NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
419322 |
2e9k   |
10149 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2e9k
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 2374
_Distance_constraint_stats_list.Viol_count 390
_Distance_constraint_stats_list.Viol_total 121.592
_Distance_constraint_stats_list.Viol_max 0.200
_Distance_constraint_stats_list.Viol_rms 0.0028
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0156
_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 6 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ASP 0.052 0.036 14 0 "[ . 1 . 2]"
1 9 ILE 0.235 0.036 14 0 "[ . 1 . 2]"
1 10 ARG 0.258 0.036 16 0 "[ . 1 . 2]"
1 11 PRO 0.016 0.014 3 0 "[ . 1 . 2]"
1 12 SER 0.000 0.000 4 0 "[ . 1 . 2]"
1 13 LYS 0.076 0.076 18 0 "[ . 1 . 2]"
1 14 LEU 0.028 0.012 4 0 "[ . 1 . 2]"
1 15 LEU 0.071 0.021 1 0 "[ . 1 . 2]"
1 16 THR 0.004 0.004 15 0 "[ . 1 . 2]"
1 17 TRP 0.006 0.003 15 0 "[ . 1 . 2]"
1 18 CYS 0.004 0.002 12 0 "[ . 1 . 2]"
1 19 GLN 0.002 0.002 12 0 "[ . 1 . 2]"
1 20 GLN 0.001 0.001 10 0 "[ . 1 . 2]"
1 21 GLN 0.006 0.003 15 0 "[ . 1 . 2]"
1 22 THR 0.013 0.005 18 0 "[ . 1 . 2]"
1 23 GLU 0.392 0.150 12 0 "[ . 1 . 2]"
1 24 GLY 0.365 0.150 12 0 "[ . 1 . 2]"
1 25 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 GLN 0.124 0.062 5 0 "[ . 1 . 2]"
1 27 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 ASN 0.016 0.016 9 0 "[ . 1 . 2]"
1 30 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 THR 0.009 0.004 17 0 "[ . 1 . 2]"
1 35 THR 0.011 0.007 18 0 "[ . 1 . 2]"
1 36 SER 0.006 0.006 14 0 "[ . 1 . 2]"
1 37 TRP 0.053 0.012 8 0 "[ . 1 . 2]"
1 38 ARG 0.079 0.012 8 0 "[ . 1 . 2]"
1 39 SER 0.001 0.001 9 0 "[ . 1 . 2]"
1 40 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 LEU 0.005 0.003 12 0 "[ . 1 . 2]"
1 42 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 CYS 0.020 0.017 20 0 "[ . 1 . 2]"
1 45 ALA 0.012 0.007 15 0 "[ . 1 . 2]"
1 46 ILE 0.016 0.008 17 0 "[ . 1 . 2]"
1 47 ILE 0.006 0.005 11 0 "[ . 1 . 2]"
1 48 HIS 0.013 0.006 19 0 "[ . 1 . 2]"
1 49 ARG 0.025 0.020 16 0 "[ . 1 . 2]"
1 50 PHE 0.196 0.154 17 0 "[ . 1 . 2]"
1 51 ARG 0.033 0.031 17 0 "[ . 1 . 2]"
1 52 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 GLU 0.018 0.018 11 0 "[ . 1 . 2]"
1 54 LEU 0.009 0.002 12 0 "[ . 1 . 2]"
1 55 ILE 0.034 0.017 20 0 "[ . 1 . 2]"
1 56 ASN 0.042 0.030 4 0 "[ . 1 . 2]"
1 57 PHE 0.007 0.004 12 0 "[ . 1 . 2]"
1 58 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 SER 0.026 0.007 4 0 "[ . 1 . 2]"
1 60 LEU 0.055 0.013 11 0 "[ . 1 . 2]"
1 61 ASN 0.942 0.152 8 0 "[ . 1 . 2]"
1 62 GLU 0.004 0.002 18 0 "[ . 1 . 2]"
1 63 ASP 0.083 0.023 11 0 "[ . 1 . 2]"
1 64 ASP 0.020 0.005 5 0 "[ . 1 . 2]"
1 65 ALA 0.017 0.005 5 0 "[ . 1 . 2]"
1 66 VAL 0.021 0.004 12 0 "[ . 1 . 2]"
1 67 GLU 0.002 0.001 12 0 "[ . 1 . 2]"
1 68 ASN 0.015 0.003 4 0 "[ . 1 . 2]"
1 69 ASN 0.002 0.002 1 0 "[ . 1 . 2]"
1 70 GLN 0.094 0.062 1 0 "[ . 1 . 2]"
1 71 LEU 0.009 0.004 11 0 "[ . 1 . 2]"
1 72 ALA 0.014 0.007 15 0 "[ . 1 . 2]"
1 73 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 ASP 0.010 0.004 11 0 "[ . 1 . 2]"
1 75 VAL 0.068 0.047 20 0 "[ . 1 . 2]"
1 76 ALA 0.180 0.102 20 0 "[ . 1 . 2]"
1 77 GLU 0.012 0.004 4 0 "[ . 1 . 2]"
1 78 ARG 0.047 0.036 15 0 "[ . 1 . 2]"
1 79 GLU 0.118 0.047 20 0 "[ . 1 . 2]"
1 80 PHE 0.235 0.102 20 0 "[ . 1 . 2]"
1 81 GLY 0.104 0.057 20 0 "[ . 1 . 2]"
1 82 ILE 0.069 0.008 19 0 "[ . 1 . 2]"
1 83 PRO 0.005 0.004 4 0 "[ . 1 . 2]"
1 84 PRO 0.003 0.003 3 0 "[ . 1 . 2]"
1 85 VAL 0.013 0.005 7 0 "[ . 1 . 2]"
1 86 THR 0.011 0.007 20 0 "[ . 1 . 2]"
1 87 THR 0.014 0.005 17 0 "[ . 1 . 2]"
1 88 GLY 0.004 0.004 1 0 "[ . 1 . 2]"
1 89 LYS 0.038 0.014 12 0 "[ . 1 . 2]"
1 90 GLU 0.011 0.005 17 0 "[ . 1 . 2]"
1 91 MET 0.038 0.008 13 0 "[ . 1 . 2]"
1 92 ALA 0.018 0.005 17 0 "[ . 1 . 2]"
1 93 SER 0.011 0.011 17 0 "[ . 1 . 2]"
1 94 ALA 0.001 0.001 9 0 "[ . 1 . 2]"
1 95 GLN 0.011 0.011 17 0 "[ . 1 . 2]"
1 96 GLU 0.754 0.053 9 0 "[ . 1 . 2]"
1 97 PRO 0.732 0.051 9 0 "[ . 1 . 2]"
1 98 ASP 0.035 0.011 13 0 "[ . 1 . 2]"
1 99 LYS 0.015 0.010 8 0 "[ . 1 . 2]"
1 100 LEU 0.395 0.049 13 0 "[ . 1 . 2]"
1 101 SER 0.108 0.024 13 0 "[ . 1 . 2]"
1 102 MET 0.055 0.015 20 0 "[ . 1 . 2]"
1 103 VAL 0.004 0.003 9 0 "[ . 1 . 2]"
1 104 MET 0.074 0.024 13 0 "[ . 1 . 2]"
1 105 TYR 0.006 0.003 17 0 "[ . 1 . 2]"
1 106 LEU 0.015 0.015 13 0 "[ . 1 . 2]"
1 107 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 LYS 0.572 0.200 18 0 "[ . 1 . 2]"
1 109 PHE 0.043 0.007 2 0 "[ . 1 . 2]"
1 110 TYR 0.004 0.001 15 0 "[ . 1 . 2]"
1 111 GLU 0.004 0.001 15 0 "[ . 1 . 2]"
1 112 LEU 0.031 0.031 20 0 "[ . 1 . 2]"
1 113 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 114 ARG 0.001 0.001 7 0 "[ . 1 . 2]"
1 115 GLY 0.001 0.001 7 0 "[ . 1 . 2]"
1 116 THR 0.998 0.075 14 0 "[ . 1 . 2]"
1 117 PRO 0.998 0.075 14 0 "[ . 1 . 2]"
1 118 LEU 0.009 0.009 4 0 "[ . 1 . 2]"
1 119 ARG 0.062 0.053 14 0 "[ . 1 . 2]"
1 120 PRO 0.053 0.053 14 0 "[ . 1 . 2]"
1 121 VAL 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 6 SER QB 1 7 GLY H . . 4.430 3.269 1.949 3.936 . 0 0 "[ . 1 . 2]" 1
2 1 7 GLY QA 1 8 ASP HA . . 4.450 3.995 3.929 4.345 . 0 0 "[ . 1 . 2]" 1
3 1 8 ASP H 1 8 ASP QB . . 3.510 2.573 2.237 3.193 . 0 0 "[ . 1 . 2]" 1
4 1 8 ASP HA 1 9 ILE H . . 2.960 2.373 2.139 2.947 . 0 0 "[ . 1 . 2]" 1
5 1 8 ASP QB 1 9 ILE H . . 3.840 3.043 2.008 3.856 0.016 20 0 "[ . 1 . 2]" 1
6 1 8 ASP HB2 1 9 ILE H . . 4.410 3.697 2.296 4.446 0.036 14 0 "[ . 1 . 2]" 1
7 1 8 ASP HB3 1 9 ILE H . . 4.410 3.512 2.038 4.349 . 0 0 "[ . 1 . 2]" 1
8 1 9 ILE H 1 9 ILE HB . . 3.300 2.570 2.370 3.044 . 0 0 "[ . 1 . 2]" 1
9 1 9 ILE H 1 9 ILE MD . . 4.560 3.350 2.093 3.910 . 0 0 "[ . 1 . 2]" 1
10 1 9 ILE H 1 9 ILE HG12 . . 4.200 3.137 2.061 4.121 . 0 0 "[ . 1 . 2]" 1
11 1 9 ILE H 1 9 ILE QG . . 3.460 2.413 1.876 3.243 . 0 0 "[ . 1 . 2]" 1
12 1 9 ILE H 1 9 ILE HG13 . . 4.200 3.066 1.891 3.993 . 0 0 "[ . 1 . 2]" 1
13 1 9 ILE H 1 9 ILE MG . . 3.860 3.788 3.721 3.862 0.002 9 0 "[ . 1 . 2]" 1
14 1 9 ILE H 1 10 ARG H . . 4.580 4.531 4.431 4.608 0.028 13 0 "[ . 1 . 2]" 1
15 1 9 ILE HA 1 9 ILE MD . . 4.000 3.015 1.934 3.948 . 0 0 "[ . 1 . 2]" 1
16 1 9 ILE HA 1 9 ILE HG12 . . 4.200 2.942 2.575 3.495 . 0 0 "[ . 1 . 2]" 1
17 1 9 ILE HA 1 9 ILE QG . . 3.680 2.661 2.188 3.277 . 0 0 "[ . 1 . 2]" 1
18 1 9 ILE HA 1 9 ILE HG13 . . 4.200 3.233 2.213 3.963 . 0 0 "[ . 1 . 2]" 1
19 1 9 ILE HA 1 9 ILE MG . . 3.640 2.348 2.164 2.521 . 0 0 "[ . 1 . 2]" 1
20 1 9 ILE HA 1 10 ARG H . . 3.060 2.252 2.139 2.437 . 0 0 "[ . 1 . 2]" 1
21 1 9 ILE HB 1 10 ARG H . . 4.920 3.879 2.994 4.356 . 0 0 "[ . 1 . 2]" 1
22 1 9 ILE QG 1 10 ARG H . . 4.390 4.229 3.883 4.404 0.014 16 0 "[ . 1 . 2]" 1
23 1 9 ILE HG12 1 10 ARG H . . 5.020 4.703 4.243 4.993 . 0 0 "[ . 1 . 2]" 1
