3.088 . 0 0 "[ . 1 . 2]" 1
727 1 37 ILE MG 1 64 LEU H . . 4.920 4.322 3.920 4.615 . 0 0 "[ . 1 . 2]" 1
728 1 37 ILE MG 1 64 LEU HG . . 5.500 4.409 3.755 5.501 0.001 20 0 "[ . 1 . 2]" 1
729 1 37 ILE MG 1 75 VAL HB . . 5.500 5.072 4.329 5.389 . 0 0 "[ . 1 . 2]" 1
730 1 37 ILE MG 1 80 TYR QE . . 5.500 5.257 4.762 5.496 . 0 0 "[ . 1 . 2]" 1
731 1 38 ALA H 1 38 ALA MB . . 3.030 2.103 2.030 2.186 . 0 0 "[ . 1 . 2]" 1
732 1 38 ALA H 1 39 GLY H . . 4.160 2.872 2.823 2.975 . 0 0 "[ . 1 . 2]" 1
733 1 38 ALA H 1 41 LEU QD . . 5.440 4.808 4.010 5.042 . 0 0 "[ . 1 . 2]" 1
734 1 38 ALA H 1 60 VAL MG1 . . 4.120 3.020 2.563 3.291 . 0 0 "[ . 1 . 2]" 1
735 1 38 ALA H 1 60 VAL MG2 . . 4.250 3.534 3.304 3.678 . 0 0 "[ . 1 . 2]" 1
736 1 38 ALA HA 1 40 LEU QB . . 5.340 5.029 4.773 5.148 . 0 0 "[ . 1 . 2]" 1
737 1 38 ALA HA 1 41 LEU QB . . 4.400 4.143 3.514 4.403 0.003 13 0 "[ . 1 . 2]" 1
738 1 38 ALA HA 1 41 LEU MD1 . . 5.500 3.376 2.575 3.732 . 0 0 "[ . 1 . 2]" 1
739 1 38 ALA HA 1 41 LEU QD . . 4.040 3.330 2.569 3.658 . 0 0 "[ . 1 . 2]" 1
740 1 38 ALA HA 1 41 LEU MD2 . . 5.500 5.171 4.859 5.420 . 0 0 "[ . 1 . 2]" 1
741 1 38 ALA HA 1 41 LEU HG . . 4.880 3.843 3.513 4.648 . 0 0 "[ . 1 . 2]" 1
742 1 38 ALA HA 1 55 PRO HB2 . . 5.500 5.277 4.980 5.505 0.005 17 0 "[ . 1 . 2]" 1
743 1 38 ALA HA 1 55 PRO HG2 . . 4.650 3.702 3.370 3.918 . 0 0 "[ . 1 . 2]" 1
744 1 38 ALA HA 1 55 PRO HG3 . . 5.150 4.997 4.732 5.151 0.001 6 0 "[ . 1 . 2]" 1
745 1 38 ALA HA 1 60 VAL MG1 . . 4.120 3.133 2.316 3.843 . 0 0 "[ . 1 . 2]" 1
746 1 38 ALA HA 1 60 VAL MG2 . . 3.480 2.104 1.936 2.638 . 0 0 "[ . 1 . 2]" 1
747 1 38 ALA MB 1 39 GLY H . . 3.830 2.452 2.199 2.605 . 0 0 "[ . 1 . 2]" 1
748 1 38 ALA MB 1 41 LEU QD . . 5.410 4.425 3.893 4.648 . 0 0 "[ . 1 . 2]" 1
749 1 38 ALA MB 1 55 PRO HG2 . . 4.330 4.308 4.194 4.333 0.003 16 0 "[ . 1 . 2]" 1
750 1 38 ALA MB 1 57 LYS HA . . 5.490 4.370 3.873 4.970 . 0 0 "[ . 1 . 2]" 1
751 1 38 ALA MB 1 60 VAL MG1 . . 3.730 3.363 2.895 3.733 0.003 17 0 "[ . 1 . 2]" 1
752 1 38 ALA MB 1 60 VAL MG2 . . 3.170 2.651 2.347 3.011 . 0 0 "[ . 1 . 2]" 1
753 1 39 GLY H 1 40 LEU H . . 3.990 2.422 2.386 2.577 . 0 0 "[ . 1 . 2]" 1
754 1 39 GLY QA 1 42 LYS H . . 4.190 3.371 3.216 3.530 . 0 0 "[ . 1 . 2]" 1
755 1 39 GLY QA 1 42 LYS QB . . 3.410 2.542 2.420 2.831 . 0 0 "[ . 1 . 2]" 1
756 1 39 GLY QA 1 42 LYS QD . . 4.670 3.302 2.379 4.643 . 0 0 "[ . 1 . 2]" 1
757 1 39 GLY QA 1 43 ASP H . . 5.280 4.560 4.435 4.709 . 0 0 "[ . 1 . 2]" 1
758 1 40 LEU H 1 40 LEU MD1 . . 4.640 4.182 4.116 4.321 . 0 0 "[ . 1 . 2]" 1
759 1 40 LEU H 1 40 LEU MD2 . . 4.640 4.125 3.889 4.179 . 0 0 "[ . 1 . 2]" 1
760 1 40 LEU H 1 41 LEU H . . 4.170 2.812 2.591 2.923 . 0 0 "[ . 1 . 2]" 1
761 1 40 LEU H 1 41 LEU QD . . 5.020 4.556 4.335 4.736 . 0 0 "[ . 1 . 2]" 1
762 1 40 LEU HA 1 40 LEU MD1 . . 3.970 2.585 2.214 3.318 . 0 0 "[ . 1 . 2]" 1
763 1 40 LEU HA 1 40 LEU QD . . 3.410 2.545 2.203 3.121 . 0 0 "[ . 1 . 2]" 1
764 1 40 LEU HA 1 40 LEU MD2 . . 3.970 3.929 3.798 3.954 . 0 0 "[ . 1 . 2]" 1
765 1 40 LEU HA 1 40 LEU HG . . 3.820 2.996 2.724 3.462 . 0 0 "[ . 1 . 2]" 1
766 1 40 LEU QB 1 41 LEU H . . 4.080 2.335 2.210 2.538 . 0 0 "[ . 1 . 2]" 1
767 1 40 LEU QD 1 41 LEU H . . 4.150 3.363 2.932 3.610 . 0 0 "[ . 1 . 2]" 1
768 1 40 LEU QD 1 41 LEU HA . . 4.270 3.600 2.730 3.859 . 0 0 "[ . 1 . 2]" 1
769 1 40 LEU QD 1 41 LEU HG . . 4.110 3.739 2.986 4.110 . 0 0 "[ . 1 . 2]" 1
770 1 40 LEU QD 1 44 THR HB . . 4.800 3.757 3.413 4.070 . 0 0 "[ . 1 . 2]" 1
771 1 40 LEU QD 1 44 THR MG . . 4.320 3.426 3.146 3.656 . 0 0 "[ . 1 . 2]" 1
772 1 40 LEU QD 1 45 TYR QD . . 5.440 5.419 5.075 5.450 0.010 12 0 "[ . 1 . 2]" 1
773 1 40 LEU QD 1 63 TRP HH2 . . 3.740 2.477 1.991 2.906 . 0 0 "[ . 1 . 2]" 1
774 1 40 LEU QD 1 63 TRP HZ2 . . 3.880 3.061 2.538 3.864 . 0 0 "[ . 1 . 2]" 1
775 1 40 LEU QD 1 80 TYR QD . . 4.160 3.230 2.904 3.577 . 0 0 "[ . 1 . 2]" 1
776 1 40 LEU QD 1 80 TYR QE . . 3.250 2.478 2.117 2.928 . 0 0 "[ . 1 . 2]" 1
777 1 40 LEU MD1 1 41 LEU H . . 4.930 4.416 3.925 4.678 . 0 0 "[ . 1 . 2]" 1
778 1 40 LEU MD1 1 80 TYR QE . . 3.740 3.183 2.732 3.688 . 0 0 "[ . 1 . 2]" 1
779 1 40 LEU MD2 1 41 LEU H . . 4.930 3.536 2.963 4.056 . 0 0 "[ . 1 . 2]" 1
780 1 40 LEU MD2 1 80 TYR QE . . 3.740 2.615 2.145 3.299 . 0 0 "[ . 1 . 2]" 1
781 1 40 LEU HG 1 41 LEU H . . 3.930 3.414 2.909 3.874 . 0 0 "[ . 1 . 2]" 1
782 1 40 LEU HG 1 41 LEU QD . . 4.570 3.372 2.439 4.565 . 0 0 "[ . 1 . 2]" 1
783 1 40 LEU HG 1 44 THR HB . . 5.500 3.682 3.486 4.061 . 0 0 "[ . 1 . 2]" 1
784 1 40 LEU HG 1 63 TRP HZ2 . . 5.500 5.017 4.398 5.500 0.000 14 0 "[ . 1 . 2]" 1
785 1 40 LEU HG 1 80 TYR QE . . 5.500 4.099 3.634 4.587 . 0 0 "[ . 1 . 2]" 1
786 1 41 LEU H 1 41 LEU HB2 . . 4.040 2.658 2.422 2.741 . 0 0 "[ . 1 . 2]" 1
787 1 41 LEU H 1 41 LEU QB . . 3.440 2.588 2.385 2.657 . 0 0 "[ . 1 . 2]" 1
788 1 41 LEU H 1 41 LEU HB3 . . 4.040 3.576 3.565 3.586 . 0 0 "[ . 1 . 2]" 1
789 1 41 LEU H 1 41 LEU MD1 . . 5.090 3.583 2.989 3.643 . 0 0 "[ . 1 . 2]" 1
790 1 41 LEU H 1 41 LEU QD . . 4.300 2.708 2.514 3.153 . 0 0 "[ . 1 . 2]" 1
791 1 41 LEU H 1 41 LEU MD2 . . 5.090 2.852 2.563 3.840 . 0 0 "[ . 1 . 2]" 1
792 1 41 LEU H 1 41 LEU HG . . 4.370 2.049 1.949 2.385 . 0 0 "[ . 1 . 2]" 1
793 1 41 LEU H 1 42 LYS H . . 3.650 2.767 2.677 2.816 . 0 0 "[ . 1 . 2]" 1
794 1 41 LEU HA 1 41 LEU MD1 . . 3.860 3.859 3.846 3.874 0.014 17 0 "[ . 1 . 2]" 1
795 1 41 LEU HA 1 41 LEU QD . . 3.310 2.183 2.038 2.629 . 0 0 "[ . 1 . 2]" 1
796 1 41 LEU HA 1 41 LEU MD2 . . 3.860 2.196 2.045 2.675 . 0 0 "[ . 1 . 2]" 1
797 1 41 LEU HA 1 41 LEU HG . . 4.140 3.268 2.666 3.431 . 0 0 "[ . 1 . 2]" 1
798 1 41 LEU HA 1 43 ASP H . . 5.500 4.491 4.131 4.902 . 0 0 "[ . 1 . 2]" 1
799 1 41 LEU HA 1 44 THR HA . . 5.270 4.968 4.894 5.056 . 0 0 "[ . 1 . 2]" 1
800 1 41 LEU HA 1 44 THR HB . . 3.570 2.113 2.000 2.266 . 0 0 "[ . 1 . 2]" 1
801 1 41 LEU HA 1 44 THR MG . . 4.630 3.549 3.395 3.759 . 0 0 "[ . 1 . 2]" 1
802 1 41 LEU HA 1 45 TYR QD . . 4.330 2.832 2.633 3.216 . 0 0 "[ . 1 . 2]" 1
803 1 41 LEU QB 1 45 TYR QD . . 4.340 3.017 2.883 3.492 . 0 0 "[ . 1 . 2]" 1
804 1 41 LEU QB 1 45 TYR QE . . 5.000 2.715 2.486 3.163 . 0 0 "[ . 1 . 2]" 1
805 1 41 LEU QB 1 55 PRO HG2 . . 5.040 3.530 3.107 3.791 . 0 0 "[ . 1 . 2]" 1
806 1 41 LEU QB 1 55 PRO HG3 . . 4.140 3.090 2.736 3.328 . 0 0 "[ . 1 . 2]" 1
807 1 41 LEU QD 1 44 THR HB . . 4.730 3.311 3.185 3.589 . 0 0 "[ . 1 . 2]" 1
808 1 41 LEU QD 1 44 THR MG . . 4.870 3.498 3.308 3.758 . 0 0 "[ . 1 . 2]" 1
809 1 41 LEU QD 1 45 TYR QD . . 4.690 3.365 3.063 3.573 . 0 0 "[ . 1 . 2]" 1
810 1 41 LEU QD 1 45 TYR QE . . 3.700 2.411 1.969 2.632 . 0 0 "[ . 1 . 2]" 1
811 1 41 LEU QD 1 55 PRO HB2 . . 4.890 3.632 3.266 3.882 . 0 0 "[ . 1 . 2]" 1
812 1 41 LEU QD 1 55 PRO HB3 . . 4.590 3.842 3.517 4.072 . 0 0 "[ . 1 . 2]" 1
813 1 41 LEU QD 1 55 PRO HG2 . . 4.680 2.820 2.450 3.073 . 0 0 "[ . 1 . 2]" 1
814 1 41 LEU QD 1 55 PRO HG3 . . 4.590 2.266 2.002 2.593 . 0 0 "[ . 1 . 2]" 1
815 1 41 LEU QD 1 60 VAL HA . . 3.580 2.734 2.571 2.893 . 0 0 "[ . 1 . 2]" 1
816 1 41 LEU QD 1 60 VAL MG1 . . 3.620 3.083 2.562 3.300 . 0 0 "[ . 1 . 2]" 1
817 1 41 LEU QD 1 60 VAL MG2 . . 3.430 2.462 2.271 2.676 . 0 0 "[ . 1 . 2]" 1
818 1 41 LEU QD 1 63 TRP H . . 4.930 4.440 4.233 4.599 . 0 0 "[ . 1 . 2]" 1
819 1 41 LEU QD 1 63 TRP HB2 . . 4.150 2.922 2.591 3.128 . 0 0 "[ . 1 . 2]" 1
820 1 41 LEU QD 1 63 TRP HB3 . . 4.650 2.793 2.525 2.968 . 0 0 "[ . 1 . 2]" 1
821 1 41 LEU QD 1 63 TRP HD1 . . 3.610 3.022 2.621 3.502 . 0 0 "[ . 1 . 2]" 1
822 1 41 LEU QD 1 63 TRP HE1 . . 4.590 2.886 2.642 3.299 . 0 0 "[ . 1 . 2]" 1
823 1 41 LEU QD 1 63 TRP HZ2 . . 4.160 3.296 3.130 3.517 . 0 0 "[ . 1 . 2]" 1
824 1 41 LEU MD1 1 44 THR HB . . 5.490 5.429 5.350 5.496 0.006 12 0 "[ . 1 . 2]" 1
825 1 41 LEU MD1 1 45 TYR QD . . 5.500 4.648 4.528 5.441 . 0 0 "[ . 1 . 2]" 1
826 1 41 LEU MD1 1 45 TYR QE . . 4.530 3.511 3.270 4.451 . 0 0 "[ . 1 . 2]" 1
827 1 41 LEU MD1 1 60 VAL HA . . 4.530 2.758 2.595 2.926 . 0 0 "[ . 1 . 2]" 1
828 1 41 LEU MD1 1 60 VAL MG1 . . 4.400 3.176 2.579 3.434 . 0 0 "[ . 1 . 2]" 1
829 1 41 LEU MD1 1 60 VAL MG2 . . 4.530 2.474 2.277 2.695 . 0 0 "[ . 1 . 2]" 1
830 1 41 LEU MD1 1 63 TRP HB2 . . 4.980 3.069 2.643 3.351 . 0 0 "[ . 1 . 2]" 1
831 1 41 LEU MD1 1 63 TRP HB3 . . 5.280 2.925 2.612 3.125 . 0 0 "[ . 1 . 2]" 1
832 1 41 LEU MD1 1 63 TRP HD1 . . 4.110 3.702 3.196 4.106 . 0 0 "[ . 1 . 2]" 1
833 1 41 LEU MD1 1 63 TRP HE3 . . 4.990 4.154 3.804 4.516 . 0 0 "[ . 1 . 2]" 1
834 1 41 LEU MD1 1 63 TRP HZ2 . . 5.500 5.482 5.383 5.507 0.007 17 0 "[ . 1 . 2]" 1
835 1 41 LEU MD2 1 44 THR HB . . 5.490 3.341 3.209 3.638 . 0 0 "[ . 1 . 2]" 1
836 1 41 LEU MD2 1 45 TYR QD . . 5.500 3.462 3.095 3.730 . 0 0 "[ . 1 . 2]" 1
837 1 41 LEU MD2 1 45 TYR QE . . 4.530 2.468 1.972 2.717 . 0 0 "[ . 1 . 2]" 1
838 1 41 LEU MD2 1 60 VAL HA . . 4.530 4.504 4.186 4.538 0.008 17 0 "[ . 1 . 2]" 1
839 1 41 LEU MD2 1 60 VAL MG1 . . 4.400 4.233 4.056 4.399 . 0 0 "[ . 1 . 2]" 1
840 1 41 LEU MD2 1 60 VAL MG2 . . 4.530 4.503 4.406 4.540 0.010 18 0 "[ . 1 . 2]" 1
841 1 41 LEU MD2 1 63 TRP HB2 . . 4.980 3.727 3.048 4.005 . 0 0 "[ . 1 . 2]" 1
842 1 41 LEU MD2 1 63 TRP HB3 . . 5.280 3.546 3.330 3.709 . 0 0 "[ . 1 . 2]" 1
843 1 41 LEU MD2 1 63 TRP HD1 . . 4.110 3.238 2.652 3.797 . 0 0 "[ . 1 . 2]" 1
844 1 41 LEU MD2 1 63 TRP HE3 . . 4.990 3.764 3.142 4.271 . 0 0 "[ . 1 . 2]" 1
845 1 41 LEU MD2 1 63 TRP HZ2 . . 5.500 3.323 3.148 3.559 . 0 0 "[ . 1 . 2]" 1
846 1 41 LEU HG 1 45 TYR QD . . 5.500 5.495 5.383 5.506 0.006 17 0 "[ . 1 . 2]" 1
847 1 41 LEU HG 1 45 TYR QE . . 5.500 4.955 4.661 5.280 . 0 0 "[ . 1 . 2]" 1
848 1 42 LYS H 1 42 LYS QB . . 3.330 2.103 2.040 2.178 . 0 0 "[ . 1 . 2]" 1
849 1 42 LYS H 1 43 ASP H . . 3.940 2.878 2.727 3.001 . 0 0 "[ . 1 . 2]" 1
850 1 42 LYS HA 1 42 LYS QE . . 5.340 4.447 3.663 4.826 . 0 0 "[ . 1 . 2]" 1
851 1 42 LYS HA 1 45 TYR H . . 4.430 4.101 3.985 4.175 . 0 0 "[ . 1 . 2]" 1
852 1 42 LYS HA 1 45 TYR QB . . 4.730 3.367 3.154 3.610 . 0 0 "[ . 1 . 2]" 1
853 1 42 LYS HA 1 45 TYR QD . . 4.740 4.698 4.551 4.751 0.011 17 0 "[ . 1 . 2]" 1
854 1 42 LYS HA 1 52 ASN QD . . 3.940 3.491 2.593 3.940 . 0 0 "[ . 1 . 2]" 1
855 1 42 LYS HA 1 55 PRO HD2 . . 4.860 4.668 4.031 4.864 0.004 10 0 "[ . 1 . 2]" 1
856 1 42 LYS QB 1 43 ASP H . . 3.500 2.370 2.116 2.620 . 0 0 "[ . 1 . 2]" 1
857 1 42 LYS QE 1 42 LYS QG . . 3.270 2.200 2.033 2.351 . 0 0 "[ . 1 . 2]" 1
858 1 42 LYS QE 1 54 THR HA . . 5.180 4.560 2.772 5.153 . 0 0 "[ . 1 . 2]" 1
859 1 42 LYS QE 1 54 THR MG . . 4.030 2.914 1.835 3.857 . 0 0 "[ . 1 . 2]" 1
860 1 42 LYS QG 1 43 ASP HA . . 5.190 4.539 4.168 5.130 . 0 0 "[ . 1 . 2]" 1
861 1 42 LYS QG 1 55 PRO HD2 . . 4.590 4.497 4.103 4.591 0.001 3 0 "[ . 1 . 2]" 1
862 1 43 ASP H 1 43 ASP HB2 . . 3.650 2.470 2.129 2.728 . 0 0 "[ . 1 . 2]" 1
863 1 43 ASP H 1 43 ASP QB . . 3.070 2.247 2.108 2.312 . 0 0 "[ . 1 . 2]" 1
864 1 43 ASP H 1 43 ASP HB3 . . 3.650 2.811 2.453 3.532 . 0 0 "[ . 1 . 2]" 1
865 1 43 ASP H 1 44 THR H . . 3.950 2.470 2.358 2.565 . 0 0 "[ . 1 . 2]" 1
866 1 43 ASP H 1 46 ALA MB . . 5.110 4.838 4.537 5.040 . 0 0 "[ . 1 . 2]" 1
867 1 43 ASP HA 1 46 ALA H . . 4.390 3.339 3.063 3.542 . 0 0 "[ . 1 . 2]" 1
868 1 43 ASP HA 1 46 ALA MB . . 3.080 2.612 2.315 2.892 . 0 0 "[ . 1 . 2]" 1
869 1 43 ASP QB 1 44 THR H . . 3.900 2.558 2.421 2.947 . 0 0 "[ . 1 . 2]" 1
870 1 43 ASP HB2 1 44 THR H . . 4.520 3.549 2.669 3.918 . 0 0 "[ . 1 . 2]" 1
871 1 43 ASP HB2 1 46 ALA MB . . 5.500 4.852 4.408 5.302 . 0 0 "[ . 1 . 2]" 1
872 1 43 ASP HB3 1 44 THR H . . 4.520 2.732 2.454 3.508 . 0 0 "[ . 1 . 2]" 1
873 1 43 ASP HB3 1 46 ALA MB . . 5.500 4.962 4.273 5.357 . 0 0 "[ . 1 . 2]" 1
874 1 44 THR H 1 44 THR HB . . 3.970 2.612 2.521 2.713 . 0 0 "[ . 1 . 2]" 1
875 1 44 THR H 1 44 THR MG . . 4.330 3.765 3.752 3.768 . 0 0 "[ . 1 . 2]" 1
876 1 44 THR HA 1 44 THR MG . . 3.090 2.322 2.234 2.407 . 0 0 "[ . 1 . 2]" 1
877 1 44 THR HA 1 45 TYR QD . . 5.500 4.846 4.641 5.007 . 0 0 "[ . 1 . 2]" 1
878 1 44 THR HA 1 47 GLU QB . . 3.570 3.002 2.536 3.512 . 0 0 "[ . 1 . 2]" 1
879 1 44 THR HA 1 47 GLU QG . . 3.790 2.851 2.083 3.603 . 0 0 "[ . 1 . 2]" 1
880 1 44 THR HB 1 45 TYR H . . 3.700 2.801 2.317 2.915 . 0 0 "[ . 1 . 2]" 1
881 1 44 THR HB 1 45 TYR QD . . 4.050 2.671 2.436 2.845 . 0 0 "[ . 1 . 2]" 1
882 1 44 THR HB 1 45 TYR QE . . 5.020 4.126 3.785 4.394 . 0 0 "[ . 1 . 2]" 1
883 1 44 THR MG 1 45 TYR H . . 4.100 3.648 3.163 3.805 . 0 0 "[ . 1 . 2]" 1
884 1 44 THR MG 1 45 TYR QD . . 4.560 3.187 3.001 3.378 . 0 0 "[ . 1 . 2]" 1
885 1 44 THR MG 1 48 MET ME . . 3.840 2.905 2.021 3.597 . 0 0 "[ . 1 . 2]" 1
886 1 44 THR MG 1 48 MET QG . . 4.580 4.401 4.010 4.582 0.002 15 0 "[ . 1 . 2]" 1
887 1 44 THR MG 1 63 TRP HZ2 . . 5.400 3.937 3.407 4.364 . 0 0 "[ . 1 . 2]" 1
888 1 44 THR MG 1 80 TYR QE . . 4.220 3.249 2.562 3.816 . 0 0 "[ . 1 . 2]" 1
889 1 44 THR MG 1 84 ILE MD . . 4.810 4.251 3.776 4.559 . 0 0 "[ . 1 . 2]" 1
890 1 45 TYR H 1 45 TYR QB . . 3.450 2.177 2.140 2.218 . 0 0 "[ . 1 . 2]" 1
891 1 45 TYR H 1 45 TYR QD . . 4.440 2.479 2.146 2.672 . 0 0 "[ . 1 . 2]" 1
892 1 45 TYR H 1 46 ALA H . . 3.730 2.570 2.356 2.762 . 0 0 "[ . 1 . 2]" 1
893 1 45 TYR HA 1 45 TYR QD . . 3.860 2.818 2.691 2.965 . 0 0 "[ . 1 . 2]" 1
894 1 45 TYR HA 1 45 TYR QE . . 5.440 4.450 4.399 4.491 . 0 0 "[ . 1 . 2]" 1
895 1 45 TYR HA 1 48 MET H . . 4.180 3.834 3.558 4.023 . 0 0 "[ . 1 . 2]" 1
896 1 45 TYR HA 1 48 MET ME . . 4.110 2.418 2.050 2.743 . 0 0 "[ . 1 . 2]" 1
897 1 45 TYR HA 1 50 MET ME . . 4.290 3.576 2.686 4.102 . 0 0 "[ . 1 . 2]" 1
898 1 45 TYR QB 1 46 ALA H . . 3.630 2.569 2.326 2.964 . 0 0 "[ . 1 . 2]" 1
899 1 45 TYR QB 1 50 MET QB . . 3.900 2.228 1.952 2.866 . 0 0 "[ . 1 . 2]" 1
900 1 45 TYR QB 1 50 MET ME . . 4.360 4.073 3.296 4.366 0.006 17 0 "[ . 1 . 2]" 1
901 1 45 TYR QD 1 48 MET ME . . 4.020 3.846 3.369 4.022 0.002 1 0 "[ . 1 . 2]" 1
902 1 45 TYR QD 1 50 MET HA . . 5.500 5.196 4.892 5.470 . 0 0 "[ . 1 . 2]" 1
903 1 45 TYR QD 1 50 MET HB2 . . 4.290 3.477 2.826 3.909 . 0 0 "[ . 1 . 2]" 1
904 1 45 TYR QD 1 50 MET HB3 . . 4.290 2.680 2.423 2.891 . 0 0 "[ . 1 . 2]" 1
905 1 45 TYR QD 1 50 MET ME . . 3.970 3.391 2.817 3.691 . 0 0 "[ . 1 . 2]" 1
906 1 45 TYR QD 1 50 MET QG . . 5.180 3.121 1.977 4.220 . 0 0 "[ . 1 . 2]" 1
907 1 45 TYR QD 1 53 PHE H . . 4.400 3.133 2.577 3.490 . 0 0 "[ . 1 . 2]" 1
908 1 45 TYR QD 1 53 PHE HB2 . . 4.940 4.869 4.360 4.941 0.001 20 0 "[ . 1 . 2]" 1
909 1 45 TYR QD 1 53 PHE HB3 . . 4.940 4.267 3.798 4.440 . 0 0 "[ . 1 . 2]" 1
910 1 45 TYR QE 1 48 MET ME . . 4.530 4.404 3.701 4.532 0.002 5 0 "[ . 1 . 2]" 1
911 1 45 TYR QE 1 50 MET ME . . 3.710 3.471 2.837 3.710 0.000 18 0 "[ . 1 . 2]" 1
912 1 45 TYR QE 1 53 PHE QB . . 4.500 3.863 3.088 4.134 . 0 0 "[ . 1 . 2]" 1
913 1 46 ALA H 1 46 ALA MB . . 3.060 2.075 2.025 2.221 . 0 0 "[ . 1 . 2]" 1
914 1 46 ALA H 1 47 GLU QB . . 4.830 4.501 4.248 4.645 . 0 0 "[ . 1 . 2]" 1
915 1 46 ALA H 1 48 MET H . . 4.620 4.364 4.179 4.578 . 0 0 "[ . 1 . 2]" 1
916 1 46 ALA HA 1 49 GLY HA2 . . 3.940 3.523 3.131 3.860 . 0 0 "[ . 1 . 2]" 1
917 1 46 ALA HA 1 50 MET H . . 3.840 2.950 2.634 3.525 . 0 0 "[ . 1 . 2]" 1
918 1 46 ALA MB 1 47 GLU H . . 3.630 2.932 2.782 2.998 . 0 0 "[ . 1 . 2]" 1
919 1 46 ALA MB 1 47 GLU HA . . 4.590 3.807 3.760 3.865 . 0 0 "[ . 1 . 2]" 1
920 1 46 ALA MB 1 49 GLY HA2 . . 4.690 4.337 4.080 4.672 . 0 0 "[ . 1 . 2]" 1
921 1 47 GLU H 1 47 GLU QB . . 3.050 2.226 2.049 2.457 . 0 0 "[ . 1 . 2]" 1
922 1 47 GLU H 1 47 GLU QG . . 3.670 2.781 2.152 3.672 0.002 15 0 "[ . 1 . 2]" 1
923 1 47 GLU H 1 48 MET H . . 3.510 2.721 2.617 2.860 . 0 0 "[ . 1 . 2]" 1
924 1 47 GLU HA 1 47 GLU QG . . 3.190 2.460 2.075 3.018 . 0 0 "[ . 1 . 2]" 1
925 1 47 GLU QB 1 47 GLU QG . . 2.300 2.019 1.970 2.083 . 0 0 "[ . 1 . 2]" 1
926 1 47 GLU QB 1 48 MET H . . 3.240 2.842 2.390 2.953 . 0 0 "[ . 1 . 2]" 1
927 1 47 GLU QB 1 49 GLY H . . 5.130 4.517 4.287 4.607 . 0 0 "[ . 1 . 2]" 1
928 1 48 MET H 1 48 MET QG . . 3.580 2.363 1.920 3.571 . 0 0 "[ . 1 . 2]" 1
929 1 48 MET H 1 49 GLY H . . 3.640 2.427 2.061 2.598 . 0 0 "[ . 1 . 2]" 1
930 1 48 MET H 1 50 MET H . . 4.040 3.209 2.982 3.780 . 0 0 "[ . 1 . 2]" 1
931 1 48 MET HA 1 48 MET ME . . 5.100 4.684 4.304 5.038 . 0 0 "[ . 1 . 2]" 1
932 1 48 MET HA 1 48 MET HG2 . . 3.900 2.980 2.535 3.715 . 0 0 "[ . 1 . 2]" 1
933 1 48 MET HA 1 48 MET QG . . 3.320 2.711 2.178 3.326 0.006 11 0 "[ . 1 . 2]" 1
934 1 48 MET HA 1 48 MET HG3 . . 3.900 3.232 2.201 3.788 . 0 0 "[ . 1 . 2]" 1
935 1 48 MET QG 1 50 MET ME . . 4.700 3.938 3.285 4.683 . 0 0 "[ . 1 . 2]" 1
936 1 48 MET HG2 1 50 MET ME . . 5.500 4.715 3.852 5.497 . 0 0 "[ . 1 . 2]" 1
937 1 48 MET HG3 1 50 MET ME . . 5.500 4.270 3.459 5.104 . 0 0 "[ . 1 . 2]" 1
938 1 49 GLY H 1 50 MET H . . 3.550 2.496 2.190 2.625 . 0 0 "[ . 1 . 2]" 1
939 1 50 MET H 1 50 MET HB2 . . 3.780 2.232 2.106 2.417 . 0 0 "[ . 1 . 2]" 1
940 1 50 MET H 1 50 MET QB . . 3.310 2.194 2.072 2.381 . 0 0 "[ . 1 . 2]" 1
941 1 50 MET H 1 50 MET HB3 . . 3.780 3.260 2.935 3.579 . 0 0 "[ . 1 . 2]" 1
942 1 50 MET H 1 50 MET HG2 . . 5.170 3.817 2.375 4.630 . 0 0 "[ . 1 . 2]" 1
943 1 50 MET H 1 50 MET QG . . 4.460 3.314 2.331 4.036 . 0 0 "[ . 1 . 2]" 1
944 1 50 MET H 1 50 MET HG3 . . 5.170 3.828 2.644 4.488 . 0 0 "[ . 1 . 2]" 1
945 1 50 MET HA 1 50 MET HG2 . . 3.810 2.922 2.196 3.622 . 0 0 "[ . 1 . 2]" 1
946 1 50 MET HA 1 50 MET QG . . 3.320 2.391 2.131 2.655 . 0 0 "[ . 1 . 2]" 1
947 1 50 MET HA 1 50 MET HG3 . . 3.810 2.926 2.233 3.740 . 0 0 "[ . 1 . 2]" 1
948 1 50 MET HA 1 51 SER H . . 3.170 2.509 2.410 2.545 . 0 0 "[ . 1 . 2]" 1
949 1 50 MET HA 1 52 ASN H . . 4.260 4.067 3.975 4.189 . 0 0 "[ . 1 . 2]" 1
950 1 50 MET QB 1 51 SER H . . 3.900 2.505 2.111 3.012 . 0 0 "[ . 1 . 2]" 1
951 1 50 MET HB2 1 51 SER H . . 4.580 3.746 3.459 4.003 . 0 0 "[ . 1 . 2]" 1
952 1 50 MET HB3 1 51 SER H . . 4.580 2.552 2.128 3.115 . 0 0 "[ . 1 . 2]" 1
953 1 50 MET QG 1 51 SER H . . 4.300 2.825 1.923 4.102 . 0 0 "[ . 1 . 2]" 1
954 1 51 SER H 1 51 SER QB . . 3.180 2.365 2.167 2.751 . 0 0 "[ . 1 . 2]" 1