24 1 9 ILE HG13 1 10 ARG H . . 5.020 4.852 4.075 5.054 0.034 2 0 "[ . 1 . 2]" 1
25 1 9 ILE MG 1 10 ARG H . . 4.140 2.218 1.766 2.917 . 0 0 "[ . 1 . 2]" 1
26 1 9 ILE MG 1 10 ARG QB . . 3.980 3.464 2.852 3.997 0.017 18 0 "[ . 1 . 2]" 1
27 1 9 ILE MG 1 12 SER QB . . 4.480 2.236 1.728 3.912 . 0 0 "[ . 1 . 2]" 1
28 1 10 ARG H 1 10 ARG HB2 . . 4.180 2.180 2.145 2.318 . 0 0 "[ . 1 . 2]" 1
29 1 10 ARG H 1 10 ARG QB . . 3.480 2.158 2.125 2.291 . 0 0 "[ . 1 . 2]" 1
30 1 10 ARG H 1 10 ARG HB3 . . 4.180 3.463 3.434 3.573 . 0 0 "[ . 1 . 2]" 1
31 1 10 ARG H 1 10 ARG QG . . 3.260 3.057 2.681 3.296 0.036 16 0 "[ . 1 . 2]" 1
32 1 10 ARG H 1 11 PRO HD2 . . 4.660 1.930 1.799 2.458 . 0 0 "[ . 1 . 2]" 1
33 1 10 ARG H 1 11 PRO QD . . 4.050 1.911 1.788 2.410 . 0 0 "[ . 1 . 2]" 1
34 1 10 ARG H 1 11 PRO HD3 . . 4.660 3.092 2.930 3.464 . 0 0 "[ . 1 . 2]" 1
35 1 10 ARG HA 1 10 ARG QD . . 4.490 3.350 1.975 4.048 . 0 0 "[ . 1 . 2]" 1
36 1 10 ARG HA 1 11 PRO QD . . 3.540 3.467 3.464 3.470 . 0 0 "[ . 1 . 2]" 1
37 1 10 ARG QB 1 11 PRO QD . . 3.140 1.780 1.687 1.854 . 0 0 "[ . 1 . 2]" 1
38 1 10 ARG HB2 1 11 PRO HD2 . . 4.510 2.374 2.188 2.532 . 0 0 "[ . 1 . 2]" 1
39 1 10 ARG HB2 1 11 PRO HD3 . . 4.510 1.957 1.933 1.976 . 0 0 "[ . 1 . 2]" 1
40 1 10 ARG HB3 1 11 PRO HD2 . . 4.510 3.316 3.073 3.529 . 0 0 "[ . 1 . 2]" 1
41 1 10 ARG HB3 1 11 PRO HD3 . . 4.510 2.310 2.026 2.566 . 0 0 "[ . 1 . 2]" 1
42 1 10 ARG QG 1 11 PRO QD . . 3.920 3.540 3.339 3.690 . 0 0 "[ . 1 . 2]" 1
43 1 10 ARG HG2 1 11 PRO HD2 . . 5.140 4.822 4.413 5.154 0.014 3 0 "[ . 1 . 2]" 1
44 1 10 ARG HG2 1 11 PRO HD3 . . 5.140 4.511 4.323 4.713 . 0 0 "[ . 1 . 2]" 1
45 1 10 ARG HG3 1 11 PRO HD2 . . 5.140 4.503 4.355 4.803 . 0 0 "[ . 1 . 2]" 1
46 1 10 ARG HG3 1 11 PRO HD3 . . 5.140 4.205 3.818 4.483 . 0 0 "[ . 1 . 2]" 1
47 1 11 PRO HA 1 14 LEU H . . 4.140 3.526 3.024 3.797 . 0 0 "[ . 1 . 2]" 1
48 1 11 PRO HA 1 14 LEU HB2 . . 4.040 3.623 3.032 4.005 . 0 0 "[ . 1 . 2]" 1
49 1 11 PRO HA 1 14 LEU HB3 . . 3.670 2.693 2.377 3.214 . 0 0 "[ . 1 . 2]" 1
50 1 11 PRO HA 1 14 LEU MD2 . . 3.890 3.134 2.638 3.626 . 0 0 "[ . 1 . 2]" 1
51 1 11 PRO HA 1 15 LEU H . . 4.950 4.091 3.742 4.550 . 0 0 "[ . 1 . 2]" 1
52 1 11 PRO HA 1 33 LEU MD1 . . 3.960 3.604 3.104 3.955 . 0 0 "[ . 1 . 2]" 1
53 1 11 PRO HA 1 103 VAL MG2 . . 4.040 3.600 2.881 4.041 0.001 1 0 "[ . 1 . 2]" 1
54 1 11 PRO QB 1 33 LEU MD1 . . 3.550 2.489 1.802 3.243 . 0 0 "[ . 1 . 2]" 1
55 1 11 PRO HB2 1 33 LEU MD1 . . 4.300 2.605 1.844 3.442 . 0 0 "[ . 1 . 2]" 1
56 1 11 PRO HB3 1 33 LEU MD1 . . 4.300 3.230 2.535 3.964 . 0 0 "[ . 1 . 2]" 1
57 1 12 SER HA 1 14 LEU H . . 5.080 4.681 3.929 4.988 . 0 0 "[ . 1 . 2]" 1
58 1 12 SER HA 1 15 LEU H . . 4.140 3.901 3.587 4.140 0.000 4 0 "[ . 1 . 2]" 1
59 1 12 SER HA 1 15 LEU HB2 . . 4.220 3.992 3.372 4.219 . 0 0 "[ . 1 . 2]" 1
60 1 12 SER HA 1 15 LEU QB . . 3.660 3.131 2.787 3.633 . 0 0 "[ . 1 . 2]" 1
61 1 12 SER HA 1 15 LEU HB3 . . 4.220 3.284 2.972 4.012 . 0 0 "[ . 1 . 2]" 1
62 1 12 SER HA 1 15 LEU MD2 . . 4.450 3.576 3.165 4.154 . 0 0 "[ . 1 . 2]" 1
63 1 12 SER HA 1 16 THR H . . 5.500 4.585 4.237 5.213 . 0 0 "[ . 1 . 2]" 1
64 1 13 LYS H 1 14 LEU H . . 4.380 2.755 2.201 3.115 . 0 0 "[ . 1 . 2]" 1
65 1 13 LYS HA 1 13 LYS QD . . 4.030 3.232 2.037 4.106 0.076 18 0 "[ . 1 . 2]" 1
66 1 13 LYS HA 1 13 LYS HG2 . . 4.190 2.991 2.205 3.815 . 0 0 "[ . 1 . 2]" 1
67 1 13 LYS HA 1 13 LYS QG . . 3.580 2.488 2.151 3.326 . 0 0 "[ . 1 . 2]" 1
68 1 13 LYS HA 1 13 LYS HG3 . . 4.190 3.006 2.191 3.991 . 0 0 "[ . 1 . 2]" 1
69 1 13 LYS QB 1 13 LYS QD . . 3.330 2.198 2.008 2.483 . 0 0 "[ . 1 . 2]" 1
70 1 13 LYS QB 1 13 LYS QE . . 3.900 2.994 2.004 3.818 . 0 0 "[ . 1 . 2]" 1
71 1 13 LYS QB 1 14 LEU H . . 3.390 2.509 2.118 3.068 . 0 0 "[ . 1 . 2]" 1
72 1 13 LYS QE 1 13 LYS HG2 . . 3.720 2.712 2.087 3.515 . 0 0 "[ . 1 . 2]" 1
73 1 13 LYS QE 1 13 LYS HG3 . . 3.720 2.664 2.113 3.489 . 0 0 "[ . 1 . 2]" 1
74 1 13 LYS QG 1 14 LEU H . . 4.820 3.915 1.909 4.414 . 0 0 "[ . 1 . 2]" 1
75 1 14 LEU H 1 14 LEU HB2 . . 3.470 2.617 2.438 2.709 . 0 0 "[ . 1 . 2]" 1
76 1 14 LEU H 1 14 LEU HB3 . . 3.600 2.412 2.317 2.588 . 0 0 "[ . 1 . 2]" 1
77 1 14 LEU H 1 14 LEU MD1 . . 4.270 4.151 4.027 4.240 . 0 0 "[ . 1 . 2]" 1
78 1 14 LEU H 1 14 LEU MD2 . . 4.220 4.173 4.048 4.232 0.012 4 0 "[ . 1 . 2]" 1
79 1 14 LEU H 1 14 LEU HG . . 5.320 4.418 4.356 4.506 . 0 0 "[ . 1 . 2]" 1
80 1 14 LEU H 1 15 LEU H . . 3.500 2.920 2.622 3.129 . 0 0 "[ . 1 . 2]" 1
81 1 14 LEU H 1 15 LEU QB . . 5.070 4.547 4.326 4.662 . 0 0 "[ . 1 . 2]" 1
82 1 14 LEU HA 1 14 LEU MD1 . . 3.220 2.314 2.023 2.644 . 0 0 "[ . 1 . 2]" 1
83 1 14 LEU HA 1 14 LEU MD2 . . 4.090 3.950 3.845 4.013 . 0 0 "[ . 1 . 2]" 1
84 1 14 LEU HA 1 17 TRP H . . 4.060 3.758 3.513 3.996 . 0 0 "[ . 1 . 2]" 1
85 1 14 LEU HA 1 17 TRP HB2 . . 4.500 3.890 3.586 4.264 . 0 0 "[ . 1 . 2]" 1
86 1 14 LEU HA 1 17 TRP QB . . 3.830 3.148 2.896 3.416 . 0 0 "[ . 1 . 2]" 1
87 1 14 LEU HA 1 17 TRP HB3 . . 4.500 3.336 2.997 3.701 . 0 0 "[ . 1 . 2]" 1
88 1 14 LEU HA 1 110 TYR QD . . 4.500 3.782 2.887 4.310 . 0 0 "[ . 1 . 2]" 1
89 1 14 LEU HB2 1 14 LEU MD2 . . 3.630 2.443 2.299 2.660 . 0 0 "[ . 1 . 2]" 1
90 1 14 LEU HB2 1 15 LEU H . . 3.960 3.826 3.619 3.961 0.001 14 0 "[ . 1 . 2]" 1
91 1 14 LEU HB3 1 14 LEU MD2 . . 3.480 2.220 1.997 2.384 . 0 0 "[ . 1 . 2]" 1
92 1 14 LEU HB3 1 15 LEU H . . 3.540 2.410 2.125 2.641 . 0 0 "[ . 1 . 2]" 1
93 1 14 LEU HB3 1 15 LEU HA . . 5.010 4.357 4.133 4.473 . 0 0 "[ . 1 . 2]" 1
94 1 14 LEU MD1 1 17 TRP H . . 4.980 4.793 4.360 4.968 . 0 0 "[ . 1 . 2]" 1
95 1 14 LEU MD1 1 17 TRP HE3 . . 4.040 3.100 2.711 3.541 . 0 0 "[ . 1 . 2]" 1
96 1 14 LEU MD1 1 18 CYS H . . 4.300 3.943 3.634 4.259 . 0 0 "[ . 1 . 2]" 1
97 1 14 LEU MD1 1 18 CYS HG . . 3.840 2.506 1.961 3.190 . 0 0 "[ . 1 . 2]" 1
98 1 14 LEU MD1 1 106 LEU HB2 . . 4.000 3.156 2.668 3.653 . 0 0 "[ . 1 . 2]" 1
99 1 14 LEU MD1 1 106 LEU QB . . 3.350 2.567 2.109 3.083 . 0 0 "[ . 1 . 2]" 1
100 1 14 LEU MD1 1 106 LEU HB3 . . 4.000 2.734 2.210 3.430 . 0 0 "[ . 1 . 2]" 1
101 1 14 LEU MD1 1 107 SER H . . 4.530 3.707 3.182 4.202 . 0 0 "[ . 1 . 2]" 1
102 1 14 LEU MD1 1 107 SER HA . . 3.580 2.738 2.014 3.307 . 0 0 "[ . 1 . 2]" 1
103 1 14 LEU MD1 1 110 TYR H . . 4.020 3.799 3.421 4.020 . 1 0 "[ . 1 . 2]" 1
104 1 14 LEU MD1 1 110 TYR HA . . 4.350 4.022 3.700 4.258 . 0 0 "[ . 1 . 2]" 1
105 1 14 LEU MD1 1 110 TYR HB2 . . 3.980 2.205 1.816 2.459 . 0 0 "[ . 1 . 2]" 1
106 1 14 LEU MD1 1 110 TYR QB . . 3.370 2.135 1.733 2.388 . 0 0 "[ . 1 . 2]" 1
107 1 14 LEU MD1 1 110 TYR HB3 . . 3.980 2.873 2.192 3.292 . 0 0 "[ . 1 . 2]" 1
108 1 14 LEU MD1 1 110 TYR QD . . 3.920 2.808 2.304 3.250 . 0 0 "[ . 1 . 2]" 1
109 1 14 LEU MD2 1 15 LEU H . . 4.460 3.824 3.488 4.114 . 0 0 "[ . 1 . 2]" 1
110 1 14 LEU MD2 1 103 VAL HA . . 3.490 2.588 2.258 3.003 . 0 0 "[ . 1 . 2]" 1
111 1 14 LEU MD2 1 106 LEU H . . 4.710 4.324 3.995 4.620 . 0 0 "[ . 1 . 2]" 1
112 1 14 LEU MD2 1 106 LEU HB2 . . 3.770 2.292 1.972 2.738 . 0 0 "[ . 1 . 2]" 1
113 1 14 LEU MD2 1 106 LEU QB . . 3.290 2.213 1.909 2.636 . 0 0 "[ . 1 . 2]" 1
114 1 14 LEU MD2 1 106 LEU HB3 . . 3.770 2.959 2.280 3.433 . 0 0 "[ . 1 . 2]" 1
115 1 14 LEU MD2 1 106 LEU MD1 . . 4.170 2.324 1.862 2.697 . 0 0 "[ . 1 . 2]" 1
116 1 14 LEU MD2 1 107 SER H . . 3.850 3.261 2.643 3.656 . 0 0 "[ . 1 . 2]" 1
117 1 14 LEU MD2 1 107 SER HA . . 4.180 3.559 2.855 4.108 . 0 0 "[ . 1 . 2]" 1
118 1 14 LEU MD2 1 107 SER QB . . 4.540 3.859 2.860 4.529 . 0 0 "[ . 1 . 2]" 1
119 1 14 LEU HG 1 15 LEU HA . . 3.690 3.311 3.144 3.640 . 0 0 "[ . 1 . 2]" 1
120 1 14 LEU HG 1 18 CYS HG . . 4.400 2.726 2.188 3.262 . 0 0 "[ . 1 . 2]" 1
121 1 14 LEU HG 1 33 LEU MD2 . . 3.710 3.064 2.537 3.683 . 0 0 "[ . 1 . 2]" 1
122 1 15 LEU H 1 15 LEU HB2 . . 3.290 2.532 2.421 2.641 . 0 0 "[ . 1 . 2]" 1
123 1 15 LEU H 1 15 LEU HB3 . . 3.290 2.492 2.410 2.606 . 0 0 "[ . 1 . 2]" 1
124 1 15 LEU H 1 15 LEU MD1 . . 4.150 4.081 3.973 4.145 . 0 0 "[ . 1 . 2]" 1
125 1 15 LEU H 1 15 LEU MD2 . . 4.660 4.196 4.150 4.246 . 0 0 "[ . 1 . 2]" 1
126 1 15 LEU H 1 15 LEU HG . . 4.680 4.465 4.419 4.511 . 0 0 "[ . 1 . 2]" 1
127 1 15 LEU H 1 16 THR H . . 3.630 2.929 2.725 3.095 . 0 0 "[ . 1 . 2]" 1
128 1 15 LEU H 1 17 TRP H . . 5.070 4.652 4.443 4.992 . 0 0 "[ . 1 . 2]" 1
129 1 15 LEU H 1 33 LEU MD2 . . 4.470 3.668 3.307 4.023 . 0 0 "[ . 1 . 2]" 1
130 1 15 LEU HA 1 15 LEU MD1 . . 3.210 2.277 1.988 2.528 . 0 0 "[ . 1 . 2]" 1
131 1 15 LEU HA 1 15 LEU MD2 . . 3.950 3.942 3.902 3.971 0.021 1 0 "[ . 1 . 2]" 1
132 1 15 LEU HA 1 18 CYS H . . 4.210 3.690 3.588 3.852 . 0 0 "[ . 1 . 2]" 1
133 1 15 LEU HA 1 18 CYS HB2 . . 4.050 2.871 2.672 3.045 . 0 0 "[ . 1 . 2]" 1
134 1 15 LEU HA 1 18 CYS HB3 . . 4.650 4.477 4.227 4.641 . 0 0 "[ . 1 . 2]" 1
135 1 15 LEU HA 1 19 GLN H . . 4.480 3.978 3.852 4.079 . 0 0 "[ . 1 . 2]" 1
136 1 15 LEU HA 1 33 LEU MD1 . . 4.780 3.583 3.126 3.923 . 0 0 "[ . 1 . 2]" 1
137 1 15 LEU HA 1 33 LEU MD2 . . 3.270 2.264 1.967 2.639 . 0 0 "[ . 1 . 2]" 1
138 1 15 LEU HA 1 33 LEU HG . . 4.690 4.300 3.682 4.654 . 0 0 "[ . 1 . 2]" 1
139 1 15 LEU QB 1 15 LEU MD1 . . 3.200 2.198 2.057 2.321 . 0 0 "[ . 1 . 2]" 1
140 1 15 LEU QB 1 16 THR H . . 3.360 2.392 2.118 2.581 . 0 0 "[ . 1 . 2]" 1
141 1 15 LEU QB 1 33 LEU MD1 . . 3.820 2.549 2.098 3.026 . 0 0 "[ . 1 . 2]" 1
142 1 15 LEU QB 1 33 LEU MD2 . . 3.510 2.603 2.105 3.011 . 0 0 "[ . 1 . 2]" 1
143 1 15 LEU QB 1 33 LEU HG . . 4.810 3.224 2.832 3.913 . 0 0 "[ . 1 . 2]" 1
144 1 15 LEU HB2 1 15 LEU MD2 . . 3.530 2.466 2.351 2.608 . 0 0 "[ . 1 . 2]" 1
145 1 15 LEU HB2 1 16 THR H . . 4.190 3.815 3.643 3.927 . 0 0 "[ . 1 . 2]" 1
146 1 15 LEU HB2 1 33 LEU MD2 . . 4.350 2.637 2.119 3.074 . 0 0 "[ . 1 . 2]" 1
147 1 15 LEU HB3 1 15 LEU MD2 . . 3.530 2.196 2.077 2.295 . 0 0 "[ . 1 . 2]" 1
148 1 15 LEU HB3 1 16 THR H . . 4.190 2.418 2.132 2.619 . 0 0 "[ . 1 . 2]" 1
149 1 15 LEU HB3 1 33 LEU MD2 . . 4.350 4.047 3.590 4.322 . 0 0 "[ . 1 . 2]" 1
150 1 15 LEU MD1 1 16 THR H . . 4.550 4.415 4.220 4.554 0.004 15 0 "[ . 1 . 2]" 1
151 1 15 LEU MD1 1 18 CYS HB2 . . 4.280 3.295 2.876 3.632 . 0 0 "[ . 1 . 2]" 1
152 1 15 LEU MD1 1 18 CYS HB3 . . 4.780 4.378 4.070 4.731 . 0 0 "[ . 1 . 2]" 1
153 1 15 LEU MD1 1 19 GLN H . . 4.410 3.842 3.103 4.156 . 0 0 "[ . 1 . 2]" 1
154 1 15 LEU MD1 1 19 GLN HE21 . . 4.520 2.588 1.909 3.340 . 0 0 "[ . 1 . 2]" 1
155 1 15 LEU MD1 1 19 GLN QE . . 3.980 2.513 1.898 3.229 . 0 0 "[ . 1 . 2]" 1
156 1 15 LEU MD1 1 19 GLN HE22 . . 4.520 3.542 3.057 4.286 . 0 0 "[ . 1 . 2]" 1
157 1 15 LEU MD1 1 19 GLN QG . . 3.670 2.486 1.993 3.041 . 0 0 "[ . 1 . 2]" 1
158 1 15 LEU MD1 1 30 VAL MG1 . . 3.100 2.176 1.786 2.621 . 0 0 "[ . 1 . 2]" 1
159 1 15 LEU MD1 1 31 THR H . . 4.740 4.232 3.815 4.697 . 0 0 "[ . 1 . 2]" 1
160 1 15 LEU MD1 1 31 THR HA . . 4.520 3.555 3.156 4.145 . 0 0 "[ . 1 . 2]" 1
161 1 15 LEU MD1 1 32 ASP H . . 4.170 3.835 3.360 4.170 . 0 0 "[ . 1 . 2]" 1
162 1 15 LEU MD1 1 32 ASP HA . . 3.890 3.091 2.530 3.815 . 0 0 "[ . 1 . 2]" 1
163 1 15 LEU MD1 1 33 LEU H . . 5.250 4.123 3.568 4.788 . 0 0 "[ . 1 . 2]" 1
164 1 15 LEU MD1 1 33 LEU HG . . 3.750 2.388 2.035 3.041 . 0 0 "[ . 1 . 2]" 1
165 1 15 LEU MD2 1 16 THR H . . 4.360 3.901 3.434 4.225 . 0 0 "[ . 1 . 2]" 1
166 1 15 LEU MD2 1 19 GLN HE21 . . 4.870 2.891 2.414 3.894 . 0 0 "[ . 1 . 2]" 1
167 1 15 LEU MD2 1 19 GLN QE . . 4.180 2.368 2.012 3.156 . 0 0 "[ . 1 . 2]" 1
168 1 15 LEU MD2 1 19 GLN HE22 . . 4.870 2.569 2.090 3.336 . 0 0 "[ . 1 . 2]" 1
169 1 15 LEU MD2 1 32 ASP HA . . 4.000 3.459 3.054 3.917 . 0 0 "[ . 1 . 2]" 1
170 1 15 LEU HG 1 16 THR H . . 4.200 3.454 3.127 3.857 . 0 0 "[ . 1 . 2]" 1
171 1 15 LEU HG 1 18 CYS H . . 5.500 5.438 5.347 5.501 0.001 18 0 "[ . 1 . 2]" 1
172 1 15 LEU HG 1 19 GLN H . . 4.570 4.045 3.781 4.360 . 0 0 "[ . 1 . 2]" 1
173 1 15 LEU HG 1 19 GLN HB2 . . 5.230 3.845 3.441 4.154 . 0 0 "[ . 1 . 2]" 1
174 1 15 LEU HG 1 19 GLN HE21 . . 4.840 3.099 2.391 4.039 . 0 0 "[ . 1 . 2]" 1
175 1 15 LEU HG 1 19 GLN HE22 . . 4.840 3.344 2.683 4.072 . 0 0 "[ . 1 . 2]" 1
176 1 15 LEU HG 1 19 GLN QG . . 4.700 2.615 2.258 3.119 . 0 0 "[ . 1 . 2]" 1
177 1 16 THR H 1 16 THR HB . . 3.100 2.701 2.577 2.839 . 0 0 "[ . 1 . 2]" 1
178 1 16 THR H 1 16 THR MG . . 4.030 3.761 3.745 3.773 . 0 0 "[ . 1 . 2]" 1
179 1 16 THR H 1 17 TRP H . . 3.530 3.034 2.789 3.290 . 0 0 "[ . 1 . 2]" 1
180 1 16 THR H 1 18 CYS H . . 5.220 4.523 4.112 4.770 . 0 0 "[ . 1 . 2]" 1
181 1 16 THR HA 1 16 THR MG . . 3.220 2.324 2.209 2.429 . 0 0 "[ . 1 . 2]" 1
182 1 16 THR HA 1 18 CYS H . . 5.110 4.758 4.384 5.057 . 0 0 "[ . 1 . 2]" 1
183 1 16 THR HA 1 19 GLN H . . 4.040 3.662 3.391 3.920 . 0 0 "[ . 1 . 2]" 1
184 1 16 THR HA 1 19 GLN HB2 . . 3.620 2.607 2.392 2.778 . 0 0 "[ . 1 . 2]" 1
185 1 16 THR HA 1 19 GLN HB3 . . 4.240 4.111 3.874 4.226 . 0 0 "[ . 1 . 2]" 1
186 1 16 THR HA 1 20 GLN H . . 4.370 4.168 3.976 4.326 . 0 0 "[ . 1 . 2]" 1
187 1 16 THR HB 1 17 TRP H . . 3.280 2.227 1.947 2.428 . 0 0 "[ . 1 . 2]" 1
188 1 16 THR MG 1 17 TRP H . . 3.960 3.257 3.064 3.421 . 0 0 "[ . 1 . 2]" 1
189 1 16 THR MG 1 17 TRP HA . . 4.390 3.500 3.277 3.665 . 0 0 "[ . 1 . 2]" 1
190 1 16 THR MG 1 18 CYS H . . 5.500 5.150 4.836 5.374 . 0 0 "[ . 1 . 2]" 1
191 1 16 THR MG 1 20 GLN HE21 . . 4.460 2.840 2.008 3.722 . 0 0 "[ . 1 . 2]" 1
192 1 16 THR MG 1 20 GLN QE . . 3.890 2.748 1.992 3.500 . 0 0 "[ . 1 . 2]" 1
193 1 16 THR MG 1 20 GLN HE22 . . 4.460 3.892 3.304 4.324 . 0 0 "[ . 1 . 2]" 1
194 1 16 THR MG 1 20 GLN HG2 . . 4.620 3.238 2.440 4.087 . 0 0 "[ . 1 . 2]" 1
195 1 16 THR MG 1 20 GLN QG . . 3.780 2.565 2.257 2.864 . 0 0 "[ . 1 . 2]" 1