955 1 51 SER H 1 52 ASN H . . 3.920 2.617 2.519 2.707 . 0 0 "[ . 1 . 2]" 1
956 1 51 SER HA 1 51 SER QB . . 2.620 2.339 2.187 2.479 . 0 0 "[ . 1 . 2]" 1
957 1 51 SER HA 1 52 ASN H . . 3.500 3.396 3.294 3.461 . 0 0 "[ . 1 . 2]" 1
958 1 52 ASN H 1 52 ASN HB2 . . 3.920 3.186 3.081 3.805 . 0 0 "[ . 1 . 2]" 1
959 1 52 ASN H 1 52 ASN HB3 . . 3.920 3.783 3.674 4.078 0.158 10 0 "[ . 1 . 2]" 1
960 1 52 ASN H 1 53 PHE H . . 3.650 2.843 2.674 3.046 . 0 0 "[ . 1 . 2]" 1
961 1 53 PHE H 1 53 PHE HB2 . . 3.210 2.604 2.493 2.745 . 0 0 "[ . 1 . 2]" 1
962 1 53 PHE H 1 53 PHE QB . . 2.790 2.268 2.254 2.307 . 0 0 "[ . 1 . 2]" 1
963 1 53 PHE H 1 53 PHE HB3 . . 3.210 2.498 2.474 2.570 . 0 0 "[ . 1 . 2]" 1
964 1 53 PHE HA 1 53 PHE QD . . 3.590 2.559 2.425 2.683 . 0 0 "[ . 1 . 2]" 1
965 1 53 PHE HA 1 53 PHE QE . . 4.700 4.546 4.497 4.592 . 0 0 "[ . 1 . 2]" 1
966 1 53 PHE HA 1 54 THR H . . 2.930 2.297 2.295 2.301 . 0 0 "[ . 1 . 2]" 1
967 1 53 PHE QB 1 54 THR H . . 4.040 3.442 3.438 3.445 . 0 0 "[ . 1 . 2]" 1
968 1 53 PHE HB2 1 54 THR H . . 4.730 3.924 3.916 3.927 . 0 0 "[ . 1 . 2]" 1
969 1 53 PHE HB3 1 54 THR H . . 4.730 3.810 3.806 3.813 . 0 0 "[ . 1 . 2]" 1
970 1 53 PHE QD 1 54 THR H . . 4.350 2.940 2.781 3.048 . 0 0 "[ . 1 . 2]" 1
971 1 53 PHE QD 1 55 PRO HA . . 4.740 3.406 3.289 3.540 . 0 0 "[ . 1 . 2]" 1
972 1 53 PHE QD 1 55 PRO HB3 . . 4.150 3.105 3.041 3.199 . 0 0 "[ . 1 . 2]" 1
973 1 53 PHE QD 1 55 PRO HD2 . . 4.940 4.345 4.156 4.549 . 0 0 "[ . 1 . 2]" 1
974 1 53 PHE QD 1 55 PRO HD3 . . 4.380 2.735 2.552 2.944 . 0 0 "[ . 1 . 2]" 1
975 1 53 PHE QE 1 55 PRO HA . . 3.900 2.298 2.119 2.506 . 0 0 "[ . 1 . 2]" 1
976 1 53 PHE QE 1 55 PRO HB3 . . 4.020 3.270 3.212 3.365 . 0 0 "[ . 1 . 2]" 1
977 1 53 PHE QE 1 55 PRO HG3 . . 5.380 5.175 5.096 5.283 . 0 0 "[ . 1 . 2]" 1
978 1 53 PHE HZ 1 55 PRO HA . . 4.070 4.069 4.060 4.073 0.003 17 0 "[ . 1 . 2]" 1
979 1 54 THR H 1 54 THR HB . . 3.830 3.143 2.600 3.681 . 0 0 "[ . 1 . 2]" 1
980 1 54 THR H 1 54 THR MG . . 4.000 3.518 2.997 3.871 . 0 0 "[ . 1 . 2]" 1
981 1 54 THR HA 1 54 THR MG . . 3.180 2.172 2.035 2.393 . 0 0 "[ . 1 . 2]" 1
982 1 54 THR HA 1 55 PRO HD2 . . 3.400 1.939 1.938 1.940 . 0 0 "[ . 1 . 2]" 1
983 1 54 THR HA 1 55 PRO HD3 . . 3.510 2.644 2.643 2.646 . 0 0 "[ . 1 . 2]" 1
984 1 54 THR HA 1 55 PRO HG2 . . 4.230 4.126 4.125 4.126 . 0 0 "[ . 1 . 2]" 1
985 1 54 THR HA 1 55 PRO HG3 . . 4.700 4.466 4.465 4.468 . 0 0 "[ . 1 . 2]" 1
986 1 54 THR HB 1 55 PRO HD2 . . 4.850 4.366 3.959 4.725 . 0 0 "[ . 1 . 2]" 1
987 1 54 THR MG 1 55 PRO HD2 . . 3.840 3.341 3.017 3.682 . 0 0 "[ . 1 . 2]" 1
988 1 54 THR MG 1 55 PRO HD3 . . 4.360 4.292 4.189 4.363 0.003 20 0 "[ . 1 . 2]" 1
989 1 55 PRO HA 1 56 THR H . . 3.300 2.480 2.202 2.635 . 0 0 "[ . 1 . 2]" 1
990 1 55 PRO HA 1 56 THR MG . . 4.010 3.454 3.256 3.868 . 0 0 "[ . 1 . 2]" 1
991 1 55 PRO HA 1 59 ASP HB2 . . 4.620 3.599 3.054 4.251 . 0 0 "[ . 1 . 2]" 1
992 1 55 PRO HA 1 59 ASP QB . . 3.790 3.286 2.929 3.623 . 0 0 "[ . 1 . 2]" 1
993 1 55 PRO HA 1 59 ASP HB3 . . 4.620 3.951 3.317 4.339 . 0 0 "[ . 1 . 2]" 1
994 1 55 PRO HA 1 60 VAL MG2 . . 5.430 4.913 4.730 5.051 . 0 0 "[ . 1 . 2]" 1
995 1 55 PRO HB2 1 56 THR H . . 4.260 2.439 2.078 3.224 . 0 0 "[ . 1 . 2]" 1
996 1 55 PRO HB2 1 59 ASP QB . . 4.400 1.950 1.894 1.997 . 0 0 "[ . 1 . 2]" 1
997 1 55 PRO HB2 1 60 VAL HA . . 5.200 4.402 4.269 4.491 . 0 0 "[ . 1 . 2]" 1
998 1 55 PRO HB2 1 60 VAL MG2 . . 3.730 2.725 2.496 2.884 . 0 0 "[ . 1 . 2]" 1
999 1 55 PRO HB3 1 56 THR H . . 4.380 3.377 3.211 3.799 . 0 0 "[ . 1 . 2]" 1
1000 1 55 PRO HB3 1 59 ASP QB . . 3.510 2.471 2.266 2.718 . 0 0 "[ . 1 . 2]" 1
1001 1 55 PRO HB3 1 60 VAL HA . . 5.500 5.488 5.434 5.504 0.004 16 0 "[ . 1 . 2]" 1
1002 1 55 PRO HB3 1 60 VAL MG2 . . 4.590 4.145 3.902 4.332 . 0 0 "[ . 1 . 2]" 1
1003 1 55 PRO HG2 1 60 VAL MG2 . . 4.420 2.842 2.387 3.107 . 0 0 "[ . 1 . 2]" 1
1004 1 55 PRO HG3 1 60 VAL MG2 . . 4.510 3.687 3.291 3.999 . 0 0 "[ . 1 . 2]" 1
1005 1 56 THR H 1 56 THR MG . . 3.600 2.740 2.373 2.985 . 0 0 "[ . 1 . 2]" 1
1006 1 56 THR H 1 59 ASP H . . 4.170 3.064 2.911 3.370 . 0 0 "[ . 1 . 2]" 1
1007 1 56 THR H 1 59 ASP HB2 . . 4.370 2.461 1.951 3.330 . 0 0 "[ . 1 . 2]" 1
1008 1 56 THR H 1 59 ASP QB . . 3.800 2.208 1.943 2.527 . 0 0 "[ . 1 . 2]" 1
1009 1 56 THR H 1 59 ASP HB3 . . 4.370 3.232 2.042 4.096 . 0 0 "[ . 1 . 2]" 1
1010 1 56 THR HA 1 56 THR HB . . 2.790 2.446 2.387 2.597 . 0 0 "[ . 1 . 2]" 1
1011 1 56 THR HA 1 56 THR MG . . 2.770 2.345 2.215 2.440 . 0 0 "[ . 1 . 2]" 1
1012 1 56 THR HA 1 57 LYS H . . 3.160 2.623 2.561 2.636 . 0 0 "[ . 1 . 2]" 1
1013 1 56 THR HA 1 58 GLU H . . 4.540 4.265 4.227 4.321 . 0 0 "[ . 1 . 2]" 1
1014 1 56 THR HB 1 57 LYS H . . 3.170 1.996 1.955 2.069 . 0 0 "[ . 1 . 2]" 1
1015 1 56 THR HB 1 58 GLU H . . 3.570 3.055 2.600 3.231 . 0 0 "[ . 1 . 2]" 1
1016 1 56 THR HB 1 59 ASP H . . 4.740 4.576 3.973 4.742 0.002 15 0 "[ . 1 . 2]" 1
1017 1 56 THR MG 1 57 LYS H . . 3.850 3.571 3.239 3.682 . 0 0 "[ . 1 . 2]" 1
1018 1 57 LYS H 1 57 LYS HB2 . . 3.630 2.910 2.156 3.589 . 0 0 "[ . 1 . 2]" 1
1019 1 57 LYS H 1 57 LYS QB . . 3.010 2.329 2.108 2.591 . 0 0 "[ . 1 . 2]" 1
1020 1 57 LYS H 1 57 LYS HB3 . . 3.630 2.746 2.370 3.586 . 0 0 "[ . 1 . 2]" 1
1021 1 57 LYS H 1 57 LYS HG2 . . 5.130 3.309 1.960 4.615 . 0 0 "[ . 1 . 2]" 1
1022 1 57 LYS H 1 57 LYS QG . . 4.360 2.935 1.938 4.047 . 0 0 "[ . 1 . 2]" 1
1023 1 57 LYS H 1 57 LYS HG3 . . 5.130 3.693 2.174 4.496 . 0 0 "[ . 1 . 2]" 1
1024 1 57 LYS H 1 58 GLU H . . 3.560 2.709 2.652 2.764 . 0 0 "[ . 1 . 2]" 1
1025 1 57 LYS HA 1 57 LYS QB . . 2.630 2.310 2.178 2.491 . 0 0 "[ . 1 . 2]" 1
1026 1 57 LYS HA 1 60 VAL HB . . 3.320 2.831 2.588 3.027 . 0 0 "[ . 1 . 2]" 1
1027 1 57 LYS HA 1 60 VAL MG1 . . 4.250 4.049 3.955 4.222 . 0 0 "[ . 1 . 2]" 1
1028 1 57 LYS HA 1 60 VAL MG2 . . 3.280 2.844 2.439 3.280 . 11 0 "[ . 1 . 2]" 1
1029 1 57 LYS QB 1 57 LYS QD . . 2.740 2.189 2.063 2.502 . 0 0 "[ . 1 . 2]" 1
1030 1 57 LYS QB 1 58 GLU H . . 4.200 3.196 2.804 3.610 . 0 0 "[ . 1 . 2]" 1
1031 1 57 LYS HB2 1 58 GLU H . . 4.870 3.815 2.868 4.140 . 0 0 "[ . 1 . 2]" 1
1032 1 57 LYS HB3 1 58 GLU H . . 4.870 3.581 2.867 4.165 . 0 0 "[ . 1 . 2]" 1
1033 1 57 LYS QD 1 57 LYS QG . . 2.290 2.043 2.018 2.090 . 0 0 "[ . 1 . 2]" 1
1034 1 58 GLU H 1 58 GLU HB2 . . 3.420 2.439 2.200 2.719 . 0 0 "[ . 1 . 2]" 1
1035 1 58 GLU H 1 58 GLU QB . . 2.890 2.234 2.141 2.271 . 0 0 "[ . 1 . 2]" 1
1036 1 58 GLU H 1 58 GLU HB3 . . 3.420 2.662 2.407 2.936 . 0 0 "[ . 1 . 2]" 1
1037 1 58 GLU H 1 58 GLU QG . . 4.390 3.975 3.877 4.064 . 0 0 "[ . 1 . 2]" 1
1038 1 58 GLU H 1 59 ASP H . . 3.250 2.720 2.507 2.805 . 0 0 "[ . 1 . 2]" 1
1039 1 58 GLU HA 1 58 GLU HG2 . . 3.900 3.190 2.572 3.763 . 0 0 "[ . 1 . 2]" 1
1040 1 58 GLU HA 1 58 GLU QG . . 3.110 2.431 2.094 3.041 . 0 0 "[ . 1 . 2]" 1
1041 1 58 GLU HA 1 58 GLU HG3 . . 3.900 2.560 2.118 3.222 . 0 0 "[ . 1 . 2]" 1
1042 1 58 GLU HA 1 62 ILE MD . . 4.050 3.826 3.703 4.044 . 0 0 "[ . 1 . 2]" 1
1043 1 58 GLU QB 1 58 GLU QG . . 2.350 2.057 1.981 2.086 . 0 0 "[ . 1 . 2]" 1
1044 1 58 GLU QB 1 59 ASP H . . 3.130 2.179 2.080 2.552 . 0 0 "[ . 1 . 2]" 1
1045 1 58 GLU QB 1 62 ILE MD . . 4.170 3.793 3.514 4.078 . 0 0 "[ . 1 . 2]" 1
1046 1 58 GLU HB2 1 59 ASP H . . 3.970 3.533 3.365 3.838 . 0 0 "[ . 1 . 2]" 1
1047 1 58 GLU HB3 1 59 ASP H . . 3.970 2.201 2.098 2.591 . 0 0 "[ . 1 . 2]" 1
1048 1 58 GLU QG 1 62 ILE MD . . 3.750 2.553 2.217 2.899 . 0 0 "[ . 1 . 2]" 1
1049 1 58 GLU HG2 1 62 ILE MD . . 4.360 2.937 2.282 4.054 . 0 0 "[ . 1 . 2]" 1
1050 1 58 GLU HG3 1 62 ILE MD . . 4.360 3.343 2.463 4.236 . 0 0 "[ . 1 . 2]" 1
1051 1 59 ASP H 1 59 ASP HB2 . . 3.660 2.305 2.101 2.739 . 0 0 "[ . 1 . 2]" 1
1052 1 59 ASP H 1 59 ASP QB . . 3.110 2.200 2.070 2.406 . 0 0 "[ . 1 . 2]" 1
1053 1 59 ASP H 1 59 ASP HB3 . . 3.660 3.190 2.343 3.587 . 0 0 "[ . 1 . 2]" 1
1054 1 59 ASP H 1 60 VAL H . . 3.360 2.803 2.459 2.876 . 0 0 "[ . 1 . 2]" 1
1055 1 59 ASP H 1 60 VAL MG2 . . 4.950 4.223 3.951 4.315 . 0 0 "[ . 1 . 2]" 1
1056 1 59 ASP H 1 62 ILE MD . . 5.130 3.746 3.670 4.094 . 0 0 "[ . 1 . 2]" 1
1057 1 59 ASP HA 1 60 VAL MG2 . . 5.500 4.951 4.865 5.046 . 0 0 "[ . 1 . 2]" 1
1058 1 59 ASP HA 1 62 ILE H . . 4.530 3.561 3.423 3.683 . 0 0 "[ . 1 . 2]" 1
1059 1 59 ASP HA 1 62 ILE HB . . 3.510 3.369 3.308 3.424 . 0 0 "[ . 1 . 2]" 1
1060 1 59 ASP HA 1 62 ILE MD . . 3.470 1.928 1.887 1.970 . 0 0 "[ . 1 . 2]" 1
1061 1 59 ASP HA 1 62 ILE MG . . 4.660 4.663 4.634 4.676 0.016 16 0 "[ . 1 . 2]" 1
1062 1 59 ASP QB 1 60 VAL H . . 3.640 2.618 2.377 2.971 . 0 0 "[ . 1 . 2]" 1
1063 1 59 ASP QB 1 62 ILE MD . . 5.340 3.753 3.569 3.889 . 0 0 "[ . 1 . 2]" 1
1064 1 59 ASP HB2 1 60 VAL H . . 4.400 3.200 2.621 4.041 . 0 0 "[ . 1 . 2]" 1
1065 1 59 ASP HB2 1 60 VAL MG2 . . 5.500 3.970 3.353 4.856 . 0 0 "[ . 1 . 2]" 1
1066 1 59 ASP HB3 1 60 VAL H . . 4.400 3.022 2.407 3.653 . 0 0 "[ . 1 . 2]" 1
1067 1 59 ASP HB3 1 60 VAL MG2 . . 5.500 3.555 3.054 4.153 . 0 0 "[ . 1 . 2]" 1