196 1 16 THR MG 1 20 GLN HG3 . . 4.620 2.796 2.470 3.376 . 0 0 "[ . 1 . 2]" 1
197 1 17 TRP H 1 17 TRP HB2 . . 3.270 2.473 2.380 2.563 . 0 0 "[ . 1 . 2]" 1
198 1 17 TRP H 1 17 TRP HB3 . . 3.270 2.603 2.495 2.768 . 0 0 "[ . 1 . 2]" 1
199 1 17 TRP H 1 17 TRP HD1 . . 4.960 4.843 4.658 4.962 0.002 15 0 "[ . 1 . 2]" 1
200 1 17 TRP H 1 18 CYS H . . 3.490 2.970 2.757 3.175 . 0 0 "[ . 1 . 2]" 1
201 1 17 TRP H 1 19 GLN H . . 4.930 4.356 4.094 4.649 . 0 0 "[ . 1 . 2]" 1
202 1 17 TRP H 1 110 TYR QE . . 4.960 4.519 3.945 4.947 . 0 0 "[ . 1 . 2]" 1
203 1 17 TRP HA 1 17 TRP HD1 . . 4.110 2.967 2.763 3.171 . 0 0 "[ . 1 . 2]" 1
204 1 17 TRP HA 1 19 GLN H . . 5.010 4.636 4.328 4.919 . 0 0 "[ . 1 . 2]" 1
205 1 17 TRP HA 1 20 GLN H . . 3.990 3.648 3.338 3.834 . 0 0 "[ . 1 . 2]" 1
206 1 17 TRP HA 1 20 GLN HB2 . . 3.870 2.993 2.505 3.209 . 0 0 "[ . 1 . 2]" 1
207 1 17 TRP HA 1 20 GLN HB3 . . 4.960 4.559 4.118 4.790 . 0 0 "[ . 1 . 2]" 1
208 1 17 TRP HA 1 20 GLN QG . . 3.740 3.103 2.870 3.588 . 0 0 "[ . 1 . 2]" 1
209 1 17 TRP HA 1 21 GLN H . . 4.460 4.246 3.844 4.463 0.003 15 0 "[ . 1 . 2]" 1
210 1 17 TRP QB 1 18 CYS H . . 3.340 2.290 2.130 2.585 . 0 0 "[ . 1 . 2]" 1
211 1 17 TRP QB 1 110 TYR QD . . 3.930 2.670 2.227 3.048 . 0 0 "[ . 1 . 2]" 1
212 1 17 TRP QB 1 110 TYR QE . . 3.620 2.378 1.943 2.865 . 0 0 "[ . 1 . 2]" 1
213 1 17 TRP QB 1 114 ARG QD . . 5.180 4.716 3.900 5.169 . 0 0 "[ . 1 . 2]" 1
214 1 17 TRP HB2 1 18 CYS H . . 3.980 3.726 3.611 3.907 . 0 0 "[ . 1 . 2]" 1
215 1 17 TRP HB2 1 110 TYR QD . . 4.530 3.321 2.792 3.664 . 0 0 "[ . 1 . 2]" 1
216 1 17 TRP HB2 1 110 TYR QE . . 4.250 2.442 2.003 2.952 . 0 0 "[ . 1 . 2]" 1
217 1 17 TRP HB3 1 18 CYS H . . 3.980 2.312 2.145 2.623 . 0 0 "[ . 1 . 2]" 1
218 1 17 TRP HB3 1 110 TYR QD . . 4.530 2.825 2.340 3.263 . 0 0 "[ . 1 . 2]" 1
219 1 17 TRP HB3 1 110 TYR QE . . 4.250 3.295 2.553 3.874 . 0 0 "[ . 1 . 2]" 1
220 1 17 TRP HD1 1 21 GLN QE . . 4.500 3.811 2.965 4.431 . 0 0 "[ . 1 . 2]" 1
221 1 17 TRP HD1 1 110 TYR QE . . 4.260 3.507 2.630 4.234 . 0 0 "[ . 1 . 2]" 1
222 1 17 TRP HE1 1 21 GLN HE21 . . 4.440 3.712 2.645 4.386 . 0 0 "[ . 1 . 2]" 1
223 1 17 TRP HE1 1 21 GLN QE . . 3.890 3.381 2.538 3.850 . 0 0 "[ . 1 . 2]" 1
224 1 17 TRP HE1 1 21 GLN HE22 . . 4.440 3.945 3.268 4.425 . 0 0 "[ . 1 . 2]" 1
225 1 17 TRP HE1 1 21 GLN HG2 . . 4.760 4.350 3.779 4.674 . 0 0 "[ . 1 . 2]" 1
226 1 17 TRP HE1 1 21 GLN HG3 . . 4.980 4.287 3.003 4.778 . 0 0 "[ . 1 . 2]" 1
227 1 17 TRP HE1 1 114 ARG HA . . 4.350 4.150 3.152 4.345 . 0 0 "[ . 1 . 2]" 1
228 1 17 TRP HE1 1 114 ARG QB . . 4.880 4.038 2.790 4.869 . 0 0 "[ . 1 . 2]" 1
229 1 17 TRP HE1 1 114 ARG QD . . 5.340 4.716 3.111 5.322 . 0 0 "[ . 1 . 2]" 1
230 1 17 TRP HE1 1 114 ARG QG . . 5.230 4.367 3.067 5.229 . 0 0 "[ . 1 . 2]" 1
231 1 17 TRP HE3 1 18 CYS H . . 3.910 2.810 2.467 3.233 . 0 0 "[ . 1 . 2]" 1
232 1 17 TRP HE3 1 18 CYS HA . . 3.970 2.994 2.474 3.428 . 0 0 "[ . 1 . 2]" 1
233 1 17 TRP HE3 1 18 CYS HG . . 4.170 2.506 2.003 3.823 . 0 0 "[ . 1 . 2]" 1
234 1 17 TRP HE3 1 46 ILE MD . . 4.410 3.921 3.619 4.144 . 0 0 "[ . 1 . 2]" 1
235 1 17 TRP HE3 1 110 TYR QD . . 4.550 2.984 2.523 3.495 . 0 0 "[ . 1 . 2]" 1
236 1 17 TRP HH2 1 46 ILE MG . . 3.620 2.519 2.122 3.044 . 0 0 "[ . 1 . 2]" 1
237 1 17 TRP HH2 1 109 PHE HB2 . . 4.810 4.411 3.596 4.775 . 0 0 "[ . 1 . 2]" 1
238 1 17 TRP HH2 1 109 PHE HB3 . . 4.510 3.528 2.632 4.059 . 0 0 "[ . 1 . 2]" 1
239 1 17 TRP HH2 1 110 TYR HA . . 4.290 3.389 2.871 3.835 . 0 0 "[ . 1 . 2]" 1
240 1 17 TRP HH2 1 113 PHE HB2 . . 4.580 2.987 2.384 3.708 . 0 0 "[ . 1 . 2]" 1
241 1 17 TRP HH2 1 113 PHE QB . . 3.980 2.888 2.337 3.545 . 0 0 "[ . 1 . 2]" 1
242 1 17 TRP HH2 1 113 PHE HB3 . . 4.580 3.858 3.261 4.555 . 0 0 "[ . 1 . 2]" 1
243 1 17 TRP HH2 1 113 PHE QD . . 4.130 2.509 2.029 3.857 . 0 0 "[ . 1 . 2]" 1
244 1 17 TRP HZ2 1 21 GLN HG2 . . 5.030 4.610 4.369 4.851 . 0 0 "[ . 1 . 2]" 1
245 1 17 TRP HZ2 1 110 TYR HA . . 4.770 3.991 3.578 4.353 . 0 0 "[ . 1 . 2]" 1
246 1 17 TRP HZ2 1 113 PHE H . . 5.390 4.729 4.326 5.112 . 0 0 "[ . 1 . 2]" 1
247 1 17 TRP HZ2 1 113 PHE HB2 . . 4.180 2.460 2.003 2.938 . 0 0 "[ . 1 . 2]" 1
248 1 17 TRP HZ2 1 113 PHE QB . . 3.630 2.140 1.897 2.429 . 0 0 "[ . 1 . 2]" 1
249 1 17 TRP HZ2 1 113 PHE HB3 . . 4.180 2.441 2.019 3.150 . 0 0 "[ . 1 . 2]" 1
250 1 17 TRP HZ2 1 114 ARG H . . 5.010 4.057 3.422 4.536 . 0 0 "[ . 1 . 2]" 1
251 1 17 TRP HZ3 1 46 ILE MD . . 3.700 2.612 2.029 2.867 . 0 0 "[ . 1 . 2]" 1
252 1 17 TRP HZ3 1 110 TYR H . . 4.780 4.118 3.551 4.548 . 0 0 "[ . 1 . 2]" 1
253 1 18 CYS H 1 18 CYS HB2 . . 3.420 2.543 2.398 2.635 . 0 0 "[ . 1 . 2]" 1
254 1 18 CYS H 1 18 CYS HB3 . . 3.830 3.590 3.579 3.599 . 0 0 "[ . 1 . 2]" 1
255 1 18 CYS H 1 18 CYS HG . . 3.300 2.399 2.047 3.088 . 0 0 "[ . 1 . 2]" 1
256 1 18 CYS H 1 19 GLN H . . 3.620 2.834 2.643 2.984 . 0 0 "[ . 1 . 2]" 1
257 1 18 CYS H 1 19 GLN HB2 . . 4.940 4.735 4.536 4.942 0.002 12 0 "[ . 1 . 2]" 1
258 1 18 CYS H 1 20 GLN H . . 4.920 4.289 4.047 4.534 . 0 0 "[ . 1 . 2]" 1
259 1 18 CYS H 1 21 GLN HG2 . . 5.230 4.785 4.279 5.143 . 0 0 "[ . 1 . 2]" 1
260 1 18 CYS HA 1 18 CYS HG . . 4.310 3.539 3.072 4.074 . 0 0 "[ . 1 . 2]" 1
261 1 18 CYS HA 1 20 GLN H . . 4.700 4.424 4.159 4.690 . 0 0 "[ . 1 . 2]" 1
262 1 18 CYS HA 1 21 GLN H . . 4.070 3.598 3.407 3.825 . 0 0 "[ . 1 . 2]" 1
263 1 18 CYS HA 1 21 GLN QB . . 4.240 2.931 2.723 3.295 . 0 0 "[ . 1 . 2]" 1
264 1 18 CYS HA 1 21 GLN HG2 . . 4.010 3.287 2.800 3.647 . 0 0 "[ . 1 . 2]" 1
265 1 18 CYS HA 1 22 THR H . . 4.710 4.026 3.849 4.222 . 0 0 "[ . 1 . 2]" 1
266 1 18 CYS HA 1 37 TRP HZ2 . . 5.270 4.676 4.412 4.961 . 0 0 "[ . 1 . 2]" 1
267 1 18 CYS HA 1 46 ILE MD . . 3.610 3.003 2.518 3.430 . 0 0 "[ . 1 . 2]" 1
268 1 18 CYS HA 1 46 ILE HG12 . . 4.730 3.684 3.484 3.871 . 0 0 "[ . 1 . 2]" 1
269 1 18 CYS HA 1 46 ILE HG13 . . 4.890 4.782 4.565 4.891 0.001 20 0 "[ . 1 . 2]" 1
270 1 18 CYS HB2 1 19 GLN H . . 4.620 2.457 2.264 2.670 . 0 0 "[ . 1 . 2]" 1
271 1 18 CYS HB2 1 37 TRP HH2 . . 4.600 3.822 3.483 4.501 . 0 0 "[ . 1 . 2]" 1
272 1 18 CYS HB2 1 37 TRP HZ2 . . 4.010 2.825 2.490 3.313 . 0 0 "[ . 1 . 2]" 1
273 1 18 CYS HB2 1 46 ILE MD . . 4.650 4.384 4.022 4.596 . 0 0 "[ . 1 . 2]" 1
274 1 18 CYS HB3 1 19 GLN H . . 4.200 3.515 3.141 3.735 . 0 0 "[ . 1 . 2]" 1
275 1 18 CYS HB3 1 30 VAL MG1 . . 3.930 3.383 3.185 3.617 . 0 0 "[ . 1 . 2]" 1
276 1 18 CYS HB3 1 30 VAL MG2 . . 4.580 3.969 3.423 4.284 . 0 0 "[ . 1 . 2]" 1
277 1 18 CYS HB3 1 37 TRP HH2 . . 4.240 2.432 2.011 3.152 . 0 0 "[ . 1 . 2]" 1
278 1 18 CYS HB3 1 37 TRP HZ2 . . 3.750 2.330 2.094 2.705 . 0 0 "[ . 1 . 2]" 1
279 1 18 CYS HB3 1 46 ILE MD . . 3.980 2.992 2.601 3.279 . 0 0 "[ . 1 . 2]" 1
280 1 18 CYS HG 1 19 GLN H . . 4.810 4.549 4.415 4.789 . 0 0 "[ . 1 . 2]" 1