1068 1 60 VAL H 1 60 VAL HB . . 3.340 2.563 2.499 2.619 . 0 0 "[ . 1 . 2]" 1
1069 1 60 VAL H 1 60 VAL MG2 . . 3.270 2.126 1.929 2.445 . 0 0 "[ . 1 . 2]" 1
1070 1 60 VAL HA 1 60 VAL MG1 . . 3.340 2.322 2.282 2.352 . 0 0 "[ . 1 . 2]" 1
1071 1 60 VAL HA 1 60 VAL MG2 . . 3.130 2.385 2.280 2.433 . 0 0 "[ . 1 . 2]" 1
1072 1 60 VAL HA 1 63 TRP HA . . 5.500 5.376 5.198 5.502 0.002 20 0 "[ . 1 . 2]" 1
1073 1 60 VAL HA 1 63 TRP HB2 . . 3.880 3.549 3.172 3.799 . 0 0 "[ . 1 . 2]" 1
1074 1 60 VAL HA 1 63 TRP HB3 . . 3.940 2.704 2.505 2.816 . 0 0 "[ . 1 . 2]" 1
1075 1 60 VAL HB 1 61 LYS H . . 3.830 2.714 2.549 2.917 . 0 0 "[ . 1 . 2]" 1
1076 1 60 VAL MG1 1 61 LYS H . . 4.630 3.569 3.417 3.715 . 0 0 "[ . 1 . 2]" 1
1077 1 60 VAL MG1 1 61 LYS HA . . 3.850 3.624 3.460 3.720 . 0 0 "[ . 1 . 2]" 1
1078 1 60 VAL MG1 1 63 TRP HB2 . . 5.500 4.680 4.268 4.918 . 0 0 "[ . 1 . 2]" 1
1079 1 60 VAL MG1 1 63 TRP HB3 . . 4.640 3.295 3.074 3.497 . 0 0 "[ . 1 . 2]" 1
1080 1 60 VAL MG1 1 64 LEU H . . 4.940 3.826 3.538 4.103 . 0 0 "[ . 1 . 2]" 1
1081 1 60 VAL MG1 1 64 LEU QB . . 5.210 3.100 2.707 3.583 . 0 0 "[ . 1 . 2]" 1
1082 1 60 VAL MG2 1 61 LYS H . . 4.030 3.870 3.774 3.942 . 0 0 "[ . 1 . 2]" 1
1083 1 60 VAL MG2 1 63 TRP HB2 . . 5.500 5.142 4.894 5.350 . 0 0 "[ . 1 . 2]" 1
1084 1 60 VAL MG2 1 63 TRP HB3 . . 4.910 4.477 4.299 4.591 . 0 0 "[ . 1 . 2]" 1
1085 1 61 LYS H 1 61 LYS QB . . 2.810 2.280 2.153 2.462 . 0 0 "[ . 1 . 2]" 1
1086 1 61 LYS H 1 61 LYS QG . . 4.490 3.271 2.197 4.055 . 0 0 "[ . 1 . 2]" 1
1087 1 61 LYS H 1 62 ILE H . . 3.770 2.776 2.587 2.903 . 0 0 "[ . 1 . 2]" 1
1088 1 61 LYS HA 1 61 LYS QD . . 3.260 2.478 2.030 3.395 0.135 13 0 "[ . 1 . 2]" 1
1089 1 61 LYS HA 1 61 LYS QG . . 3.680 2.614 2.195 3.424 . 0 0 "[ . 1 . 2]" 1
1090 1 61 LYS HA 1 64 LEU H . . 4.090 3.373 3.236 3.742 . 0 0 "[ . 1 . 2]" 1
1091 1 61 LYS HA 1 64 LEU HB2 . . 3.940 3.192 2.744 3.943 0.003 16 0 "[ . 1 . 2]" 1
1092 1 61 LYS HA 1 64 LEU QB . . 3.430 2.703 2.381 2.910 . 0 0 "[ . 1 . 2]" 1
1093 1 61 LYS HA 1 64 LEU HB3 . . 3.940 3.059 2.408 3.522 . 0 0 "[ . 1 . 2]" 1
1094 1 61 LYS HA 1 64 LEU QD . . 4.280 3.410 3.136 3.685 . 0 0 "[ . 1 . 2]" 1
1095 1 62 ILE H 1 62 ILE HB . . 3.310 2.546 2.498 2.600 . 0 0 "[ . 1 . 2]" 1
1096 1 62 ILE H 1 62 ILE HG12 . . 4.940 3.810 3.680 3.982 . 0 0 "[ . 1 . 2]" 1
1097 1 62 ILE H 1 62 ILE QG . . 4.090 2.602 2.168 2.798 . 0 0 "[ . 1 . 2]" 1
1098 1 62 ILE H 1 62 ILE HG13 . . 4.940 2.653 2.184 2.873 . 0 0 "[ . 1 . 2]" 1
1099 1 62 ILE H 1 62 ILE MG . . 3.970 3.765 3.763 3.781 . 0 0 "[ . 1 . 2]" 1
1100 1 62 ILE H 1 63 TRP H . . 3.990 2.640 2.355 2.842 . 0 0 "[ . 1 . 2]" 1
1101 1 62 ILE HA 1 62 ILE MD . . 3.810 3.571 3.457 3.829 0.019 13 0 "[ . 1 . 2]" 1
1102 1 62 ILE HA 1 62 ILE HG12 . . 3.610 3.343 3.007 3.465 . 0 0 "[ . 1 . 2]" 1
1103 1 62 ILE HA 1 62 ILE HG13 . . 3.610 2.369 2.319 2.530 . 0 0 "[ . 1 . 2]" 1
1104 1 62 ILE HA 1 62 ILE MG . . 3.180 2.337 2.292 2.395 . 0 0 "[ . 1 . 2]" 1
1105 1 62 ILE HA 1 65 GLN QB . . 3.490 3.080 2.646 3.497 0.007 16 0 "[ . 1 . 2]" 1
1106 1 62 ILE HA 1 65 GLN QG . . 5.050 4.182 2.033 5.050 0.000 19 0 "[ . 1 . 2]" 1
1107 1 62 ILE HB 1 62 ILE MD . . 3.210 2.111 1.997 2.165 . 0 0 "[ . 1 . 2]" 1
1108 1 62 ILE HB 1 63 TRP H . . 3.530 2.826 2.422 2.995 . 0 0 "[ . 1 . 2]" 1
1109 1 62 ILE HB 1 63 TRP HA . . 5.190 4.337 4.178 4.395 . 0 0 "[ . 1 . 2]" 1
1110 1 62 ILE MD 1 62 ILE MG . . 3.120 2.983 2.628 3.099 . 0 0 "[ . 1 . 2]" 1
1111 1 62 ILE MD 1 63 TRP HB2 . . 5.500 5.259 5.164 5.327 . 0 0 "[ . 1 . 2]" 1
1112 1 62 ILE QG 1 62 ILE MG . . 2.970 2.023 1.926 2.133 . 0 0 "[ . 1 . 2]" 1
1113 1 62 ILE HG12 1 62 ILE MG . . 3.550 2.071 1.962 2.176 . 0 0 "[ . 1 . 2]" 1
1114 1 62 ILE HG13 1 62 ILE MG . . 3.550 2.854 2.767 3.071 . 0 0 "[ . 1 . 2]" 1
1115 1 62 ILE MG 1 63 TRP H . . 3.730 3.609 3.310 3.729 . 0 0 "[ . 1 . 2]" 1
1116 1 62 ILE MG 1 63 TRP HA . . 4.140 3.562 3.409 3.676 . 0 0 "[ . 1 . 2]" 1
1117 1 62 ILE MG 1 63 TRP HB2 . . 5.500 4.430 4.287 4.613 . 0 0 "[ . 1 . 2]" 1
1118 1 62 ILE MG 1 65 GLN QG . . 5.340 4.660 3.177 5.138 . 0 0 "[ . 1 . 2]" 1
1119 1 62 ILE MG 1 66 MET H . . 4.930 4.651 4.061 4.931 0.001 18 0 "[ . 1 . 2]" 1
1120 1 62 ILE MG 1 66 MET ME . . 3.790 3.480 2.657 3.791 0.001 18 0 "[ . 1 . 2]" 1
1121 1 63 TRP H 1 63 TRP HB2 . . 3.270 2.654 2.514 2.761 . 0 0 "[ . 1 . 2]" 1
1122 1 63 TRP H 1 63 TRP HB3 . . 3.520 2.490 2.420 2.598 . 0 0 "[ . 1 . 2]" 1
1123 1 63 TRP H 1 64 LEU H . . 3.680 2.426 2.336 2.725 . 0 0 "[ . 1 . 2]" 1
1124 1 63 TRP HA 1 63 TRP HD1 . . 3.450 3.365 3.169 3.444 . 0 0 "[ . 1 . 2]" 1
1125 1 63 TRP HA 1 63 TRP HE3 . . 5.080 4.339 4.200 4.517 . 0 0 "[ . 1 . 2]" 1
1126 1 63 TRP HA 1 66 MET QB . . 5.210 3.274 2.354 4.446 . 0 0 "[ . 1 . 2]" 1
1127 1 63 TRP HA 1 66 MET ME . . 3.940 2.930 2.152 3.661 . 0 0 "[ . 1 . 2]" 1
1128 1 63 TRP HA 1 83 LEU QD . . 4.850 4.201 3.996 4.459 . 0 0 "[ . 1 . 2]" 1
1129 1 63 TRP HB2 1 63 TRP HD1 . . 3.600 2.621 2.598 2.677 . 0 0 "[ . 1 . 2]" 1
1130 1 63 TRP HB2 1 64 LEU H . . 4.160 4.043 3.907 4.122 . 0 0 "[ . 1 . 2]" 1
1131 1 63 TRP HB3 1 63 TRP HD1 . . 3.870 3.774 3.751 3.823 . 0 0 "[ . 1 . 2]" 1
1132 1 63 TRP HB3 1 63 TRP HE3 . . 3.730 2.655 2.556 2.701 . 0 0 "[ . 1 . 2]" 1
1133 1 63 TRP HB3 1 64 LEU H . . 3.610 2.898 2.638 3.048 . 0 0 "[ . 1 . 2]" 1
1134 1 63 TRP HD1 1 66 MET ME . . 4.010 3.728 2.403 4.012 0.002 12 0 "[ . 1 . 2]" 1
1135 1 63 TRP HD1 1 83 LEU MD1 . . 4.930 4.435 3.869 4.934 0.004 20 0 "[ . 1 . 2]" 1
1136 1 63 TRP HD1 1 83 LEU QD . . 4.340 3.786 3.504 4.239 . 0 0 "[ . 1 . 2]" 1
1137 1 63 TRP HD1 1 83 LEU MD2 . . 4.930 4.218 3.592 4.671 . 0 0 "[ . 1 . 2]" 1
1138 1 63 TRP HE1 1 83 LEU QD . . 5.440 2.456 1.930 3.236 . 0 0 "[ . 1 . 2]" 1
1139 1 63 TRP HE3 1 64 LEU H . . 4.040 3.191 2.821 3.805 . 0 0 "[ . 1 . 2]" 1
1140 1 63 TRP HE3 1 64 LEU HA . . 3.690 2.519 2.152 2.981 . 0 0 "[ . 1 . 2]" 1
1141 1 63 TRP HE3 1 64 LEU MD1 . . 5.060 4.234 3.483 4.682 . 0 0 "[ . 1 . 2]" 1
1142 1 63 TRP HE3 1 64 LEU QD . . 4.450 3.932 3.386 4.291 . 0 0 "[ . 1 . 2]" 1
1143 1 63 TRP HE3 1 64 LEU MD2 . . 5.060 4.749 4.384 5.047 . 0 0 "[ . 1 . 2]" 1
1144 1 63 TRP HE3 1 67 ALA MB . . 4.650 3.540 2.956 4.257 . 0 0 "[ . 1 . 2]" 1
1145 1 63 TRP HE3 1 75 VAL MG2 . . 4.070 3.638 3.211 4.030 . 0 0 "[ . 1 . 2]" 1
1146 1 63 TRP HH2 1 67 ALA MB . . 4.360 3.300 2.807 4.197 . 0 0 "[ . 1 . 2]" 1
1147 1 63 TRP HH2 1 75 VAL MG1 . . 3.860 2.953 2.214 3.492 . 0 0 "[ . 1 . 2]" 1
1148 1 63 TRP HH2 1 75 VAL MG2 . . 3.880 3.503 3.168 3.879 . 0 0 "[ . 1 . 2]" 1
1149 1 63 TRP HH2 1 80 TYR QD . . 3.470 2.286 2.000 2.648 . 0 0 "[ . 1 . 2]" 1
1150 1 63 TRP HH2 1 80 TYR QE . . 3.840 2.932 2.417 3.395 . 0 0 "[ . 1 . 2]" 1
1151 1 63 TRP HH2 1 83 LEU MD1 . . 5.160 3.737 2.757 5.006 . 0 0 "[ . 1 . 2]" 1
1152 1 63 TRP HH2 1 83 LEU QD . . 4.190 3.201 2.745 4.134 . 0 0 "[ . 1 . 2]" 1
1153 1 63 TRP HH2 1 83 LEU MD2 . . 5.160 4.147 3.251 5.002 . 0 0 "[ . 1 . 2]" 1
1154 1 63 TRP HH2 1 84 ILE MD . . 5.500 5.255 4.987 5.465 . 0 0 "[ . 1 . 2]" 1
1155 1 63 TRP HZ2 1 67 ALA MB . . 4.600 3.870 3.451 4.609 0.009 15 0 "[ . 1 . 2]" 1
1156 1 63 TRP HZ2 1 75 VAL MG1 . . 4.850 4.703 4.157 4.852 0.002 14 0 "[ . 1 . 2]" 1
1157 1 63 TRP HZ2 1 75 VAL MG2 . . 5.500 5.252 5.028 5.500 . 0 0 "[ . 1 . 2]" 1
1158 1 63 TRP HZ2 1 80 TYR QE . . 2.930 2.124 1.998 2.375 . 0 0 "[ . 1 . 2]" 1
1159 1 63 TRP HZ2 1 83 LEU MD1 . . 4.000 2.992 2.289 3.998 . 0 0 "[ . 1 . 2]" 1
1160 1 63 TRP HZ2 1 83 LEU QD . . 3.150 2.206 1.900 2.589 . 0 0 "[ . 1 . 2]" 1
1161 1 63 TRP HZ2 1 83 LEU MD2 . . 4.000 2.834 1.914 4.001 0.001 20 0 "[ . 1 . 2]" 1
1162 1 63 TRP HZ2 1 84 ILE MD . . 4.470 4.468 4.395 4.483 0.013 15 0 "[ . 1 . 2]" 1
1163 1 63 TRP HZ3 1 64 LEU HA . . 5.000 3.404 2.950 4.139 . 0 0 "[ . 1 . 2]" 1
1164 1 63 TRP HZ3 1 64 LEU MD1 . . 5.500 4.400 3.076 5.335 . 0 0 "[ . 1 . 2]" 1
1165 1 63 TRP HZ3 1 64 LEU MD2 . . 5.500 4.820 4.107 5.499 . 0 0 "[ . 1 . 2]" 1
1166 1 63 TRP HZ3 1 67 ALA MB . . 4.800 3.122 2.621 4.007 . 0 0 "[ . 1 . 2]" 1
1167 1 63 TRP HZ3 1 75 VAL MG1 . . 4.230 3.394 2.658 3.884 . 0 0 "[ . 1 . 2]" 1
1168 1 63 TRP HZ3 1 75 VAL MG2 . . 3.740 2.244 1.963 2.876 . 0 0 "[ . 1 . 2]" 1
1169 1 64 LEU H 1 64 LEU HB2 . . 3.490 2.391 2.222 2.883 . 0 0 "[ . 1 . 2]" 1
1170 1 64 LEU H 1 64 LEU HB3 . . 3.490 2.700 2.266 2.885 . 0 0 "[ . 1 . 2]" 1
1171 1 64 LEU H 1 64 LEU MD1 . . 4.770 4.145 4.002 4.242 . 0 0 "[ . 1 . 2]" 1
1172 1 64 LEU H 1 64 LEU QD . . 4.080 3.739 3.695 3.775 . 0 0 "[ . 1 . 2]" 1
1173 1 64 LEU H 1 64 LEU MD2 . . 4.770 4.256 4.162 4.341 . 0 0 "[ . 1 . 2]" 1
1174 1 64 LEU H 1 64 LEU HG . . 4.400 4.303 4.236 4.391 . 0 0 "[ . 1 . 2]" 1
1175 1 64 LEU H 1 65 GLN H . . 3.960 2.522 2.334 2.785 . 0 0 "[ . 1 . 2]" 1
1176 1 64 LEU H 1 67 ALA MB . . 5.410 4.762 4.344 5.373 . 0 0 "[ . 1 . 2]" 1
1177 1 64 LEU HA 1 64 LEU MD1 . . 3.950 3.409 2.149 3.793 . 0 0 "[ . 1 . 2]" 1
1178 1 64 LEU HA 1 64 LEU QD . . 3.290 2.638 2.139 2.979 . 0 0 "[ . 1 . 2]" 1
1179 1 64 LEU HA 1 64 LEU MD2 . . 3.950 3.051 2.555 3.936 . 0 0 "[ . 1 . 2]" 1
1180 1 64 LEU HA 1 67 ALA MB . . 3.960 2.634 2.161 3.500 . 0 0 "[ . 1 . 2]" 1
1181 1 64 LEU HA 1 68 ASP HB2 . . 5.500 4.411 3.891 5.606 0.106 12 0 "[ . 1 . 2]" 1
1182 1 64 LEU HA 1 68 ASP QB . . 4.780 4.085 3.669 4.523 . 0 0 "[ . 1 . 2]" 1
1183 1 64 LEU HA 1 68 ASP HB3 . . 5.500 5.066 3.917 5.500 . 0 0 "[ . 1 . 2]" 1
1184 1 64 LEU HA 1 75 VAL MG1 . . 4.860 4.685 4.404 4.842 . 0 0 "[ . 1 . 2]" 1
1185 1 64 LEU HA 1 75 VAL MG2 . . 4.300 2.845 2.471 3.255 . 0 0 "[ . 1 . 2]" 1
1186 1 64 LEU QB 1 65 GLN H . . 3.520 2.604 2.324 2.947 . 0 0 "[ . 1 . 2]" 1
1187 1 64 LEU QD 1 65 GLN H . . 4.350 3.578 3.176 4.042 . 0 0 "[ . 1 . 2]" 1
1188 1 64 LEU QD 1 68 ASP HA . . 4.180 3.922 3.497 4.182 0.002 19 0 "[ . 1 . 2]" 1
1189 1 64 LEU QD 1 68 ASP QB . . 3.270 1.934 1.788 2.192 . 0 0 "[ . 1 . 2]" 1
1190 1 64 LEU QD 1 73 GLY H . . 4.730 3.121 2.149 4.112 . 0 0 "[ . 1 . 2]" 1
1191 1 64 LEU QD 1 73 GLY QA . . 3.760 2.215 1.759 2.897 . 0 0 "[ . 1 . 2]" 1
1192 1 64 LEU QD 1 74 SER H . . 4.330 2.734 2.117 3.780 . 0 0 "[ . 1 . 2]" 1
1193 1 64 LEU QD 1 74 SER HA . . 3.400 2.893 2.439 3.288 . 0 0 "[ . 1 . 2]" 1
1194 1 64 LEU QD 1 75 VAL HA . . 4.710 3.946 3.427 4.600 . 0 0 "[ . 1 . 2]" 1
1195 1 64 LEU MD1 1 73 GLY HA2 . . 4.960 2.823 1.903 3.866 . 0 0 "[ . 1 . 2]" 1
1196 1 64 LEU MD1 1 73 GLY HA3 . . 4.960 3.933 3.050 4.814 . 0 0 "[ . 1 . 2]" 1
1197 1 64 LEU MD1 1 74 SER HA . . 3.930 3.157 2.597 3.737 . 0 0 "[ . 1 . 2]" 1
1198 1 64 LEU MD2 1 73 GLY HA2 . . 4.960 2.489 1.904 3.134 . 0 0 "[ . 1 . 2]" 1
1199 1 64 LEU MD2 1 73 GLY HA3 . . 4.960 3.807 3.066 4.381 . 0 0 "[ . 1 . 2]" 1
1200 1 64 LEU MD2 1 74 SER HA . . 3.930 3.426 2.853 3.933 0.003 7 0 "[ . 1 . 2]" 1
1201 1 64 LEU HG 1 67 ALA MB . . 5.500 4.068 3.285 4.936 . 0 0 "[ . 1 . 2]" 1
1202 1 64 LEU HG 1 75 VAL MG2 . . 4.920 2.526 1.919 4.186 . 0 0 "[ . 1 . 2]" 1
1203 1 65 GLN H 1 65 GLN QB . . 3.430 2.254 2.151 2.378 . 0 0 "[ . 1 . 2]" 1
1204 1 65 GLN H 1 65 GLN QG . . 4.540 3.464 2.318 4.051 . 0 0 "[ . 1 . 2]" 1
1205 1 65 GLN H 1 66 MET H . . 3.800 2.707 2.494 2.983 . 0 0 "[ . 1 . 2]" 1
1206 1 65 GLN HA 1 65 GLN HG2 . . 3.950 3.338 2.491 3.816 . 0 0 "[ . 1 . 2]" 1
1207 1 65 GLN HA 1 65 GLN QG . . 3.410 2.595 2.312 3.331 . 0 0 "[ . 1 . 2]" 1
1208 1 65 GLN HA 1 65 GLN HG3 . . 3.950 2.911 2.357 3.731 . 0 0 "[ . 1 . 2]" 1
1209 1 65 GLN HA 1 68 ASP HB2 . . 5.030 4.499 3.401 5.137 0.107 12 0 "[ . 1 . 2]" 1
1210 1 65 GLN HA 1 68 ASP QB . . 4.250 3.361 2.373 4.154 . 0 0 "[ . 1 . 2]" 1
1211 1 65 GLN HA 1 68 ASP HB3 . . 5.030 3.503 2.423 4.716 . 0 0 "[ . 1 . 2]" 1
1212 1 65 GLN QB 1 66 MET H . . 3.870 2.783 2.172 3.531 . 0 0 "[ . 1 . 2]" 1
1213 1 65 GLN QG 1 66 MET H . . 5.180 3.692 2.299 4.385 . 0 0 "[ . 1 . 2]" 1
1214 1 66 MET H 1 66 MET HB2 . . 3.720 2.598 2.166 3.625 . 0 0 "[ . 1 . 2]" 1
1215 1 66 MET H 1 66 MET QB . . 3.140 2.328 2.144 2.789 . 0 0 "[ . 1 . 2]" 1
1216 1 66 MET H 1 66 MET HB3 . . 3.720 2.855 2.371 3.599 . 0 0 "[ . 1 . 2]" 1
1217 1 66 MET H 1 66 MET QG . . 4.270 3.466 1.946 4.010 . 0 0 "[ . 1 . 2]" 1
1218 1 66 MET H 1 67 ALA H . . 3.480 2.476 2.230 2.756 . 0 0 "[ . 1 . 2]" 1
1219 1 66 MET H 1 67 ALA MB . . 4.410 4.169 3.919 4.397 . 0 0 "[ . 1 . 2]" 1
1220 1 66 MET HA 1 66 MET ME . . 4.580 4.312 3.879 4.570 . 0 0 "[ . 1 . 2]" 1
1221 1 66 MET HA 1 66 MET HG2 . . 4.140 2.974 2.406 3.836 . 0 0 "[ . 1 . 2]" 1
1222 1 66 MET HA 1 66 MET HG3 . . 4.140 2.773 2.183 3.799 . 0 0 "[ . 1 . 2]" 1
1223 1 66 MET HA 1 83 LEU QD . . 4.980 4.462 3.813 4.982 0.002 8 0 "[ . 1 . 2]" 1
1224 1 66 MET QB 1 67 ALA H . . 4.080 2.681 2.228 3.504 . 0 0 "[ . 1 . 2]" 1
1225 1 66 MET QB 1 67 ALA MB . . 5.030 3.784 3.507 4.477 . 0 0 "[ . 1 . 2]" 1
1226 1 66 MET QB 1 83 LEU QD . . 3.640 2.793 2.039 3.630 . 0 0 "[ . 1 . 2]" 1
1227 1 66 MET ME 1 83 LEU QD . . 3.600 3.072 2.130 3.603 0.003 12 0 "[ . 1 . 2]" 1
1228 1 66 MET QG 1 83 LEU QD . . 4.020 3.129 1.974 4.021 0.001 20 0 "[ . 1 . 2]" 1
1229 1 67 ALA H 1 67 ALA MB . . 3.590 2.221 2.036 2.341 . 0 0 "[ . 1 . 2]" 1
1230 1 67 ALA H 1 68 ASP H . . 3.590 2.694 2.262 3.027 . 0 0 "[ . 1 . 2]" 1
1231 1 67 ALA HA 1 75 VAL MG1 . . 4.350 3.923 3.309 4.352 0.002 8 0 "[ . 1 . 2]" 1
1232 1 67 ALA HA 1 83 LEU QB . . 5.130 3.236 2.016 5.133 0.003 10 0 "[ . 1 . 2]" 1
1233 1 67 ALA HA 1 83 LEU MD1 . . 4.470 2.503 1.884 4.473 0.003 13 0 "[ . 1 . 2]" 1
1234 1 67 ALA HA 1 83 LEU QD . . 3.340 2.063 1.881 2.301 . 0 0 "[ . 1 . 2]" 1
1235 1 67 ALA HA 1 83 LEU MD2 . . 4.470 3.581 1.883 4.473 0.003 19 0 "[ . 1 . 2]" 1
1236 1 67 ALA HA 1 83 LEU HG . . 5.500 3.862 2.169 4.908 . 0 0 "[ . 1 . 2]" 1
1237 1 67 ALA MB 1 68 ASP H . . 3.690 2.446 1.944 3.557 . 0 0 "[ . 1 . 2]" 1
1238 1 67 ALA MB 1 68 ASP HA . . 5.020 3.831 3.641 4.286 . 0 0 "[ . 1 . 2]" 1
1239 1 67 ALA MB 1 75 VAL HA . . 5.290 4.149 3.605 4.509 . 0 0 "[ . 1 . 2]" 1
1240 1 67 ALA MB 1 75 VAL MG1 . . 3.580 2.100 1.790 2.527 . 0 0 "[ . 1 . 2]" 1
1241 1 67 ALA MB 1 75 VAL MG2 . . 3.260 2.034 1.783 2.431 . 0 0 "[ . 1 . 2]" 1
1242 1 67 ALA MB 1 80 TYR H . . 5.500 4.831 4.190 5.493 . 0 0 "[ . 1 . 2]" 1
1243 1 67 ALA MB 1 80 TYR QD . . 4.230 3.427 2.715 3.959 . 0 0 "[ . 1 . 2]" 1
1244 1 67 ALA MB 1 80 TYR QE . . 5.500 4.848 4.230 5.459 . 0 0 "[ . 1 . 2]" 1
1245 1 67 ALA MB 1 83 LEU HB2 . . 4.980 3.208 1.967 4.668 . 0 0 "[ . 1 . 2]" 1
1246 1 67 ALA MB 1 83 LEU QB . . 4.380 3.044 1.947 4.283 . 0 0 "[ . 1 . 2]" 1
1247 1 67 ALA MB 1 83 LEU HB3 . . 4.980 3.991 3.110 4.983 0.003 12 0 "[ . 1 . 2]" 1
1248 1 68 ASP H 1 68 ASP HB2 . . 3.430 2.544 2.111 3.519 0.089 12 0 "[ . 1 . 2]" 1
1249 1 68 ASP H 1 68 ASP QB . . 3.000 2.283 2.084 2.692 . 0 0 "[ . 1 . 2]" 1
1250 1 68 ASP H 1 68 ASP HB3 . . 3.430 2.711 2.223 3.196 . 0 0 "[ . 1 . 2]" 1
1251 1 68 ASP HA 1 69 THR H . . 3.010 2.153 2.138 2.211 . 0 0 "[ . 1 . 2]" 1
1252 1 68 ASP HA 1 70 ASN H . . 4.120 3.747 3.403 4.156 0.036 12 0 "[ . 1 . 2]" 1
1253 1 68 ASP HA 1 71 SER H . . 4.690 4.063 3.741 4.343 . 0 0 "[ . 1 . 2]" 1
1254 1 68 ASP HA 1 75 VAL HA . . 4.970 3.504 3.023 4.386 . 0 0 "[ . 1 . 2]" 1
1255 1 68 ASP HA 1 75 VAL MG1 . . 4.380 3.603 3.073 4.344 . 0 0 "[ . 1 . 2]" 1
1256 1 68 ASP HA 1 75 VAL MG2 . . 3.880 3.375 2.257 3.880 . 0 0 "[ . 1 . 2]" 1
1257 1 68 ASP HA 1 79 GLU QB . . 4.520 2.743 2.025 3.692 . 0 0 "[ . 1 . 2]" 1
1258 1 68 ASP QB 1 69 THR H . . 4.160 3.765 3.226 3.991 . 0 0 "[ . 1 . 2]" 1
1259 1 68 ASP QB 1 71 SER HA . . 4.620 2.627 2.019 3.414 . 0 0 "[ . 1 . 2]" 1
1260 1 68 ASP QB 1 71 SER QB . . 5.180 4.184 3.646 4.795 . 0 0 "[ . 1 . 2]" 1
1261 1 68 ASP QB 1 74 SER HA . . 5.340 4.892 4.354 5.337 . 0 0 "[ . 1 . 2]" 1
1262 1 68 ASP QB 1 75 VAL MG2 . . 4.130 2.569 1.953 3.552 . 0 0 "[ . 1 . 2]" 1
1263 1 68 ASP HB2 1 74 SER H . . 5.160 3.790 3.117 5.069 . 0 0 "[ . 1 . 2]" 1
1264 1 68 ASP HB2 1 75 VAL MG2 . . 4.780 2.642 1.963 4.420 . 0 0 "[ . 1 . 2]" 1
1265 1 68 ASP HB3 1 74 SER H . . 5.160 4.460 3.876 5.156 . 0 0 "[ . 1 . 2]" 1
1266 1 68 ASP HB3 1 75 VAL MG2 . . 4.780 3.939 3.141 4.782 0.002 20 0 "[ . 1 . 2]" 1
1267 1 69 THR H 1 69 THR MG . . 3.810 3.627 2.160 3.804 . 0 0 "[ . 1 . 2]" 1
1268 1 69 THR H 1 70 ASN H . . 4.250 2.369 2.290 2.538 . 0 0 "[ . 1 . 2]" 1
1269 1 69 THR H 1 71 SER H . . 4.560 3.645 3.343 3.833 . 0 0 "[ . 1 . 2]" 1
1270 1 69 THR H 1 79 GLU QB . . 5.210 3.316 1.988 4.288 . 0 0 "[ . 1 . 2]" 1
1271 1 69 THR H 1 79 GLU QG . . 4.560 2.453 1.865 3.377 . 0 0 "[ . 1 . 2]" 1
1272 1 69 THR HA 1 69 THR MG . . 2.830 2.258 2.064 2.402 . 0 0 "[ . 1 . 2]" 1
1273 1 69 THR HB 1 70 ASN H . . 4.410 2.955 2.448 3.790 . 0 0 "[ . 1 . 2]" 1
1274 1 69 THR HB 1 70 ASN QB . . 5.340 4.195 3.662 5.273 . 0 0 "[ . 1 . 2]" 1
1275 1 69 THR HB 1 79 GLU QG . . 4.620 3.590 2.451 4.618 . 0 0 "[ . 1 . 2]" 1
1276 1 69 THR MG 1 70 ASN QB . . 5.000 4.648 3.832 5.005 0.005 8 0 "[ . 1 . 2]" 1
1277 1 69 THR MG 1 79 GLU HG2 . . 5.500 4.991 3.505 5.518 0.018 8 0 "[ . 1 . 2]" 1
1278 1 69 THR MG 1 79 GLU HG3 . . 5.500 4.814 2.128 5.501 0.001 13 0 "[ . 1 . 2]" 1
1279 1 70 ASN H 1 70 ASN QB . . 3.590 2.293 2.105 2.503 . 0 0 "[ . 1 . 2]" 1
1280 1 70 ASN H 1 71 SER H . . 3.350 2.327 2.092 2.530 . 0 0 "[ . 1 . 2]" 1
1281 1 71 SER H 1 71 SER HA . . 2.770 2.278 2.275 2.288 . 0 0 "[ . 1 . 2]" 1
1282 1 71 SER H 1 72 ASP H . . 3.610 2.815 2.662 3.043 . 0 0 "[ . 1 . 2]" 1
1283 1 71 SER HA 1 72 ASP H . . 3.560 2.737 2.569 2.958 . 0 0 "[ . 1 . 2]" 1
1284 1 71 SER HA 1 73 GLY H . . 4.200 3.181 3.065 3.366 . 0 0 "[ . 1 . 2]" 1
1285 1 72 ASP H 1 73 GLY H . . 3.280 2.443 2.036 2.738 . 0 0 "[ . 1 . 2]" 1
1286 1 72 ASP H 1 73 GLY QA . . 4.900 4.304 4.079 4.449 . 0 0 "[ . 1 . 2]" 1
1287 1 72 ASP H 1 74 SER H . . 4.020 3.307 2.973 3.803 . 0 0 "[ . 1 . 2]" 1
1288 1 72 ASP HA 1 74 SER H . . 4.940 4.702 4.298 4.942 0.002 4 0 "[ . 1 . 2]" 1
1289 1 72 ASP QB 1 74 SER H . . 5.330 3.394 2.626 4.174 . 0 0 "[ . 1 . 2]" 1
1290 1 73 GLY H 1 74 SER H . . 3.340 2.397 2.101 2.658 . 0 0 "[ . 1 . 2]" 1
1291 1 74 SER H 1 74 SER QB . . 3.640 3.140 2.847 3.324 . 0 0 "[ . 1 . 2]" 1