281 1 18 CYS HG 1 37 TRP HZ2 . . 4.940 3.922 3.337 4.291 . 0 0 "[ . 1 . 2]" 1
282 1 19 GLN H 1 19 GLN HB2 . . 3.000 2.292 2.191 2.561 . 0 0 "[ . 1 . 2]" 1
283 1 19 GLN H 1 19 GLN HB3 . . 3.640 3.543 3.497 3.594 . 0 0 "[ . 1 . 2]" 1
284 1 19 GLN H 1 19 GLN HG2 . . 4.080 3.769 3.328 4.069 . 0 0 "[ . 1 . 2]" 1
285 1 19 GLN H 1 19 GLN HG3 . . 4.080 2.642 2.072 2.886 . 0 0 "[ . 1 . 2]" 1
286 1 19 GLN H 1 20 GLN H . . 3.440 2.811 2.605 2.971 . 0 0 "[ . 1 . 2]" 1
287 1 19 GLN H 1 21 GLN H . . 4.760 4.476 4.292 4.616 . 0 0 "[ . 1 . 2]" 1
288 1 19 GLN H 1 22 THR HG1 . . 5.280 4.481 4.089 5.046 . 0 0 "[ . 1 . 2]" 1
289 1 19 GLN H 1 30 VAL HB . . 5.060 4.797 4.386 5.060 . 0 0 "[ . 1 . 2]" 1
290 1 19 GLN H 1 30 VAL MG1 . . 4.300 3.651 3.238 3.906 . 0 0 "[ . 1 . 2]" 1
291 1 19 GLN HA 1 19 GLN HG2 . . 4.100 2.454 2.248 2.667 . 0 0 "[ . 1 . 2]" 1
292 1 19 GLN HA 1 19 GLN QG . . 3.240 2.290 2.199 2.443 . 0 0 "[ . 1 . 2]" 1
293 1 19 GLN HA 1 19 GLN HG3 . . 4.100 2.811 2.526 3.125 . 0 0 "[ . 1 . 2]" 1
294 1 19 GLN HA 1 21 GLN H . . 5.000 4.771 4.617 4.986 . 0 0 "[ . 1 . 2]" 1
295 1 19 GLN HA 1 22 THR H . . 4.120 3.720 3.491 3.932 . 0 0 "[ . 1 . 2]" 1
296 1 19 GLN HA 1 22 THR HG1 . . 3.510 2.364 2.014 2.775 . 0 0 "[ . 1 . 2]" 1
297 1 19 GLN HA 1 30 VAL HB . . 3.830 2.762 2.356 3.036 . 0 0 "[ . 1 . 2]" 1
298 1 19 GLN HA 1 30 VAL MG1 . . 3.520 3.128 2.793 3.397 . 0 0 "[ . 1 . 2]" 1
299 1 19 GLN HA 1 30 VAL MG2 . . 3.670 3.309 3.114 3.555 . 0 0 "[ . 1 . 2]" 1
300 1 19 GLN HB2 1 20 GLN H . . 3.390 2.699 2.358 2.943 . 0 0 "[ . 1 . 2]" 1
301 1 19 GLN HB3 1 20 GLN H . . 3.900 3.317 3.146 3.583 . 0 0 "[ . 1 . 2]" 1
302 1 19 GLN QE 1 30 VAL MG1 . . 4.070 3.042 2.725 3.281 . 0 0 "[ . 1 . 2]" 1
303 1 19 GLN QE 1 31 THR HA . . 3.350 2.493 1.933 3.040 . 0 0 "[ . 1 . 2]" 1
304 1 19 GLN QE 1 31 THR MG . . 5.340 3.838 3.226 4.984 . 0 0 "[ . 1 . 2]" 1
305 1 19 GLN HE21 1 30 VAL MG1 . . 4.630 3.096 2.757 3.362 . 0 0 "[ . 1 . 2]" 1
306 1 19 GLN HE21 1 31 THR HA . . 3.890 2.588 1.973 3.194 . 0 0 "[ . 1 . 2]" 1
307 1 19 GLN HE22 1 30 VAL MG1 . . 4.630 4.483 4.269 4.628 . 0 0 "[ . 1 . 2]" 1
308 1 19 GLN HE22 1 31 THR HA . . 3.890 3.301 2.613 3.817 . 0 0 "[ . 1 . 2]" 1
309 1 19 GLN QG 1 30 VAL H . . 4.740 4.074 3.697 4.425 . 0 0 "[ . 1 . 2]" 1
310 1 19 GLN QG 1 30 VAL MG2 . . 4.430 3.707 3.489 3.874 . 0 0 "[ . 1 . 2]" 1
311 1 19 GLN HG2 1 30 VAL HB . . 4.070 2.445 2.112 2.918 . 0 0 "[ . 1 . 2]" 1
312 1 19 GLN HG2 1 30 VAL MG1 . . 3.810 2.615 2.033 3.229 . 0 0 "[ . 1 . 2]" 1
313 1 19 GLN HG3 1 30 VAL HB . . 4.070 3.350 2.922 4.041 . 0 0 "[ . 1 . 2]" 1
314 1 19 GLN HG3 1 30 VAL MG1 . . 3.810 2.273 2.035 2.737 . 0 0 "[ . 1 . 2]" 1
315 1 20 GLN H 1 20 GLN HB2 . . 3.150 2.460 2.383 2.568 . 0 0 "[ . 1 . 2]" 1
316 1 20 GLN H 1 20 GLN HG2 . . 3.560 2.717 2.042 3.467 . 0 0 "[ . 1 . 2]" 1
317 1 20 GLN H 1 20 GLN QG . . 3.090 2.281 2.024 2.465 . 0 0 "[ . 1 . 2]" 1
318 1 20 GLN H 1 20 GLN HG3 . . 3.560 2.922 2.263 3.556 . 0 0 "[ . 1 . 2]" 1
319 1 20 GLN H 1 21 GLN H . . 3.470 2.802 2.658 2.944 . 0 0 "[ . 1 . 2]" 1
320 1 20 GLN H 1 22 THR H . . 4.800 4.217 4.030 4.388 . 0 0 "[ . 1 . 2]" 1
321 1 20 GLN HA 1 20 GLN HG2 . . 3.890 2.586 2.293 2.941 . 0 0 "[ . 1 . 2]" 1
322 1 20 GLN HA 1 20 GLN QG . . 3.220 2.522 2.247 2.843 . 0 0 "[ . 1 . 2]" 1
323 1 20 GLN HA 1 20 GLN HG3 . . 3.890 3.520 2.988 3.812 . 0 0 "[ . 1 . 2]" 1
324 1 20 GLN HA 1 22 THR H . . 4.740 4.558 4.252 4.740 . 0 0 "[ . 1 . 2]" 1
325 1 20 GLN HA 1 23 GLU H . . 4.130 3.732 3.406 4.118 . 0 0 "[ . 1 . 2]" 1
326 1 20 GLN HA 1 23 GLU HB2 . . 3.940 2.471 2.234 2.771 . 0 0 "[ . 1 . 2]" 1
327 1 20 GLN HA 1 23 GLU QB . . 3.340 2.371 2.214 2.548 . 0 0 "[ . 1 . 2]" 1
328 1 20 GLN HA 1 23 GLU HB3 . . 3.940 3.311 2.550 3.882 . 0 0 "[ . 1 . 2]" 1
329 1 20 GLN HB2 1 21 GLN H . . 3.710 2.379 2.233 2.489 . 0 0 "[ . 1 . 2]" 1
330 1 20 GLN HB2 1 21 GLN HE21 . . 4.950 3.105 2.489 4.912 . 0 0 "[ . 1 . 2]" 1
331 1 20 GLN HB2 1 21 GLN HE22 . . 4.950 4.392 4.009 4.853 . 0 0 "[ . 1 . 2]" 1
332 1 20 GLN HB3 1 21 GLN H . . 3.710 3.367 3.165 3.515 . 0 0 "[ . 1 . 2]" 1
333 1 20 GLN HB3 1 21 GLN HA . . 4.730 4.271 4.147 4.386 . 0 0 "[ . 1 . 2]" 1
334 1 20 GLN HB3 1 21 GLN HE21 . . 4.890 3.700 3.009 4.886 . 0 0 "[ . 1 . 2]" 1
335 1 20 GLN HB3 1 21 GLN QE . . 4.300 3.488 2.936 3.972 . 0 0 "[ . 1 . 2]" 1
336 1 20 GLN HB3 1 21 GLN HE22 . . 4.890 4.455 3.818 4.848 . 0 0 "[ . 1 . 2]" 1
337 1 20 GLN QG 1 21 GLN H . . 4.140 3.981 3.849 4.076 . 0 0 "[ . 1 . 2]" 1
338 1 20 GLN HG2 1 21 GLN H . . 4.880 4.547 4.194 4.881 0.001 10 0 "[ . 1 . 2]" 1
339 1 20 GLN HG3 1 21 GLN H . . 4.880 4.454 4.201 4.745 . 0 0 "[ . 1 . 2]" 1
340 1 21 GLN H 1 21 GLN HB2 . . 3.800 2.591 2.532 2.744 . 0 0 "[ . 1 . 2]" 1
341 1 21 GLN H 1 21 GLN QB . . 3.240 2.534 2.483 2.660 . 0 0 "[ . 1 . 2]" 1
342 1 21 GLN H 1 21 GLN HB3 . . 3.800 3.590 3.573 3.598 . 0 0 "[ . 1 . 2]" 1
343 1 21 GLN H 1 21 GLN HE21 . . 4.660 3.127 2.526 3.835 . 0 0 "[ . 1 . 2]" 1
344 1 21 GLN H 1 21 GLN QE . . 3.920 3.054 2.505 3.500 . 0 0 "[ . 1 . 2]" 1
345 1 21 GLN H 1 21 GLN HE22 . . 4.660 4.415 4.040 4.652 . 0 0 "[ . 1 . 2]" 1
346 1 21 GLN H 1 21 GLN HG2 . . 3.640 2.079 1.961 2.209 . 0 0 "[ . 1 . 2]" 1
347 1 21 GLN H 1 21 GLN HG3 . . 3.630 3.580 3.437 3.630 . 0 0 "[ . 1 . 2]" 1
348 1 21 GLN H 1 22 THR H . . 3.370 2.816 2.690 3.000 . 0 0 "[ . 1 . 2]" 1
349 1 21 GLN H 1 23 GLU H . . 4.540 4.171 3.858 4.489 . 0 0 "[ . 1 . 2]" 1
350 1 21 GLN HA 1 21 GLN QE . . 4.950 3.058 2.002 3.565 . 0 0 "[ . 1 . 2]" 1
351 1 21 GLN QB 1 22 THR H . . 3.820 2.439 2.275 2.663 . 0 0 "[ . 1 . 2]" 1
352 1 21 GLN QB 1 46 ILE H . . 5.340 4.787 4.443 5.226 . 0 0 "[ . 1 . 2]" 1
353 1 21 GLN QB 1 46 ILE HA . . 3.850 2.976 2.616 3.540 . 0 0 "[ . 1 . 2]" 1
354 1 21 GLN QB 1 46 ILE HG12 . . 4.470 2.361 1.895 2.822 . 0 0 "[ . 1 . 2]" 1
355 1 21 GLN QB 1 46 ILE HG13 . . 4.570 3.575 3.256 4.146 . 0 0 "[ . 1 . 2]" 1
356 1 21 GLN QB 1 46 ILE MG . . 3.630 3.056 2.498 3.556 . 0 0 "[ . 1 . 2]" 1
357 1 21 GLN HB2 1 22 THR H . . 4.350 2.481 2.314 2.719 . 0 0 "[ . 1 . 2]" 1
358 1 21 GLN HB2 1 46 ILE HA . . 4.660 3.996 3.627 4.301 . 0 0 "[ . 1 . 2]" 1
359 1 21 GLN HB2 1 46 ILE MG . . 4.220 3.675 3.137 4.105 . 0 0 "[ . 1 . 2]" 1
360 1 21 GLN HB3 1 22 THR H . . 4.350 3.595 3.365 3.808 . 0 0 "[ . 1 . 2]" 1
361 1 21 GLN HB3 1 46 ILE HA . . 4.660 3.081 2.683 3.888 . 0 0 "[ . 1 . 2]" 1
362 1 21 GLN HB3 1 46 ILE MG . . 4.220 3.280 2.623 3.897 . 0 0 "[ . 1 . 2]" 1
363 1 21 GLN HG2 1 22 THR H . . 4.200 4.148 3.839 4.201 0.001 12 0 "[ . 1 . 2]" 1
364 1 22 THR H 1 22 THR HB . . 4.110 3.639 3.582 3.735 . 0 0 "[ . 1 . 2]" 1
365 1 22 THR H 1 22 THR HG1 . . 3.030 2.274 1.899 3.035 0.005 18 0 "[ . 1 . 2]" 1
366 1 22 THR H 1 22 THR MG . . 3.420 2.504 2.294 2.902 . 0 0 "[ . 1 . 2]" 1
367 1 22 THR H 1 23 GLU H . . 3.140 2.773 2.478 3.085 . 0 0 "[ . 1 . 2]" 1
368 1 22 THR H 1 23 GLU QB . . 4.420 4.251 4.001 4.362 . 0 0 "[ . 1 . 2]" 1
369 1 22 THR H 1 30 VAL MG2 . . 4.560 4.455 4.319 4.534 . 0 0 "[ . 1 . 2]" 1
370 1 22 THR HA 1 22 THR HG1 . . 4.080 3.569 3.394 4.023 . 0 0 "[ . 1 . 2]" 1
371 1 22 THR HA 1 22 THR MG . . 3.340 2.315 2.116 2.494 . 0 0 "[ . 1 . 2]" 1
372 1 22 THR HA 1 25 TYR H . . 4.370 4.229 3.454 4.370 . 0 0 "[ . 1 . 2]" 1
373 1 22 THR HA 1 25 TYR HB2 . . 4.880 3.743 3.519 3.965 . 0 0 "[ . 1 . 2]" 1
374 1 22 THR HA 1 25 TYR HB3 . . 5.500 5.142 4.932 5.355 . 0 0 "[ . 1 . 2]" 1
375 1 22 THR HA 1 25 TYR QD . . 3.480 2.711 2.064 3.301 . 0 0 "[ . 1 . 2]" 1
376 1 22 THR HA 1 25 TYR QE . . 4.180 3.496 2.733 3.921 . 0 0 "[ . 1 . 2]" 1
377 1 22 THR HA 1 28 VAL MG1 . . 4.300 3.835 3.403 4.212 . 0 0 "[ . 1 . 2]" 1
378 1 22 THR HA 1 45 ALA MB . . 3.770 3.000 2.581 3.563 . 0 0 "[ . 1 . 2]" 1
379 1 22 THR HB 1 23 GLU H . . 4.650 4.088 3.543 4.473 . 0 0 "[ . 1 . 2]" 1
380 1 22 THR HB 1 25 TYR HB2 . . 4.680 3.534 2.869 3.830 . 0 0 "[ . 1 . 2]" 1
381 1 22 THR HB 1 28 VAL HB . . 4.470 4.058 3.764 4.307 . 0 0 "[ . 1 . 2]" 1
382 1 22 THR HB 1 28 VAL MG1 . . 3.310 2.105 1.964 2.281 . 0 0 "[ . 1 . 2]" 1
383 1 22 THR HB 1 30 VAL MG2 . . 4.050 2.956 2.506 3.753 . 0 0 "[ . 1 . 2]" 1
384 1 22 THR HB 1 45 ALA MB . . 4.330 3.486 2.678 3.979 . 0 0 "[ . 1 . 2]" 1
385 1 22 THR HG1 1 22 THR MG . . 3.290 2.557 1.973 3.028 . 0 0 "[ . 1 . 2]" 1
386 1 22 THR HG1 1 23 GLU H . . 4.050 3.372 2.077 3.977 . 0 0 "[ . 1 . 2]" 1
387 1 22 THR HG1 1 28 VAL MG1 . . 4.450 4.011 3.496 4.399 . 0 0 "[ . 1 . 2]" 1
388 1 22 THR HG1 1 30 VAL MG2 . . 3.970 2.786 2.015 3.534 . 0 0 "[ . 1 . 2]" 1
389 1 22 THR MG 1 23 GLU H . . 4.350 4.184 3.966 4.336 . 0 0 "[ . 1 . 2]" 1
390 1 22 THR MG 1 28 VAL MG1 . . 3.410 2.849 2.417 3.297 . 0 0 "[ . 1 . 2]" 1
391 1 22 THR MG 1 30 VAL MG2 . . 3.560 2.442 1.930 3.521 . 0 0 "[ . 1 . 2]" 1
392 1 22 THR MG 1 42 ALA HA . . 3.910 2.962 2.150 3.736 . 0 0 "[ . 1 . 2]" 1
393 1 22 THR MG 1 45 ALA H . . 4.430 4.145 3.775 4.375 . 0 0 "[ . 1 . 2]" 1
394 1 22 THR MG 1 45 ALA MB . . 3.000 2.088 1.794 2.423 . 0 0 "[ . 1 . 2]" 1
395 1 22 THR MG 1 46 ILE H . . 4.220 3.312 2.514 3.806 . 0 0 "[ . 1 . 2]" 1
396 1 22 THR MG 1 46 ILE HG13 . . 3.530 2.517 1.867 2.939 . 0 0 "[ . 1 . 2]" 1
397 1 23 GLU H 1 23 GLU HB2 . . 3.160 2.520 2.178 3.178 0.018 12 0 "[ . 1 . 2]" 1
398 1 23 GLU H 1 23 GLU QB . . 2.760 2.239 2.131 2.333 . 0 0 "[ . 1 . 2]" 1
399 1 23 GLU H 1 23 GLU HB3 . . 3.160 2.668 2.221 3.023 . 0 0 "[ . 1 . 2]" 1
400 1 23 GLU H 1 23 GLU HG2 . . 4.680 4.479 3.970 4.663 . 0 0 "[ . 1 . 2]" 1
401 1 23 GLU H 1 23 GLU QG . . 4.050 3.964 3.700 4.050 . 0 0 "[ . 1 . 2]" 1
402 1 23 GLU H 1 23 GLU HG3 . . 4.680 4.436 4.167 4.602 . 0 0 "[ . 1 . 2]" 1
403 1 23 GLU H 1 24 GLY H . . 4.750 4.307 2.082 4.631 . 0 0 "[ . 1 . 2]" 1
404 1 23 GLU HA 1 23 GLU HG2 . . 3.700 3.276 2.280 3.693 . 0 0 "[ . 1 . 2]" 1
405 1 23 GLU HA 1 23 GLU QG . . 3.140 2.470 2.215 3.072 . 0 0 "[ . 1 . 2]" 1
406 1 23 GLU HA 1 23 GLU HG3 . . 3.700 2.630 2.261 3.511 . 0 0 "[ . 1 . 2]" 1
407 1 23 GLU HA 1 24 GLY H . . 3.280 2.300 2.143 3.430 0.150 12 0 "[ . 1 . 2]" 1
408 1 23 GLU HA 1 25 TYR H . . 4.290 3.868 3.702 4.234 . 0 0 "[ . 1 . 2]" 1
409 1 23 GLU QB 1 24 GLY H . . 3.890 3.624 3.125 3.836 . 0 0 "[ . 1 . 2]" 1
410 1 23 GLU HB2 1 24 GLY H . . 4.530 4.267 4.090 4.421 . 0 0 "[ . 1 . 2]" 1
411 1 23 GLU HB3 1 24 GLY H . . 4.530 3.950 3.207 4.230 . 0 0 "[ . 1 . 2]" 1
412 1 23 GLU QG 1 24 GLY QA . . 3.910 3.394 3.015 3.906 . 0 0 "[ . 1 . 2]" 1
413 1 23 GLU HG2 1 24 GLY H . . 4.230 3.438 2.511 4.223 . 0 0 "[ . 1 . 2]" 1
414 1 23 GLU HG3 1 24 GLY H . . 4.230 3.148 2.420 4.271 0.041 12 0 "[ . 1 . 2]" 1
415 1 24 GLY H 1 25 TYR H . . 3.350 3.009 2.360 3.169 . 0 0 "[ . 1 . 2]" 1
416 1 24 GLY QA 1 25 TYR H . . 3.000 2.704 2.643 2.829 . 0 0 "[ . 1 . 2]" 1
417 1 25 TYR H 1 25 TYR HB2 . . 3.090 2.306 2.223 2.395 . 0 0 "[ . 1 . 2]" 1
418 1 25 TYR H 1 25 TYR HB3 . . 3.600 3.558 3.518 3.595 . 0 0 "[ . 1 . 2]" 1
419 1 25 TYR H 1 25 TYR QD . . 3.200 2.295 1.903 2.871 . 0 0 "[ . 1 . 2]" 1
420 1 25 TYR H 1 25 TYR QE . . 4.970 4.497 4.211 4.912 . 0 0 "[ . 1 . 2]" 1
421 1 25 TYR H 1 26 GLN H . . 4.860 4.624 4.531 4.643 . 0 0 "[ . 1 . 2]" 1
422 1 25 TYR H 1 28 VAL HB . . 4.680 4.432 3.675 4.680 . 0 0 "[ . 1 . 2]" 1
423 1 25 TYR H 1 28 VAL MG1 . . 5.270 4.606 4.194 4.892 . 0 0 "[ . 1 . 2]" 1
424 1 25 TYR H 1 28 VAL MG2 . . 5.500 4.936 4.398 5.183 . 0 0 "[ . 1 . 2]" 1
425 1 25 TYR H 1 45 ALA MB . . 5.360 5.154 4.636 5.353 . 0 0 "[ . 1 . 2]" 1
426 1 25 TYR HA 1 25 TYR QD . . 4.030 2.968 2.578 3.064 . 0 0 "[ . 1 . 2]" 1
427 1 25 TYR HA 1 25 TYR QE . . 4.890 4.513 4.383 4.566 . 0 0 "[ . 1 . 2]" 1
428 1 25 TYR HA 1 26 GLN H . . 2.870 2.341 2.178 2.493 . 0 0 "[ . 1 . 2]" 1
429 1 25 TYR HB2 1 26 GLN H . . 4.430 3.970 3.719 4.291 . 0 0 "[ . 1 . 2]" 1
430 1 25 TYR HB2 1 28 VAL H . . 5.500 4.820 4.620 4.964 . 0 0 "[ . 1 . 2]" 1
431 1 25 TYR HB2 1 28 VAL HB . . 4.010 2.559 2.227 2.772 . 0 0 "[ . 1 . 2]" 1
432 1 25 TYR HB2 1 28 VAL MG1 . . 4.400 2.884 2.574 3.162 . 0 0 "[ . 1 . 2]" 1
433 1 25 TYR HB2 1 28 VAL MG2 . . 3.910 3.055 2.562 3.359 . 0 0 "[ . 1 . 2]" 1
434 1 25 TYR HB2 1 45 ALA MB . . 4.360 3.832 3.464 4.045 . 0 0 "[ . 1 . 2]" 1
435 1 25 TYR HB3 1 26 GLN H . . 4.770 2.665 2.278 3.189 . 0 0 "[ . 1 . 2]" 1
436 1 25 TYR HB3 1 28 VAL H . . 4.490 4.312 4.103 4.486 . 0 0 "[ . 1 . 2]" 1
437 1 25 TYR HB3 1 28 VAL HB . . 3.970 2.514 2.091 2.926 . 0 0 "[ . 1 . 2]" 1
438 1 25 TYR HB3 1 28 VAL MG1 . . 4.710 3.352 2.991 3.598 . 0 0 "[ . 1 . 2]" 1
439 1 25 TYR HB3 1 28 VAL MG2 . . 3.780 2.042 1.872 2.304 . 0 0 "[ . 1 . 2]" 1
440 1 25 TYR HB3 1 45 ALA MB . . 4.140 3.914 3.564 4.096 . 0 0 "[ . 1 . 2]" 1
441 1 25 TYR QD 1 26 GLN H . . 4.510 3.378 2.773 3.975 . 0 0 "[ . 1 . 2]" 1
442 1 25 TYR QD 1 28 VAL MG2 . . 4.570 2.995 2.513 3.527 . 0 0 "[ . 1 . 2]" 1
443 1 25 TYR QD 1 45 ALA HA . . 4.820 4.234 3.611 4.785 . 0 0 "[ . 1 . 2]" 1
444 1 25 TYR QD 1 45 ALA MB . . 3.930 2.911 2.632 3.237 . 0 0 "[ . 1 . 2]" 1
445 1 25 TYR QD 1 57 PHE QD . . 4.640 3.765 3.239 4.638 . 0 0 "[ . 1 . 2]" 1
446 1 25 TYR QE 1 45 ALA HA . . 3.800 2.902 2.289 3.789 . 0 0 "[ . 1 . 2]" 1
447 1 25 TYR QE 1 45 ALA MB . . 4.120 2.760 2.483 3.280 . 0 0 "[ . 1 . 2]" 1
448 1 25 TYR QE 1 49 ARG H . . 4.600 4.307 3.846 4.593 . 0 0 "[ . 1 . 2]" 1
449 1 25 TYR QE 1 49 ARG QB . . 4.250 3.096 2.016 3.512 . 0 0 "[ . 1 . 2]" 1
450 1 25 TYR QE 1 49 ARG QD . . 4.140 3.016 1.965 4.137 . 0 0 "[ . 1 . 2]" 1
451 1 25 TYR QE 1 49 ARG HE . . 5.500 4.591 2.646 5.347 . 0 0 "[ . 1 . 2]" 1
452 1 25 TYR QE 1 57 PHE H . . 5.500 5.082 4.445 5.488 . 0 0 "[ . 1 . 2]" 1
453 1 25 TYR QE 1 57 PHE HB2 . . 4.520 3.186 2.376 3.928 . 0 0 "[ . 1 . 2]" 1