1292 1 74 SER HA 1 75 VAL H . . 3.260 2.244 2.148 2.622 . 0 0 "[ . 1 . 2]" 1
1293 1 74 SER HA 1 75 VAL HA . . 5.070 4.404 4.360 4.520 . 0 0 "[ . 1 . 2]" 1
1294 1 74 SER HA 1 75 VAL MG2 . . 4.360 3.436 3.133 3.658 . 0 0 "[ . 1 . 2]" 1
1295 1 74 SER QB 1 75 VAL H . . 3.470 2.945 2.028 3.239 . 0 0 "[ . 1 . 2]" 1
1296 1 74 SER HB2 1 75 VAL H . . 4.230 3.467 2.776 4.012 . 0 0 "[ . 1 . 2]" 1
1297 1 74 SER HB3 1 75 VAL H . . 4.230 3.323 2.048 4.003 . 0 0 "[ . 1 . 2]" 1
1298 1 75 VAL H 1 75 VAL HB . . 3.820 2.681 2.551 2.892 . 0 0 "[ . 1 . 2]" 1
1299 1 75 VAL H 1 75 VAL MG1 . . 4.170 3.861 3.792 3.955 . 0 0 "[ . 1 . 2]" 1
1300 1 75 VAL H 1 75 VAL MG2 . . 3.530 2.531 2.230 2.867 . 0 0 "[ . 1 . 2]" 1
1301 1 75 VAL HA 1 75 VAL MG1 . . 3.410 2.364 2.308 2.389 . 0 0 "[ . 1 . 2]" 1
1302 1 75 VAL HA 1 75 VAL MG2 . . 3.330 2.409 2.333 2.462 . 0 0 "[ . 1 . 2]" 1
1303 1 75 VAL HA 1 76 SER H . . 3.250 2.163 2.141 2.205 . 0 0 "[ . 1 . 2]" 1
1304 1 75 VAL HA 1 76 SER HA . . 4.930 4.422 4.385 4.466 . 0 0 "[ . 1 . 2]" 1
1305 1 75 VAL HA 1 76 SER HB2 . . 5.500 4.865 4.391 5.385 . 0 0 "[ . 1 . 2]" 1
1306 1 75 VAL HA 1 76 SER HB3 . . 5.500 5.091 4.565 5.504 0.004 16 0 "[ . 1 . 2]" 1
1307 1 75 VAL HA 1 79 GLU HA . . 5.500 5.491 5.399 5.507 0.007 15 0 "[ . 1 . 2]" 1
1308 1 75 VAL HA 1 79 GLU HB2 . . 4.560 2.890 2.586 3.268 . 0 0 "[ . 1 . 2]" 1
1309 1 75 VAL HA 1 79 GLU HB3 . . 4.560 3.097 2.825 3.487 . 0 0 "[ . 1 . 2]" 1
1310 1 75 VAL HA 1 79 GLU QG . . 4.770 3.665 2.953 4.319 . 0 0 "[ . 1 . 2]" 1
1311 1 75 VAL HA 1 80 TYR HA . . 5.500 5.444 5.328 5.507 0.007 8 0 "[ . 1 . 2]" 1
1312 1 75 VAL MG1 1 76 SER H . . 3.960 3.021 2.572 3.318 . 0 0 "[ . 1 . 2]" 1
1313 1 75 VAL MG1 1 76 SER HA . . 4.910 4.166 3.894 4.333 . 0 0 "[ . 1 . 2]" 1
1314 1 75 VAL MG1 1 77 LEU HA . . 4.980 4.666 4.500 4.814 . 0 0 "[ . 1 . 2]" 1
1315 1 75 VAL MG1 1 79 GLU H . . 4.250 3.913 3.709 4.249 . 0 0 "[ . 1 . 2]" 1
1316 1 75 VAL MG1 1 79 GLU HA . . 4.300 4.073 3.895 4.295 . 0 0 "[ . 1 . 2]" 1
1317 1 75 VAL MG1 1 79 GLU HB2 . . 4.140 2.589 2.012 2.920 . 0 0 "[ . 1 . 2]" 1
1318 1 75 VAL MG1 1 79 GLU HB3 . . 4.140 2.398 2.038 3.153 . 0 0 "[ . 1 . 2]" 1
1319 1 75 VAL MG1 1 79 GLU QG . . 4.310 3.787 3.428 4.021 . 0 0 "[ . 1 . 2]" 1
1320 1 75 VAL MG1 1 80 TYR H . . 3.970 2.630 2.094 3.090 . 0 0 "[ . 1 . 2]" 1
1321 1 75 VAL MG1 1 80 TYR HA . . 4.440 2.333 2.209 2.580 . 0 0 "[ . 1 . 2]" 1
1322 1 75 VAL MG1 1 80 TYR QB . . 3.900 1.953 1.881 2.183 . 0 0 "[ . 1 . 2]" 1
1323 1 75 VAL MG1 1 80 TYR QD . . 3.710 2.777 2.482 3.119 . 0 0 "[ . 1 . 2]" 1
1324 1 75 VAL MG1 1 80 TYR QE . . 5.410 4.628 4.397 4.917 . 0 0 "[ . 1 . 2]" 1
1325 1 75 VAL MG2 1 76 SER H . . 4.270 4.212 4.136 4.272 0.002 7 0 "[ . 1 . 2]" 1
1326 1 76 SER H 1 76 SER QB . . 3.630 2.567 2.223 2.983 . 0 0 "[ . 1 . 2]" 1
1327 1 76 SER H 1 79 GLU H . . 4.270 3.547 3.227 3.849 . 0 0 "[ . 1 . 2]" 1
1328 1 76 SER H 1 79 GLU HB2 . . 3.980 2.044 1.942 2.230 . 0 0 "[ . 1 . 2]" 1
1329 1 76 SER H 1 79 GLU QB . . 3.400 2.024 1.926 2.206 . 0 0 "[ . 1 . 2]" 1
1330 1 76 SER H 1 79 GLU HB3 . . 3.980 3.293 2.822 3.544 . 0 0 "[ . 1 . 2]" 1
1331 1 76 SER HA 1 77 LEU H . . 3.510 2.589 2.392 2.716 . 0 0 "[ . 1 . 2]" 1
1332 1 76 SER HA 1 78 GLU H . . 5.350 4.545 4.178 5.051 . 0 0 "[ . 1 . 2]" 1
1333 1 76 SER QB 1 77 LEU H . . 3.570 2.611 2.097 3.259 . 0 0 "[ . 1 . 2]" 1
1334 1 76 SER QB 1 78 GLU H . . 4.320 2.673 2.231 3.412 . 0 0 "[ . 1 . 2]" 1
1335 1 76 SER HB2 1 77 LEU H . . 4.340 3.122 2.199 3.898 . 0 0 "[ . 1 . 2]" 1
1336 1 76 SER HB3 1 77 LEU H . . 4.340 2.907 2.562 3.603 . 0 0 "[ . 1 . 2]" 1
1337 1 77 LEU H 1 77 LEU HB2 . . 3.850 2.270 2.109 2.609 . 0 0 "[ . 1 . 2]" 1
1338 1 77 LEU H 1 77 LEU QB . . 3.380 2.158 2.071 2.238 . 0 0 "[ . 1 . 2]" 1
1339 1 77 LEU H 1 77 LEU HB3 . . 3.850 2.845 2.413 3.531 . 0 0 "[ . 1 . 2]" 1
1340 1 77 LEU H 1 77 LEU QD . . 4.870 3.515 3.308 3.729 . 0 0 "[ . 1 . 2]" 1
1341 1 77 LEU HA 1 77 LEU MD1 . . 4.000 2.643 1.963 3.826 . 0 0 "[ . 1 . 2]" 1
1342 1 77 LEU HA 1 77 LEU QD . . 3.210 2.027 1.902 2.282 . 0 0 "[ . 1 . 2]" 1
1343 1 77 LEU HA 1 77 LEU MD2 . . 4.000 2.597 1.958 3.921 . 0 0 "[ . 1 . 2]" 1
1344 1 77 LEU HA 1 80 TYR QD . . 4.920 3.863 3.357 4.189 . 0 0 "[ . 1 . 2]" 1
1345 1 77 LEU QB 1 77 LEU QD . . 2.850 1.960 1.889 2.036 . 0 0 "[ . 1 . 2]" 1
1346 1 77 LEU HB2 1 78 GLU H . . 4.010 3.605 2.916 3.996 . 0 0 "[ . 1 . 2]" 1
1347 1 77 LEU HB3 1 78 GLU H . . 4.010 2.708 2.095 3.540 . 0 0 "[ . 1 . 2]" 1
1348 1 77 LEU QD 1 78 GLU H . . 4.720 3.732 3.102 4.217 . 0 0 "[ . 1 . 2]" 1
1349 1 77 LEU QD 1 80 TYR H . . 5.440 4.466 4.127 5.101 . 0 0 "[ . 1 . 2]" 1
1350 1 77 LEU QD 1 80 TYR QB . . 4.320 3.374 3.126 3.704 . 0 0 "[ . 1 . 2]" 1
1351 1 77 LEU QD 1 80 TYR QD . . 3.460 3.213 2.871 3.458 . 0 0 "[ . 1 . 2]" 1
1352 1 77 LEU QD 1 81 GLU H . . 4.860 3.723 3.380 4.526 . 0 0 "[ . 1 . 2]" 1
1353 1 77 LEU QD 1 81 GLU QB . . 5.120 3.289 2.367 4.639 . 0 0 "[ . 1 . 2]" 1
1354 1 78 GLU H 1 78 GLU QB . . 3.170 2.327 2.163 2.637 . 0 0 "[ . 1 . 2]" 1
1355 1 78 GLU H 1 78 GLU QG . . 3.930 3.011 1.940 3.947 0.017 5 0 "[ . 1 . 2]" 1
1356 1 78 GLU H 1 79 GLU H . . 3.720 2.490 2.367 2.746 . 0 0 "[ . 1 . 2]" 1
1357 1 78 GLU HA 1 78 GLU QG . . 3.360 2.588 2.220 3.340 . 0 0 "[ . 1 . 2]" 1
1358 1 78 GLU QB 1 79 GLU H . . 3.690 2.831 2.073 3.611 . 0 0 "[ . 1 . 2]" 1
1359 1 79 GLU H 1 79 GLU HB2 . . 3.710 2.328 2.148 2.697 . 0 0 "[ . 1 . 2]" 1
1360 1 79 GLU H 1 79 GLU QB . . 3.250 2.295 2.127 2.625 . 0 0 "[ . 1 . 2]" 1
1361 1 79 GLU H 1 79 GLU HB3 . . 3.710 3.532 3.441 3.638 . 0 0 "[ . 1 . 2]" 1
1362 1 79 GLU H 1 79 GLU HG2 . . 4.250 3.602 1.971 4.252 0.002 4 0 "[ . 1 . 2]" 1
1363 1 79 GLU H 1 79 GLU QG . . 3.710 2.943 1.961 3.708 . 0 0 "[ . 1 . 2]" 1
1364 1 79 GLU H 1 79 GLU HG3 . . 4.250 3.467 2.116 4.235 . 0 0 "[ . 1 . 2]" 1
1365 1 79 GLU H 1 80 TYR H . . 3.760 2.524 2.311 2.966 . 0 0 "[ . 1 . 2]" 1
1366 1 79 GLU HA 1 82 ASP HB2 . . 4.500 3.512 2.505 4.501 0.001 13 0 "[ . 1 . 2]" 1
1367 1 79 GLU HA 1 82 ASP QB . . 3.770 3.040 2.480 3.770 0.000 13 0 "[ . 1 . 2]" 1
1368 1 79 GLU HA 1 82 ASP HB3 . . 4.500 3.556 2.876 4.499 . 0 0 "[ . 1 . 2]" 1
1369 1 79 GLU QB 1 80 TYR H . . 3.920 2.809 2.270 3.030 . 0 0 "[ . 1 . 2]" 1
1370 1 79 GLU HB2 1 80 TYR H . . 4.520 2.945 2.295 3.247 . 0 0 "[ . 1 . 2]" 1
1371 1 79 GLU HB3 1 80 TYR H . . 4.520 3.615 3.018 4.177 . 0 0 "[ . 1 . 2]" 1
1372 1 79 GLU QG 1 80 TYR H . . 5.280 4.355 3.639 4.759 . 0 0 "[ . 1 . 2]" 1
1373 1 80 TYR H 1 80 TYR QB . . 3.070 2.269 2.240 2.300 . 0 0 "[ . 1 . 2]" 1
1374 1 80 TYR H 1 80 TYR QD . . 4.480 4.205 4.185 4.227 . 0 0 "[ . 1 . 2]" 1
1375 1 80 TYR H 1 81 GLU H . . 3.970 2.542 2.328 2.890 . 0 0 "[ . 1 . 2]" 1
1376 1 80 TYR H 1 81 GLU QB . . 4.710 4.485 4.086 4.726 0.016 18 0 "[ . 1 . 2]" 1
1377 1 80 TYR HA 1 80 TYR QD . . 3.230 2.242 2.116 2.413 . 0 0 "[ . 1 . 2]" 1
1378 1 80 TYR HA 1 80 TYR QE . . 4.720 4.476 4.387 4.582 . 0 0 "[ . 1 . 2]" 1
1379 1 80 TYR HA 1 83 LEU QB . . 4.380 3.030 2.329 3.488 . 0 0 "[ . 1 . 2]" 1
1380 1 80 TYR HA 1 83 LEU MD1 . . 4.710 3.661 1.936 4.737 0.027 8 0 "[ . 1 . 2]" 1
1381 1 80 TYR HA 1 83 LEU MD2 . . 4.710 4.248 3.777 4.710 . 0 0 "[ . 1 . 2]" 1
1382 1 80 TYR QB 1 81 GLU H . . 3.540 2.464 2.214 2.751 . 0 0 "[ . 1 . 2]" 1
1383 1 80 TYR QD 1 83 LEU HB2 . . 4.930 3.699 2.898 4.087 . 0 0 "[ . 1 . 2]" 1
1384 1 80 TYR QD 1 83 LEU QB . . 4.210 3.202 2.428 3.662 . 0 0 "[ . 1 . 2]" 1
1385 1 80 TYR QD 1 83 LEU HB3 . . 4.930 3.672 2.606 4.882 . 0 0 "[ . 1 . 2]" 1
1386 1 80 TYR QD 1 83 LEU MD1 . . 4.920 3.437 1.894 4.572 . 0 0 "[ . 1 . 2]" 1
1387 1 80 TYR QD 1 83 LEU QD . . 3.570 2.745 1.892 3.499 . 0 0 "[ . 1 . 2]" 1
1388 1 80 TYR QD 1 83 LEU MD2 . . 4.920 3.650 2.426 4.682 . 0 0 "[ . 1 . 2]" 1
1389 1 80 TYR QD 1 84 ILE MD . . 3.580 3.255 2.999 3.516 . 0 0 "[ . 1 . 2]" 1
1390 1 80 TYR QE 1 81 GLU HA . . 5.500 5.031 4.709 5.417 . 0 0 "[ . 1 . 2]" 1
1391 1 80 TYR QE 1 83 LEU QB . . 4.780 3.917 3.200 4.269 . 0 0 "[ . 1 . 2]" 1
1392 1 80 TYR QE 1 83 LEU QD . . 3.400 2.977 2.380 3.357 . 0 0 "[ . 1 . 2]" 1
1393 1 80 TYR QE 1 84 ILE MD . . 3.870 3.078 2.735 3.359 . 0 0 "[ . 1 . 2]" 1
1394 1 80 TYR QE 1 84 ILE QG . . 5.340 4.102 3.559 4.574 . 0 0 "[ . 1 . 2]" 1
1395 1 81 GLU H 1 81 GLU HB2 . . 3.950 2.866 2.148 3.594 . 0 0 "[ . 1 . 2]" 1
1396 1 81 GLU H 1 81 GLU HB3 . . 3.950 2.879 2.461 3.589 . 0 0 "[ . 1 . 2]" 1
1397 1 81 GLU H 1 81 GLU QG . . 4.290 2.839 1.929 4.047 . 0 0 "[ . 1 . 2]" 1
1398 1 81 GLU H 1 82 ASP H . . 3.930 2.762 2.529 2.964 . 0 0 "[ . 1 . 2]" 1
1399 1 81 GLU HA 1 81 GLU QG . . 3.610 2.841 2.264 3.337 . 0 0 "[ . 1 . 2]" 1
1400 1 81 GLU HA 1 84 ILE H . . 4.650 3.502 3.353 3.768 . 0 0 "[ . 1 . 2]" 1
1401 1 81 GLU HA 1 84 ILE HB . . 4.100 3.477 3.264 3.822 . 0 0 "[ . 1 . 2]" 1
1402 1 81 GLU HA 1 84 ILE MD . . 4.480 1.970 1.891 2.460 . 0 0 "[ . 1 . 2]" 1
1403 1 81 GLU HA 1 84 ILE QG . . 4.980 4.073 3.932 4.629 . 0 0 "[ . 1 . 2]" 1
1404 1 81 GLU HA 1 84 ILE MG . . 5.080 4.768 4.603 5.090 0.010 13 0 "[ . 1 . 2]" 1