454 1 25 TYR QE 1 57 PHE HB3 . . 4.300 3.742 2.549 4.297 . 0 0 "[ . 1 . 2]" 1
455 1 25 TYR QE 1 57 PHE QD . . 4.450 3.264 2.359 4.329 . 0 0 "[ . 1 . 2]" 1
456 1 25 TYR QE 1 57 PHE QE . . 5.500 4.339 3.412 5.249 . 0 0 "[ . 1 . 2]" 1
457 1 26 GLN H 1 26 GLN HB2 . . 3.800 2.652 2.254 3.727 . 0 0 "[ . 1 . 2]" 1
458 1 26 GLN H 1 26 GLN QB . . 3.120 2.422 2.229 2.735 . 0 0 "[ . 1 . 2]" 1
459 1 26 GLN H 1 26 GLN HB3 . . 3.800 3.438 2.599 3.714 . 0 0 "[ . 1 . 2]" 1
460 1 26 GLN H 1 26 GLN QE . . 3.950 3.489 2.789 3.924 . 0 0 "[ . 1 . 2]" 1
461 1 26 GLN H 1 26 GLN HG2 . . 4.230 3.593 2.008 4.228 . 0 0 "[ . 1 . 2]" 1
462 1 26 GLN H 1 26 GLN QG . . 3.560 2.823 1.987 3.518 . 0 0 "[ . 1 . 2]" 1
463 1 26 GLN H 1 26 GLN HG3 . . 4.230 3.285 2.450 4.205 . 0 0 "[ . 1 . 2]" 1
464 1 26 GLN H 1 27 HIS H . . 4.650 4.557 4.511 4.591 . 0 0 "[ . 1 . 2]" 1
465 1 26 GLN H 1 28 VAL MG2 . . 5.060 3.481 3.091 3.946 . 0 0 "[ . 1 . 2]" 1
466 1 26 GLN HA 1 26 GLN HG2 . . 4.110 3.036 2.531 3.733 . 0 0 "[ . 1 . 2]" 1
467 1 26 GLN HA 1 26 GLN HG3 . . 4.110 3.103 2.443 4.172 0.062 5 0 "[ . 1 . 2]" 1
468 1 26 GLN HA 1 27 HIS H . . 2.900 2.261 2.193 2.349 . 0 0 "[ . 1 . 2]" 1
469 1 26 GLN HA 1 27 HIS HA . . 4.600 4.416 4.394 4.446 . 0 0 "[ . 1 . 2]" 1
470 1 26 GLN HA 1 28 VAL H . . 3.550 3.384 3.232 3.532 . 0 0 "[ . 1 . 2]" 1
471 1 26 GLN QB 1 26 GLN QE . . 4.060 2.786 2.104 3.667 . 0 0 "[ . 1 . 2]" 1
472 1 26 GLN QB 1 27 HIS H . . 3.530 2.776 2.528 2.981 . 0 0 "[ . 1 . 2]" 1
473 1 26 GLN QB 1 27 HIS HD2 . . 4.090 2.493 2.055 3.345 . 0 0 "[ . 1 . 2]" 1
474 1 26 GLN HB2 1 27 HIS H . . 4.340 3.767 2.876 4.174 . 0 0 "[ . 1 . 2]" 1
475 1 26 GLN HB2 1 27 HIS HD2 . . 4.810 3.516 2.234 4.507 . 0 0 "[ . 1 . 2]" 1
476 1 26 GLN HB3 1 27 HIS H . . 4.340 3.065 2.564 4.113 . 0 0 "[ . 1 . 2]" 1
477 1 26 GLN HB3 1 27 HIS HD2 . . 4.810 2.859 2.067 4.442 . 0 0 "[ . 1 . 2]" 1
478 1 26 GLN QG 1 27 HIS H . . 4.290 3.878 3.611 4.277 . 0 0 "[ . 1 . 2]" 1
479 1 26 GLN HG2 1 27 HIS H . . 4.950 4.313 3.799 4.916 . 0 0 "[ . 1 . 2]" 1
480 1 26 GLN HG3 1 27 HIS H . . 4.950 4.567 4.039 4.939 . 0 0 "[ . 1 . 2]" 1
481 1 27 HIS H 1 27 HIS HD2 . . 5.040 3.108 2.002 3.997 . 0 0 "[ . 1 . 2]" 1
482 1 27 HIS H 1 28 VAL H . . 3.220 2.752 2.632 2.862 . 0 0 "[ . 1 . 2]" 1
483 1 27 HIS HA 1 27 HIS HD2 . . 4.550 3.800 2.854 4.469 . 0 0 "[ . 1 . 2]" 1
484 1 27 HIS HA 1 28 VAL H . . 3.470 2.932 2.854 2.983 . 0 0 "[ . 1 . 2]" 1
485 1 27 HIS HA 1 28 VAL HA . . 4.580 4.445 4.431 4.459 . 0 0 "[ . 1 . 2]" 1
486 1 27 HIS QB 1 41 LEU MD1 . . 4.000 3.750 3.372 4.000 . 0 0 "[ . 1 . 2]" 1
487 1 27 HIS HB2 1 28 VAL H . . 4.490 4.111 4.044 4.192 . 0 0 "[ . 1 . 2]" 1
488 1 27 HIS HB2 1 41 LEU MD1 . . 4.870 4.332 3.657 4.823 . 0 0 "[ . 1 . 2]" 1
489 1 27 HIS HB3 1 28 VAL H . . 4.490 4.398 4.296 4.488 . 0 0 "[ . 1 . 2]" 1
490 1 27 HIS HB3 1 41 LEU MD1 . . 4.870 4.133 3.692 4.600 . 0 0 "[ . 1 . 2]" 1
491 1 28 VAL H 1 28 VAL HB . . 3.010 2.643 2.591 2.702 . 0 0 "[ . 1 . 2]" 1
492 1 28 VAL H 1 28 VAL MG1 . . 4.280 3.825 3.758 3.868 . 0 0 "[ . 1 . 2]" 1
493 1 28 VAL H 1 28 VAL MG2 . . 3.190 2.974 2.833 3.117 . 0 0 "[ . 1 . 2]" 1
494 1 28 VAL H 1 29 ASN H . . 4.770 3.902 3.825 4.010 . 0 0 "[ . 1 . 2]" 1
495 1 28 VAL H 1 29 ASN QB . . 5.340 4.535 4.418 4.711 . 0 0 "[ . 1 . 2]" 1
496 1 28 VAL HA 1 28 VAL MG1 . . 3.550 2.449 2.371 2.507 . 0 0 "[ . 1 . 2]" 1
497 1 28 VAL HA 1 28 VAL MG2 . . 3.230 2.298 2.172 2.411 . 0 0 "[ . 1 . 2]" 1
498 1 28 VAL HA 1 29 ASN H . . 3.010 2.212 2.178 2.238 . 0 0 "[ . 1 . 2]" 1
499 1 28 VAL HB 1 29 ASN H . . 4.680 4.482 4.451 4.517 . 0 0 "[ . 1 . 2]" 1
500 1 28 VAL HB 1 30 VAL MG2 . . 5.270 4.676 4.440 4.896 . 0 0 "[ . 1 . 2]" 1
501 1 28 VAL HB 1 45 ALA MB . . 5.500 4.709 4.501 4.946 . 0 0 "[ . 1 . 2]" 1
502 1 28 VAL MG1 1 29 ASN H . . 3.560 3.255 3.097 3.401 . 0 0 "[ . 1 . 2]" 1
503 1 28 VAL MG1 1 30 VAL H . . 4.140 3.425 3.005 3.797 . 0 0 "[ . 1 . 2]" 1
504 1 28 VAL MG1 1 30 VAL MG2 . . 2.950 2.333 2.088 2.535 . 0 0 "[ . 1 . 2]" 1
505 1 28 VAL MG1 1 42 ALA H . . 4.680 4.400 3.915 4.668 . 0 0 "[ . 1 . 2]" 1
506 1 28 VAL MG1 1 42 ALA HA . . 3.190 2.884 2.593 3.167 . 0 0 "[ . 1 . 2]" 1
507 1 28 VAL MG1 1 45 ALA H . . 5.500 5.136 4.957 5.409 . 0 0 "[ . 1 . 2]" 1
508 1 28 VAL MG1 1 45 ALA MB . . 3.470 3.125 2.938 3.417 . 0 0 "[ . 1 . 2]" 1
509 1 28 VAL MG2 1 41 LEU HB2 . . 3.940 3.530 2.870 3.925 . 0 0 "[ . 1 . 2]" 1
510 1 28 VAL MG2 1 41 LEU QB . . 3.360 2.782 2.344 3.164 . 0 0 "[ . 1 . 2]" 1
511 1 28 VAL MG2 1 41 LEU HB3 . . 3.940 2.918 2.437 3.392 . 0 0 "[ . 1 . 2]" 1
512 1 28 VAL MG2 1 42 ALA H . . 5.230 4.645 4.339 4.906 . 0 0 "[ . 1 . 2]" 1
513 1 28 VAL MG2 1 42 ALA HA . . 4.270 3.919 3.537 4.162 . 0 0 "[ . 1 . 2]" 1
514 1 28 VAL MG2 1 45 ALA H . . 5.500 5.087 4.839 5.318 . 0 0 "[ . 1 . 2]" 1
515 1 28 VAL MG2 1 45 ALA MB . . 3.330 3.157 2.806 3.304 . 0 0 "[ . 1 . 2]" 1
516 1 28 VAL MG2 1 57 PHE QE . . 3.630 2.755 2.377 3.108 . 0 0 "[ . 1 . 2]" 1
517 1 28 VAL MG2 1 57 PHE HZ . . 3.290 2.310 1.895 2.843 . 0 0 "[ . 1 . 2]" 1
518 1 29 ASN H 1 29 ASN HB2 . . 4.140 3.213 2.747 3.769 . 0 0 "[ . 1 . 2]" 1
519 1 29 ASN H 1 29 ASN HB3 . . 4.140 2.614 2.346 3.041 . 0 0 "[ . 1 . 2]" 1
520 1 29 ASN H 1 30 VAL H . . 4.490 4.059 3.850 4.254 . 0 0 "[ . 1 . 2]" 1
521 1 29 ASN H 1 30 VAL MG2 . . 4.340 4.187 3.972 4.323 . 0 0 "[ . 1 . 2]" 1
522 1 29 ASN HA 1 30 VAL H . . 2.930 2.196 2.147 2.293 . 0 0 "[ . 1 . 2]" 1
523 1 29 ASN QB 1 29 ASN QD . . 2.990 2.126 2.063 2.476 . 0 0 "[ . 1 . 2]" 1
524 1 29 ASN QB 1 30 VAL H . . 4.150 3.899 3.530 4.042 . 0 0 "[ . 1 . 2]" 1
525 1 29 ASN HB2 1 29 ASN HD22 . . 4.080 3.752 3.433 4.059 . 0 0 "[ . 1 . 2]" 1
526 1 29 ASN HB2 1 30 VAL H . . 4.880 4.321 3.697 4.631 . 0 0 "[ . 1 . 2]" 1
527 1 29 ASN HB3 1 29 ASN HD22 . . 4.080 3.648 3.436 4.096 0.016 9 0 "[ . 1 . 2]" 1
528 1 29 ASN HB3 1 30 VAL H . . 4.880 4.480 4.300 4.596 . 0 0 "[ . 1 . 2]" 1
529 1 29 ASN QD 1 31 THR MG . . 3.410 2.227 1.824 3.362 . 0 0 "[ . 1 . 2]" 1
530 1 29 ASN HD21 1 31 THR MG . . 3.900 3.060 2.118 3.817 . 0 0 "[ . 1 . 2]" 1
531 1 29 ASN HD22 1 31 THR MG . . 3.900 2.486 1.836 3.783 . 0 0 "[ . 1 . 2]" 1
532 1 30 VAL H 1 30 VAL HB . . 3.170 2.495 2.448 2.581 . 0 0 "[ . 1 . 2]" 1
533 1 30 VAL H 1 30 VAL MG1 . . 3.910 3.783 3.758 3.825 . 0 0 "[ . 1 . 2]" 1
534 1 30 VAL H 1 30 VAL MG2 . . 3.250 2.424 2.141 2.701 . 0 0 "[ . 1 . 2]" 1
535 1 30 VAL H 1 31 THR H . . 4.870 4.306 4.139 4.494 . 0 0 "[ . 1 . 2]" 1
536 1 30 VAL HA 1 30 VAL MG1 . . 3.470 2.356 2.322 2.413 . 0 0 "[ . 1 . 2]" 1
537 1 30 VAL HA 1 30 VAL MG2 . . 3.480 2.384 2.336 2.470 . 0 0 "[ . 1 . 2]" 1
538 1 30 VAL HA 1 31 THR H . . 3.060 2.158 2.140 2.186 . 0 0 "[ . 1 . 2]" 1
539 1 30 VAL HA 1 32 ASP H . . 3.770 3.667 3.496 3.761 . 0 0 "[ . 1 . 2]" 1