1405 1 81 GLU QB 1 82 ASP H . . 3.310 2.941 2.348 3.357 0.047 15 0 "[ . 1 . 2]" 1
1406 1 81 GLU QB 1 84 ILE MD . . 4.690 3.650 3.462 4.183 . 0 0 "[ . 1 . 2]" 1
1407 1 81 GLU HB2 1 82 ASP H . . 4.010 3.458 2.445 4.013 0.003 14 0 "[ . 1 . 2]" 1
1408 1 81 GLU HB3 1 82 ASP H . . 4.010 3.426 2.447 4.004 . 0 0 "[ . 1 . 2]" 1
1409 1 82 ASP H 1 82 ASP HB2 . . 3.570 2.375 2.168 2.704 . 0 0 "[ . 1 . 2]" 1
1410 1 82 ASP H 1 82 ASP HB3 . . 3.570 2.807 2.371 3.532 . 0 0 "[ . 1 . 2]" 1
1411 1 82 ASP H 1 83 LEU H . . 3.920 2.678 2.469 2.840 . 0 0 "[ . 1 . 2]" 1
1412 1 82 ASP H 1 83 LEU QB . . 4.990 4.451 4.214 4.781 . 0 0 "[ . 1 . 2]" 1
1413 1 82 ASP HA 1 85 ILE H . . 4.080 3.256 3.096 3.472 . 0 0 "[ . 1 . 2]" 1
1414 1 82 ASP HA 1 85 ILE HB . . 3.720 2.999 2.594 3.484 . 0 0 "[ . 1 . 2]" 1
1415 1 82 ASP HA 1 85 ILE MD . . 3.960 3.425 1.973 3.937 . 0 0 "[ . 1 . 2]" 1
1416 1 82 ASP HA 1 85 ILE HG12 . . 4.990 2.366 1.999 4.535 . 0 0 "[ . 1 . 2]" 1
1417 1 82 ASP HA 1 85 ILE QG . . 4.330 2.212 1.891 4.150 . 0 0 "[ . 1 . 2]" 1
1418 1 82 ASP HA 1 85 ILE HG13 . . 4.990 2.673 2.257 4.810 . 0 0 "[ . 1 . 2]" 1
1419 1 82 ASP HA 1 85 ILE MG . . 4.250 4.033 3.779 4.242 . 0 0 "[ . 1 . 2]" 1
1420 1 82 ASP QB 1 83 LEU H . . 3.870 2.777 2.506 2.965 . 0 0 "[ . 1 . 2]" 1
1421 1 82 ASP HB2 1 83 LEU H . . 4.590 3.764 3.003 4.144 . 0 0 "[ . 1 . 2]" 1
1422 1 82 ASP HB3 1 83 LEU H . . 4.590 2.936 2.557 3.644 . 0 0 "[ . 1 . 2]" 1
1423 1 83 LEU H 1 83 LEU QB . . 3.350 2.249 2.121 2.467 . 0 0 "[ . 1 . 2]" 1
1424 1 83 LEU H 1 83 LEU MD1 . . 4.830 3.889 3.229 4.283 . 0 0 "[ . 1 . 2]" 1
1425 1 83 LEU H 1 83 LEU QD . . 4.070 3.499 3.081 3.728 . 0 0 "[ . 1 . 2]" 1
1426 1 83 LEU H 1 83 LEU MD2 . . 4.830 4.034 3.501 4.331 . 0 0 "[ . 1 . 2]" 1
1427 1 83 LEU H 1 84 ILE H . . 4.570 2.695 2.562 2.915 . 0 0 "[ . 1 . 2]" 1
1428 1 83 LEU HA 1 83 LEU QD . . 3.460 2.579 1.955 3.130 . 0 0 "[ . 1 . 2]" 1
1429 1 83 LEU HA 1 83 LEU HG . . 3.830 2.745 2.383 3.691 . 0 0 "[ . 1 . 2]" 1
1430 1 83 LEU HA 1 84 ILE MD . . 5.360 4.647 4.513 4.844 . 0 0 "[ . 1 . 2]" 1
1431 1 83 LEU QB 1 84 ILE H . . 3.970 2.585 2.288 2.711 . 0 0 "[ . 1 . 2]" 1
1432 1 83 LEU HB2 1 84 ILE H . . 4.560 3.536 2.617 3.990 . 0 0 "[ . 1 . 2]" 1
1433 1 83 LEU HB3 1 84 ILE H . . 4.560 2.858 2.321 3.743 . 0 0 "[ . 1 . 2]" 1
1434 1 83 LEU QD 1 84 ILE H . . 5.440 3.688 3.134 4.124 . 0 0 "[ . 1 . 2]" 1
1435 1 83 LEU QD 1 84 ILE HA . . 5.440 3.896 2.822 5.120 . 0 0 "[ . 1 . 2]" 1
1436 1 83 LEU QD 1 84 ILE MD . . 3.640 3.142 2.601 3.606 . 0 0 "[ . 1 . 2]" 1
1437 1 84 ILE H 1 84 ILE QG . . 4.040 2.923 2.752 3.034 . 0 0 "[ . 1 . 2]" 1
1438 1 84 ILE H 1 85 ILE H . . 4.280 2.519 2.405 2.855 . 0 0 "[ . 1 . 2]" 1
1439 1 84 ILE HA 1 84 ILE MD . . 3.390 3.376 3.267 3.414 0.024 13 0 "[ . 1 . 2]" 1
1440 1 84 ILE HA 1 84 ILE MG . . 3.400 2.352 2.303 2.414 . 0 0 "[ . 1 . 2]" 1
1441 1 84 ILE HA 1 87 SER QB . . 3.890 2.871 2.353 3.555 . 0 0 "[ . 1 . 2]" 1
1442 1 84 ILE HA 1 88 LEU QD . . 5.440 4.205 3.413 4.695 . 0 0 "[ . 1 . 2]" 1
1443 1 84 ILE HB 1 85 ILE H . . 3.790 2.921 2.548 3.026 . 0 0 "[ . 1 . 2]" 1
1444 1 84 ILE HB 1 85 ILE MD . . 3.990 3.597 2.735 3.942 . 0 0 "[ . 1 . 2]" 1
1445 1 84 ILE MD 1 84 ILE MG . . 3.190 3.135 3.100 3.163 . 0 0 "[ . 1 . 2]" 1
1446 1 84 ILE MD 1 85 ILE H . . 4.400 3.693 3.580 3.775 . 0 0 "[ . 1 . 2]" 1
1447 1 84 ILE MG 1 85 ILE HA . . 4.290 3.610 3.378 3.759 . 0 0 "[ . 1 . 2]" 1
1448 1 84 ILE MG 1 85 ILE MD . . 3.930 3.585 3.284 3.879 . 0 0 "[ . 1 . 2]" 1
1449 1 84 ILE MG 1 87 SER QB . . 5.000 3.253 2.501 4.172 . 0 0 "[ . 1 . 2]" 1
1450 1 84 ILE MG 1 88 LEU HB2 . . 4.300 3.717 3.016 4.220 . 0 0 "[ . 1 . 2]" 1
1451 1 84 ILE MG 1 88 LEU HG . . 4.700 3.002 2.005 4.671 . 0 0 "[ . 1 . 2]" 1
1452 1 85 ILE H 1 85 ILE HB . . 3.930 2.560 2.368 2.637 . 0 0 "[ . 1 . 2]" 1
1453 1 85 ILE H 1 85 ILE HG12 . . 4.390 2.246 1.972 4.041 . 0 0 "[ . 1 . 2]" 1
1454 1 85 ILE H 1 85 ILE QG . . 3.760 2.127 1.962 2.979 . 0 0 "[ . 1 . 2]" 1
1455 1 85 ILE H 1 85 ILE HG13 . . 4.390 3.509 2.948 3.628 . 0 0 "[ . 1 . 2]" 1
1456 1 85 ILE H 1 85 ILE MG . . 3.870 3.762 3.723 3.765 . 0 0 "[ . 1 . 2]" 1
1457 1 85 ILE HA 1 85 ILE MD . . 3.450 2.200 1.966 3.476 0.026 7 0 "[ . 1 . 2]" 1
1458 1 85 ILE HA 1 85 ILE QG . . 3.650 2.864 2.134 2.972 . 0 0 "[ . 1 . 2]" 1
1459 1 85 ILE HA 1 85 ILE MG . . 3.120 2.344 2.294 2.477 . 0 0 "[ . 1 . 2]" 1
1460 1 85 ILE HA 1 88 LEU HB2 . . 3.980 2.664 1.991 3.579 . 0 0 "[ . 1 . 2]" 1
1461 1 85 ILE HA 1 88 LEU QD . . 4.010 2.714 1.976 3.596 . 0 0 "[ . 1 . 2]" 1
1462 1 85 ILE HA 1 95 VAL MG1 . . 4.950 4.205 2.995 4.950 0.000 12 0 "[ . 1 . 2]" 1
1463 1 85 ILE HA 1 95 VAL QG . . 4.300 3.583 2.677 4.048 . 0 0 "[ . 1 . 2]" 1
1464 1 85 ILE HA 1 95 VAL MG2 . . 4.950 4.070 2.817 4.883 . 0 0 "[ . 1 . 2]" 1
1465 1 85 ILE MD 1 85 ILE MG . . 3.010 2.106 1.918 3.039 0.029 7 0 "[ . 1 . 2]" 1
1466 1 85 ILE MD 1 95 VAL MG1 . . 4.100 3.448 1.923 4.161 0.061 15 0 "[ . 1 . 2]" 1
1467 1 85 ILE MD 1 95 VAL QG . . 3.350 2.711 1.905 3.360 0.010 7 0 "[ . 1 . 2]" 1
1468 1 85 ILE MD 1 95 VAL MG2 . . 4.100 2.969 1.912 3.929 . 0 0 "[ . 1 . 2]" 1
1469 1 85 ILE QG 1 85 ILE MG . . 3.260 2.217 1.924 2.296 . 0 0 "[ . 1 . 2]" 1
1470 1 85 ILE HG12 1 85 ILE MG . . 3.750 3.067 1.957 3.201 . 0 0 "[ . 1 . 2]" 1
1471 1 85 ILE HG13 1 85 ILE MG . . 3.750 2.352 2.235 2.843 . 0 0 "[ . 1 . 2]" 1
1472 1 85 ILE MG 1 86 LYS H . . 4.080 3.352 3.107 3.684 . 0 0 "[ . 1 . 2]" 1
1473 1 85 ILE MG 1 86 LYS HA . . 3.920 3.493 3.286 3.658 . 0 0 "[ . 1 . 2]" 1
1474 1 85 ILE MG 1 86 LYS QD . . 3.750 3.483 3.036 3.757 0.007 7 0 "[ . 1 . 2]" 1
1475 1 85 ILE MG 1 89 GLN H . . 5.010 4.096 3.811 4.426 . 0 0 "[ . 1 . 2]" 1
1476 1 85 ILE MG 1 89 GLN HA . . 5.150 5.097 4.667 5.157 0.007 10 0 "[ . 1 . 2]" 1
1477 1 85 ILE MG 1 89 GLN QG . . 3.810 3.040 2.539 3.812 0.002 2 0 "[ . 1 . 2]" 1
1478 1 85 ILE MG 1 95 VAL HB . . 5.020 3.570 2.341 4.082 . 0 0 "[ . 1 . 2]" 1
1479 1 86 LYS H 1 86 LYS QB . . 3.400 2.300 2.088 2.542 . 0 0 "[ . 1 . 2]" 1
1480 1 86 LYS H 1 86 LYS QD . . 4.690 3.074 1.978 3.694 . 0 0 "[ . 1 . 2]" 1
1481 1 86 LYS H 1 86 LYS QG . . 4.480 2.974 1.970 4.035 . 0 0 "[ . 1 . 2]" 1
1482 1 86 LYS H 1 87 SER H . . 4.460 2.734 2.563 3.032 . 0 0 "[ . 1 . 2]" 1
1483 1 86 LYS HA 1 86 LYS QD . . 3.170 2.348 1.986 3.092 . 0 0 "[ . 1 . 2]" 1
1484 1 86 LYS HA 1 86 LYS HG2 . . 3.850 3.305 2.862 3.655 . 0 0 "[ . 1 . 2]" 1
1485 1 86 LYS HA 1 86 LYS QG . . 3.300 2.594 2.208 2.977 . 0 0 "[ . 1 . 2]" 1
1486 1 86 LYS HA 1 86 LYS HG3 . . 3.850 3.032 2.232 3.835 . 0 0 "[ . 1 . 2]" 1
1487 1 86 LYS HA 1 89 GLN H . . 4.310 3.555 3.071 4.131 . 0 0 "[ . 1 . 2]" 1
1488 1 86 LYS HA 1 89 GLN QB . . 3.730 3.001 2.021 3.742 0.012 4 0 "[ . 1 . 2]" 1
1489 1 86 LYS HA 1 89 GLN HG2 . . 4.790 4.152 1.999 4.788 . 0 0 "[ . 1 . 2]" 1
1490 1 86 LYS HA 1 89 GLN QG . . 4.100 3.042 1.979 3.971 . 0 0 "[ . 1 . 2]" 1
1491 1 86 LYS HA 1 89 GLN HG3 . . 4.790 3.282 2.470 4.792 0.002 17 0 "[ . 1 . 2]" 1
1492 1 86 LYS HA 1 95 VAL QG . . 5.440 4.913 4.134 5.466 0.026 20 0 "[ . 1 . 2]" 1
1493 1 86 LYS QB 1 87 SER H . . 3.860 2.590 2.289 2.905 . 0 0 "[ . 1 . 2]" 1
1494 1 86 LYS QB 1 87 SER HA . . 4.250 3.853 3.707 3.985 . 0 0 "[ . 1 . 2]" 1
1495 1 86 LYS QE 1 86 LYS QG . . 3.290 2.240 2.071 2.667 . 0 0 "[ . 1 . 2]" 1
1496 1 87 SER H 1 87 SER QB . . 3.430 2.365 2.127 2.734 . 0 0 "[ . 1 . 2]" 1
1497 1 87 SER QB 1 88 LEU H . . 4.120 2.799 2.184 3.495 . 0 0 "[ . 1 . 2]" 1
1498 1 87 SER QB 1 91 ALA MB . . 4.280 3.984 3.675 4.280 0.000 12 0 "[ . 1 . 2]" 1
1499 1 88 LEU H 1 88 LEU HB2 . . 3.730 2.224 2.116 2.435 . 0 0 "[ . 1 . 2]" 1
1500 1 88 LEU H 1 88 LEU MD1 . . 4.780 3.325 1.975 3.987 . 0 0 "[ . 1 . 2]" 1
1501 1 88 LEU H 1 88 LEU QD . . 4.040 3.033 1.968 3.434 . 0 0 "[ . 1 . 2]" 1
1502 1 88 LEU H 1 88 LEU MD2 . . 4.780 3.847 2.348 4.362 . 0 0 "[ . 1 . 2]" 1
1503 1 88 LEU HA 1 88 LEU QD . . 3.110 2.201 1.901 2.720 . 0 0 "[ . 1 . 2]" 1
1504 1 88 LEU HA 1 91 ALA MB . . 3.270 2.022 1.931 2.446 . 0 0 "[ . 1 . 2]" 1
1505 1 88 LEU HA 1 93 ILE MD . . 3.430 2.456 1.978 3.560 0.130 20 0 "[ . 1 . 2]" 1
1506 1 88 LEU HA 1 93 ILE MG . . 5.060 4.718 3.735 5.063 0.003 7 0 "[ . 1 . 2]" 1
1507 1 88 LEU HB2 1 89 GLN H . . 3.790 2.941 2.521 3.458 . 0 0 "[ . 1 . 2]" 1
1508 1 88 LEU HB2 1 95 VAL QG . . 4.500 3.709 2.213 4.502 0.002 3 0 "[ . 1 . 2]" 1
1509 1 88 LEU HB3 1 89 GLN H . . 4.200 3.413 2.625 3.866 . 0 0 "[ . 1 . 2]" 1
1510 1 88 LEU HB3 1 93 ILE H . . 4.900 4.231 3.768 4.830 . 0 0 "[ . 1 . 2]" 1
1511 1 88 LEU HB3 1 93 ILE HB . . 4.200 2.239 1.981 3.271 . 0 0 "[ . 1 . 2]" 1
1512 1 88 LEU HB3 1 95 VAL QG . . 4.690 3.632 2.624 4.310 . 0 0 "[ . 1 . 2]" 1
1513 1 88 LEU QD 1 89 GLN H . . 5.440 4.098 3.879 4.282 . 0 0 "[ . 1 . 2]" 1
1514 1 88 LEU QD 1 91 ALA MB . . 3.660 2.860 2.074 3.658 . 0 0 "[ . 1 . 2]" 1
1515 1 88 LEU QD 1 93 ILE HB . . 4.570 2.760 2.017 3.503 . 0 0 "[ . 1 . 2]" 1
1516 1 89 GLN H 1 89 GLN QB . . 3.670 2.300 2.091 2.590 . 0 0 "[ . 1 . 2]" 1
1517 1 89 GLN H 1 89 GLN QG . . 3.970 2.644 1.978 3.772 . 0 0 "[ . 1 . 2]" 1
1518 1 89 GLN HA 1 89 GLN HG2 . . 3.910 2.599 2.193 3.727 . 0 0 "[ . 1 . 2]" 1
1519 1 89 GLN HA 1 89 GLN QG . . 3.420 2.473 2.157 3.326 . 0 0 "[ . 1 . 2]" 1
1520 1 89 GLN HA 1 89 GLN HG3 . . 3.910 3.370 2.694 3.739 . 0 0 "[ . 1 . 2]" 1
1521 1 89 GLN HA 1 95 VAL QG . . 3.880 3.405 2.349 3.933 0.053 17 0 "[ . 1 . 2]" 1
1522 1 89 GLN QB 1 90 LYS H . . 4.280 2.636 2.171 3.380 . 0 0 "[ . 1 . 2]" 1
1523 1 89 GLN QB 1 95 VAL QG . . 5.280 3.879 1.977 4.691 . 0 0 "[ . 1 . 2]" 1
1524 1 89 GLN QE 1 95 VAL QG . . 5.200 3.349 1.873 5.160 . 0 0 "[ . 1 . 2]" 1
1525 1 89 GLN QG 1 95 VAL QG . . 3.460 2.495 1.946 3.499 0.039 17 0 "[ . 1 . 2]" 1
1526 1 90 LYS H 1 90 LYS QB . . 3.150 2.308 2.150 2.474 . 0 0 "[ . 1 . 2]" 1
1527 1 90 LYS H 1 91 ALA H . . 4.040 2.322 2.299 2.497 . 0 0 "[ . 1 . 2]" 1
1528 1 90 LYS HA 1 90 LYS QD . . 3.100 2.519 2.014 3.113 0.013 10 0 "[ . 1 . 2]" 1
1529 1 90 LYS HA 1 90 LYS QG . . 3.740 2.582 2.106 2.927 . 0 0 "[ . 1 . 2]" 1
1530 1 90 LYS QB 1 90 LYS QE . . 2.930 2.381 1.973 2.951 0.021 10 0 "[ . 1 . 2]" 1
1531 1 90 LYS QB 1 91 ALA H . . 3.770 2.963 2.786 3.290 . 0 0 "[ . 1 . 2]" 1
1532 1 91 ALA H 1 92 GLY H . . 4.010 2.616 2.595 2.778 . 0 0 "[ . 1 . 2]" 1
1533 1 91 ALA H 1 93 ILE MD . . 4.900 3.704 3.417 4.567 . 0 0 "[ . 1 . 2]" 1
1534 1 91 ALA HA 1 93 ILE MD . . 4.350 4.041 3.868 4.349 . 0 0 "[ . 1 . 2]" 1
1535 1 91 ALA MB 1 93 ILE MD . . 3.430 1.930 1.843 2.208 . 0 0 "[ . 1 . 2]" 1
1536 1 91 ALA MB 1 93 ILE HG12 . . 4.550 4.139 2.073 4.428 . 0 0 "[ . 1 . 2]" 1
1537 1 91 ALA MB 1 93 ILE HG13 . . 4.550 4.073 2.682 4.469 . 0 0 "[ . 1 . 2]" 1
1538 1 92 GLY H 1 93 ILE H . . 3.940 2.074 1.939 2.684 . 0 0 "[ . 1 . 2]" 1
1539 1 93 ILE H 1 93 ILE HB . . 3.570 2.650 2.601 2.780 . 0 0 "[ . 1 . 2]" 1
1540 1 93 ILE H 1 93 ILE QG . . 4.050 3.278 2.153 3.468 . 0 0 "[ . 1 . 2]" 1
1541 1 93 ILE H 1 93 ILE MG . . 3.970 3.850 3.834 3.870 . 0 0 "[ . 1 . 2]" 1
1542 1 93 ILE H 1 94 ARG HA . . 4.840 4.809 4.700 5.012 0.172 20 0 "[ . 1 . 2]" 1
1543 1 93 ILE HA 1 93 ILE MD . . 4.230 3.332 2.179 3.878 . 0 0 "[ . 1 . 2]" 1
1544 1 93 ILE HA 1 93 ILE QG . . 3.740 2.371 2.306 3.141 . 0 0 "[ . 1 . 2]" 1
1545 1 93 ILE HA 1 93 ILE MG . . 3.510 2.334 2.291 2.382 . 0 0 "[ . 1 . 2]" 1
1546 1 93 ILE HA 1 94 ARG H . . 3.170 2.170 2.142 2.190 . 0 0 "[ . 1 . 2]" 1
1547 1 93 ILE HB 1 93 ILE MD . . 3.650 2.205 2.101 3.229 . 0 0 "[ . 1 . 2]" 1
1548 1 93 ILE HB 1 95 VAL QG . . 5.030 4.089 3.063 4.947 . 0 0 "[ . 1 . 2]" 1
1549 1 93 ILE MG 1 94 ARG H . . 4.560 2.909 2.191 3.232 . 0 0 "[ . 1 . 2]" 1
1550 1 93 ILE MG 1 94 ARG HA . . 4.350 4.172 3.807 4.414 0.064 20 0 "[ . 1 . 2]" 1
1551 1 93 ILE MG 1 94 ARG HB2 . . 5.500 4.698 4.097 5.249 . 0 0 "[ . 1 . 2]" 1
1552 1 93 ILE MG 1 94 ARG HB3 . . 5.500 4.784 4.131 5.370 . 0 0 "[ . 1 . 2]" 1
1553 1 93 ILE MG 1 95 VAL HA . . 4.340 3.959 3.506 4.332 . 0 0 "[ . 1 . 2]" 1
1554 1 93 ILE MG 1 95 VAL HB . . 5.500 3.987 3.130 5.183 . 0 0 "[ . 1 . 2]" 1
1555 1 94 ARG H 1 94 ARG QB . . 3.700 2.288 2.052 2.583 . 0 0 "[ . 1 . 2]" 1
1556 1 94 ARG HA 1 94 ARG HD2 . . 4.800 3.485 2.053 4.809 0.009 16 0 "[ . 1 . 2]" 1
1557 1 94 ARG HA 1 94 ARG QD . . 3.920 3.102 1.965 4.070 0.150 16 0 "[ . 1 . 2]" 1
1558 1 94 ARG HA 1 94 ARG HD3 . . 4.800 3.724 2.005 4.728 . 0 0 "[ . 1 . 2]" 1
1559 1 94 ARG HA 1 94 ARG HG2 . . 3.820 3.233 2.275 3.766 . 0 0 "[ . 1 . 2]" 1
1560 1 94 ARG HA 1 94 ARG QG . . 3.230 2.509 2.072 3.345 0.115 16 0 "[ . 1 . 2]" 1
1561 1 94 ARG HA 1 94 ARG HG3 . . 3.820 2.864 2.095 4.034 0.214 16 0 "[ . 1 . 2]" 1
1562 1 94 ARG HA 1 95 VAL H . . 3.080 2.161 2.140 2.197 . 0 0 "[ . 1 . 2]" 1
1563 1 94 ARG HA 1 95 VAL MG1 . . 5.500 4.391 3.512 5.507 0.007 11 0 "[ . 1 . 2]" 1
1564 1 94 ARG HA 1 95 VAL QG . . 4.260 3.640 3.472 3.877 . 0 0 "[ . 1 . 2]" 1
1565 1 94 ARG HA 1 95 VAL MG2 . . 5.500 4.790 3.553 5.530 0.030 20 0 "[ . 1 . 2]" 1
1566 1 94 ARG QB 1 94 ARG QD . . 3.200 2.173 1.966 2.593 . 0 0 "[ . 1 . 2]" 1
1567 1 94 ARG QB 1 95 VAL H . . 4.380 3.671 3.057 3.965 . 0 0 "[ . 1 . 2]" 1
1568 1 94 ARG QG 1 95 VAL H . . 5.090 3.710 2.615 4.758 . 0 0 "[ . 1 . 2]" 1
1569 1 95 VAL H 1 95 VAL HB . . 4.090 2.918 2.520 3.316 . 0 0 "[ . 1 . 2]" 1
1570 1 95 VAL H 1 95 VAL QG . . 3.760 2.130 1.909 2.804 . 0 0 "[ . 1 . 2]" 1
1571 1 95 VAL HA 1 95 VAL MG1 . . 3.320 2.817 2.203 3.200 . 0 0 "[ . 1 . 2]" 1
1572 1 95 VAL HA 1 95 VAL QG . . 2.830 2.191 2.033 2.325 . 0 0 "[ . 1 . 2]" 1
1573 1 95 VAL HA 1 95 VAL MG2 . . 3.320 2.350 2.280 2.440 . 0 0 "[ . 1 . 2]" 1
1574 1 95 VAL HA 1 96 GLU H . . 3.150 2.202 2.142 2.278 . 0 0 "[ . 1 . 2]" 1
1575 1 95 VAL HB 1 96 GLU H . . 4.260 4.024 3.725 4.272 0.012 10 0 "[ . 1 . 2]" 1
1576 1 95 VAL QG 1 96 GLU H . . 3.880 2.305 1.919 2.923 . 0 0 "[ . 1 . 2]" 1
1577 1 95 VAL QG 1 96 GLU HA . . 4.640 3.655 3.266 4.135 . 0 0 "[ . 1 . 2]" 1
1578 1 95 VAL QG 1 96 GLU QG . . 5.070 4.162 3.342 5.075 0.005 14 0 "[ . 1 . 2]" 1
1579 1 95 VAL QG 1 97 LYS HA . . 4.570 4.312 4.084 4.574 0.004 14 0 "[ . 1 . 2]" 1
1580 1 95 VAL QG 1 97 LYS HB3 . . 4.340 3.827 3.021 4.345 0.005 17 0 "[ . 1 . 2]" 1
1581 1 96 GLU H 1 96 GLU QB . . 3.650 2.633 2.183 3.130 . 0 0 "[ . 1 . 2]" 1
1582 1 96 GLU H 1 96 GLU QG . . 4.380 2.987 1.933 4.074 . 0 0 "[ . 1 . 2]" 1
1583 1 96 GLU HA 1 96 GLU QG . . 3.460 3.058 2.502 3.380 . 0 0 "[ . 1 . 2]" 1
1584 1 96 GLU HA 1 97 LYS H . . 2.980 2.161 2.143 2.283 . 0 0 "[ . 1 . 2]" 1
1585 1 96 GLU QB 1 97 LYS H . . 4.300 3.521 2.685 3.922 . 0 0 "[ . 1 . 2]" 1
1586 1 96 GLU QG 1 97 LYS H . . 4.860 3.836 3.057 4.451 . 0 0 "[ . 1 . 2]" 1
1587 1 96 GLU QG 1 97 LYS HA . . 5.040 4.057 3.540 4.987 . 0 0 "[ . 1 . 2]" 1
1588 1 97 LYS H 1 97 LYS HB2 . . 4.000 3.297 2.914 3.939 . 0 0 "[ . 1 . 2]" 1
1589 1 97 LYS H 1 97 LYS HB3 . . 3.620 2.790 2.526 3.177 . 0 0 "[ . 1 . 2]" 1
1590 1 97 LYS HA 1 97 LYS QD . . 4.250 3.180 2.007 3.824 . 0 0 "[ . 1 . 2]" 1
1591 1 97 LYS HA 1 97 LYS QE . . 4.920 4.417 2.468 4.900 . 0 0 "[ . 1 . 2]" 1
1592 1 97 LYS HA 1 97 LYS HG2 . . 4.230 2.958 2.280 4.229 . 0 0 "[ . 1 . 2]" 1
1593 1 97 LYS HA 1 97 LYS QG . . 3.670 2.673 2.252 3.431 . 0 0 "[ . 1 . 2]" 1
1594 1 97 LYS HA 1 97 LYS HG3 . . 4.230 3.469 3.243 3.629 . 0 0 "[ . 1 . 2]" 1
1595 1 97 LYS HA 1 98 GLN H . . 3.100 2.207 2.142 2.358 . 0 0 "[ . 1 . 2]" 1
1596 1 97 LYS HA 1 98 GLN QG . . 4.510 3.888 3.446 4.304 . 0 0 "[ . 1 . 2]" 1
1597 1 97 LYS HB2 1 97 LYS QE . . 4.480 3.433 2.461 4.171 . 0 0 "[ . 1 . 2]" 1
1598 1 97 LYS HB2 1 98 GLN H . . 5.210 3.987 2.612 4.552 . 0 0 "[ . 1 . 2]" 1
1599 1 97 LYS HB3 1 98 GLN H . . 4.800 4.093 3.802 4.468 . 0 0 "[ . 1 . 2]" 1
1600 1 97 LYS QD 1 98 GLN H . . 4.600 2.822 1.919 3.896 . 0 0 "[ . 1 . 2]" 1
1601 1 97 LYS QD 1 98 GLN HA . . 4.280 3.749 2.538 4.297 0.017 14 0 "[ . 1 . 2]" 1
1602 1 97 LYS QD 1 98 GLN QG . . 4.520 4.348 3.472 4.526 0.006 19 0 "[ . 1 . 2]" 1
1603 1 97 LYS QE 1 97 LYS QG . . 3.110 2.138 1.993 2.459 . 0 0 "[ . 1 . 2]" 1
1604 1 97 LYS QG 1 98 GLN H . . 4.650 2.776 2.064 4.101 . 0 0 "[ . 1 . 2]" 1
1605 1 98 GLN H 1 98 GLN QB . . 3.600 2.587 2.167 3.328 . 0 0 "[ . 1 . 2]" 1
1606 1 98 GLN H 1 98 GLN QG . . 3.910 2.545 1.948 3.442 . 0 0 "[ . 1 . 2]" 1
1607 1 98 GLN HA 1 98 GLN QG . . 3.520 2.748 2.151 3.457 . 0 0 "[ . 1 . 2]" 1
1608 1 98 GLN HA 1 99 SER H . . 2.920 2.217 2.139 2.448 . 0 0 "[ . 1 . 2]" 1
1609 1 98 GLN QB 1 98 GLN QG . . 2.350 2.054 1.968 2.085 . 0 0 "[ . 1 . 2]" 1
1610 1 99 SER H 1 99 SER QB . . 3.430 2.727 2.317 3.048 . 0 0 "[ . 1 . 2]" 1
1611 1 99 SER HA 1 99 SER QB . . 2.550 2.319 2.180 2.478 . 0 0 "[ . 1 . 2]" 1
1612 1 99 SER HA 1 100 LEU H . . 3.330 2.372 2.139 2.642 . 0 0 "[ . 1 . 2]" 1
1613 1 99 SER QB 1 100 LEU H . . 4.160 2.890 2.095 3.816 . 0 0 "[ . 1 . 2]" 1
1614 1 100 LEU H 1 100 LEU HG . . 3.190 2.614 1.971 3.189 . 0 0 "[ . 1 . 2]" 1
1615 1 100 LEU HA 1 100 LEU MD1 . . 4.410 3.791 3.351 4.091 . 0 0 "[ . 1 . 2]" 1
1616 1 100 LEU HA 1 100 LEU QD . . 3.430 2.809 2.179 3.394 . 0 0 "[ . 1 . 2]" 1
1617 1 100 LEU HA 1 100 LEU MD2 . . 4.410 3.079 2.191 4.088 . 0 0 "[ . 1 . 2]" 1
1618 1 100 LEU HA 1 101 VAL H . . 3.290 2.305 2.161 2.554 . 0 0 "[ . 1 . 2]" 1
1619 1 100 LEU HA 1 101 VAL HA . . 4.600 4.414 4.305 4.603 0.003 8 0 "[ . 1 . 2]" 1
1620 1 100 LEU HA 1 101 VAL QG . . 4.190 3.487 3.144 3.863 . 0 0 "[ . 1 . 2]" 1
1621 1 101 VAL H 1 101 VAL HB . . 4.010 3.223 2.498 3.797 . 0 0 "[ . 1 . 2]" 1
1622 1 101 VAL H 1 101 VAL MG1 . . 4.430 2.890 2.007 3.890 . 0 0 "[ . 1 . 2]" 1
1623 1 101 VAL H 1 101 VAL QG . . 3.870 2.108 1.870 2.597 . 0 0 "[ . 1 . 2]" 1
1624 1 101 VAL H 1 101 VAL MG2 . . 4.430 2.515 1.957 3.892 . 0 0 "[ . 1 . 2]" 1
1625 1 101 VAL HA 1 102 PHE H . . 3.280 2.244 2.143 2.365 . 0 0 "[ . 1 . 2]" 1
1626 1 101 VAL HA 1 102 PHE QD . . 5.420 4.314 3.471 5.419 . 0 0 "[ . 1 . 2]" 1
1627 1 101 VAL HB 1 102 PHE H . . 4.880 3.381 2.471 4.323 . 0 0 "[ . 1 . 2]" 1
1628 1 102 PHE HA 1 102 PHE QD . . 3.790 3.082 2.192 3.728 . 0 0 "[ . 1 . 2]" 1
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