540 1 30 VAL HA 1 36 SER H . . 5.430 5.242 4.857 5.397 . 0 0 "[ . 1 . 2]" 1
541 1 30 VAL HA 1 36 SER HA . . 4.490 4.114 3.644 4.425 . 0 0 "[ . 1 . 2]" 1
542 1 30 VAL HB 1 31 THR H . . 5.040 4.381 4.275 4.449 . 0 0 "[ . 1 . 2]" 1
543 1 30 VAL MG1 1 31 THR H . . 3.830 2.858 2.485 3.061 . 0 0 "[ . 1 . 2]" 1
544 1 30 VAL MG1 1 32 ASP H . . 3.510 3.304 2.829 3.495 . 0 0 "[ . 1 . 2]" 1
545 1 30 VAL MG1 1 36 SER HB2 . . 4.390 3.193 2.740 3.448 . 0 0 "[ . 1 . 2]" 1
546 1 30 VAL MG1 1 36 SER QB . . 3.850 2.708 2.357 3.046 . 0 0 "[ . 1 . 2]" 1
547 1 30 VAL MG1 1 36 SER HB3 . . 4.390 2.943 2.477 3.392 . 0 0 "[ . 1 . 2]" 1
548 1 30 VAL MG1 1 37 TRP HE1 . . 3.570 2.972 2.617 3.347 . 0 0 "[ . 1 . 2]" 1
549 1 30 VAL MG1 1 37 TRP HZ2 . . 3.740 2.995 2.563 3.583 . 0 0 "[ . 1 . 2]" 1
550 1 30 VAL MG2 1 31 THR H . . 4.200 4.145 4.002 4.200 . 0 0 "[ . 1 . 2]" 1
551 1 30 VAL MG2 1 32 ASP H . . 5.500 5.152 4.915 5.277 . 0 0 "[ . 1 . 2]" 1
552 1 30 VAL MG2 1 36 SER HB2 . . 4.330 3.801 2.513 4.309 . 0 0 "[ . 1 . 2]" 1
553 1 30 VAL MG2 1 36 SER HB3 . . 4.330 2.820 2.428 4.026 . 0 0 "[ . 1 . 2]" 1
554 1 30 VAL MG2 1 37 TRP HE1 . . 5.240 4.352 3.978 4.824 . 0 0 "[ . 1 . 2]" 1
555 1 30 VAL MG2 1 37 TRP HZ2 . . 4.990 4.150 3.744 4.627 . 0 0 "[ . 1 . 2]" 1
556 1 30 VAL MG2 1 42 ALA HA . . 4.340 3.417 3.112 3.747 . 0 0 "[ . 1 . 2]" 1
557 1 31 THR H 1 31 THR MG . . 3.890 2.940 2.311 3.871 . 0 0 "[ . 1 . 2]" 1
558 1 31 THR H 1 32 ASP H . . 3.080 1.927 1.803 2.061 . 0 0 "[ . 1 . 2]" 1
559 1 31 THR H 1 32 ASP HA . . 4.860 4.633 4.488 4.716 . 0 0 "[ . 1 . 2]" 1
560 1 31 THR H 1 36 SER HB2 . . 4.350 3.882 3.176 4.341 . 0 0 "[ . 1 . 2]" 1
561 1 31 THR H 1 36 SER QB . . 3.690 3.216 2.238 3.635 . 0 0 "[ . 1 . 2]" 1
562 1 31 THR H 1 36 SER HB3 . . 4.350 3.459 2.288 3.998 . 0 0 "[ . 1 . 2]" 1
563 1 31 THR H 1 36 SER HG . . 4.010 2.605 1.920 4.002 . 0 0 "[ . 1 . 2]" 1
564 1 31 THR HA 1 31 THR MG . . 3.380 2.336 2.183 3.200 . 0 0 "[ . 1 . 2]" 1
565 1 31 THR HB 1 32 ASP H . . 4.150 3.744 2.669 4.042 . 0 0 "[ . 1 . 2]" 1
566 1 32 ASP H 1 33 LEU H . . 5.180 4.406 4.374 4.434 . 0 0 "[ . 1 . 2]" 1
567 1 32 ASP H 1 36 SER H . . 4.200 3.811 3.285 4.141 . 0 0 "[ . 1 . 2]" 1
568 1 32 ASP H 1 36 SER HB2 . . 4.230 3.533 2.979 4.003 . 0 0 "[ . 1 . 2]" 1
569 1 32 ASP H 1 36 SER HB3 . . 4.230 3.827 2.385 4.225 . 0 0 "[ . 1 . 2]" 1
570 1 32 ASP H 1 36 SER HG . . 3.740 2.359 1.896 3.580 . 0 0 "[ . 1 . 2]" 1
571 1 32 ASP HA 1 33 LEU H . . 3.520 2.592 2.207 2.652 . 0 0 "[ . 1 . 2]" 1
572 1 32 ASP QB 1 33 LEU H . . 3.180 2.204 1.920 2.945 . 0 0 "[ . 1 . 2]" 1
573 1 32 ASP QB 1 34 THR H . . 3.660 2.500 2.351 2.640 . 0 0 "[ . 1 . 2]" 1
574 1 32 ASP HB2 1 33 LEU H . . 3.860 3.302 1.939 3.770 . 0 0 "[ . 1 . 2]" 1
575 1 32 ASP HB2 1 34 THR H . . 4.310 3.198 2.560 4.256 . 0 0 "[ . 1 . 2]" 1
576 1 32 ASP HB3 1 33 LEU H . . 3.860 2.344 1.931 3.795 . 0 0 "[ . 1 . 2]" 1
577 1 32 ASP HB3 1 34 THR H . . 4.310 2.841 2.366 4.308 . 0 0 "[ . 1 . 2]" 1
578 1 33 LEU H 1 33 LEU HB2 . . 3.980 2.655 2.565 2.739 . 0 0 "[ . 1 . 2]" 1
579 1 33 LEU H 1 33 LEU QB . . 3.330 2.603 2.515 2.679 . 0 0 "[ . 1 . 2]" 1
580 1 33 LEU H 1 33 LEU HB3 . . 3.980 3.757 3.626 3.796 . 0 0 "[ . 1 . 2]" 1
581 1 33 LEU H 1 33 LEU MD1 . . 4.400 3.680 3.339 3.895 . 0 0 "[ . 1 . 2]" 1
582 1 33 LEU H 1 33 LEU MD2 . . 4.310 3.902 3.633 4.091 . 0 0 "[ . 1 . 2]" 1
583 1 33 LEU H 1 33 LEU HG . . 4.040 2.745 2.263 2.937 . 0 0 "[ . 1 . 2]" 1
584 1 33 LEU H 1 34 THR H . . 3.510 2.556 2.258 3.127 . 0 0 "[ . 1 . 2]" 1
585 1 33 LEU H 1 34 THR MG . . 4.500 3.615 3.302 4.029 . 0 0 "[ . 1 . 2]" 1
586 1 33 LEU H 1 36 SER H . . 5.170 4.935 4.638 5.146 . 0 0 "[ . 1 . 2]" 1
587 1 33 LEU H 1 37 TRP HE1 . . 5.240 4.651 4.482 4.823 . 0 0 "[ . 1 . 2]" 1
588 1 33 LEU HA 1 33 LEU MD1 . . 4.290 3.952 3.902 3.982 . 0 0 "[ . 1 . 2]" 1
589 1 33 LEU HA 1 33 LEU MD2 . . 3.290 2.306 2.021 2.437 . 0 0 "[ . 1 . 2]" 1
590 1 33 LEU HA 1 37 TRP HD1 . . 3.880 2.381 2.168 2.841 . 0 0 "[ . 1 . 2]" 1
591 1 33 LEU HA 1 37 TRP HE1 . . 3.180 2.075 1.899 2.390 . 0 0 "[ . 1 . 2]" 1
592 1 33 LEU HA 1 37 TRP HZ2 . . 4.950 4.592 4.322 4.852 . 0 0 "[ . 1 . 2]" 1
593 1 33 LEU HA 1 106 LEU MD1 . . 4.710 3.660 3.263 3.894 . 0 0 "[ . 1 . 2]" 1
594 1 33 LEU QB 1 33 LEU MD1 . . 2.960 2.048 1.978 2.099 . 0 0 "[ . 1 . 2]" 1
595 1 33 LEU QB 1 34 THR H . . 4.110 3.750 3.591 3.829 . 0 0 "[ . 1 . 2]" 1
596 1 33 LEU QB 1 37 TRP HE1 . . 4.360 3.633 3.058 3.950 . 0 0 "[ . 1 . 2]" 1
597 1 33 LEU QB 1 106 LEU MD1 . . 3.800 2.556 2.273 2.854 . 0 0 "[ . 1 . 2]" 1
598 1 33 LEU HB2 1 33 LEU MD1 . . 3.430 2.171 2.057 2.318 . 0 0 "[ . 1 . 2]" 1
599 1 33 LEU HB2 1 34 THR H . . 4.820 4.033 3.806 4.162 . 0 0 "[ . 1 . 2]" 1
600 1 33 LEU HB3 1 33 LEU MD1 . . 3.430 2.535 2.399 2.666 . 0 0 "[ . 1 . 2]" 1
601 1 33 LEU HB3 1 34 THR H . . 4.820 4.464 4.403 4.498 . 0 0 "[ . 1 . 2]" 1
602 1 33 LEU MD2 1 34 THR H . . 4.910 4.801 4.605 4.900 . 0 0 "[ . 1 . 2]" 1
603 1 33 LEU MD2 1 37 TRP HE1 . . 3.580 2.091 1.879 2.408 . 0 0 "[ . 1 . 2]" 1
604 1 33 LEU MD2 1 37 TRP HZ2 . . 4.110 2.796 2.621 2.936 . 0 0 "[ . 1 . 2]" 1
605 1 33 LEU MD2 1 106 LEU MD1 . . 3.350 2.191 1.876 2.629 . 0 0 "[ . 1 . 2]" 1
606 1 33 LEU HG 1 37 TRP HE1 . . 4.330 3.941 3.640 4.173 . 0 0 "[ . 1 . 2]" 1
607 1 34 THR H 1 34 THR MG . . 3.960 3.216 3.034 3.517 . 0 0 "[ . 1 . 2]" 1
608 1 34 THR H 1 35 THR H . . 3.670 2.159 1.812 2.617 . 0 0 "[ . 1 . 2]" 1
609 1 34 THR H 1 35 THR MG . . 4.730 4.162 3.430 4.546 . 0 0 "[ . 1 . 2]" 1
610 1 34 THR H 1 36 SER H . . 3.810 2.982 2.632 3.264 . 0 0 "[ . 1 . 2]" 1
611 1 34 THR H 1 37 TRP H . . 4.590 3.955 3.664 4.283 . 0 0 "[ . 1 . 2]" 1
612 1 34 THR H 1 37 TRP HD1 . . 3.760 3.264 3.010 3.653 . 0 0 "[ . 1 . 2]" 1
613 1 34 THR H 1 37 TRP HE1 . . 5.320 4.582 4.165 4.895 . 0 0 "[ . 1 . 2]" 1
614 1 34 THR HA 1 34 THR MG . . 3.350 2.188 2.004 2.311 . 0 0 "[ . 1 . 2]" 1
615 1 34 THR HA 1 35 THR HA . . 4.790 4.623 4.585 4.664 . 0 0 "[ . 1 . 2]" 1
616 1 34 THR HA 1 35 THR MG . . 5.220 4.758 4.535 5.015 . 0 0 "[ . 1 . 2]" 1
617 1 34 THR HA 1 37 TRP HD1 . . 4.550 4.148 3.863 4.470 . 0 0 "[ . 1 . 2]" 1
618 1 34 THR HA 1 97 PRO QG . . 4.110 2.379 1.978 2.672 . 0 0 "[ . 1 . 2]" 1
619 1 34 THR HA 1 102 MET QG . . 4.170 2.595 2.157 2.877 . 0 0 "[ . 1 . 2]" 1
620 1 34 THR HB 1 35 THR H . . 3.990 3.216 2.667 3.689 . 0 0 "[ . 1 . 2]" 1
621 1 34 THR HB 1 35 THR MG . . 4.090 3.383 3.019 3.942 . 0 0 "[ . 1 . 2]" 1
622 1 34 THR HB 1 96 GLU HG2 . . 4.420 3.671 2.562 4.424 0.004 17 0 "[ . 1 . 2]" 1
623 1 34 THR HB 1 96 GLU HG3 . . 4.420 3.611 2.842 4.414 . 0 0 "[ . 1 . 2]" 1
624 1 34 THR HB 1 97 PRO QB . . 4.590 4.448 4.176 4.592 0.002 3 0 "[ . 1 . 2]" 1
625 1 34 THR HB 1 97 PRO HD2 . . 4.210 2.280 2.000 2.760 . 0 0 "[ . 1 . 2]" 1
626 1 34 THR HB 1 97 PRO HD3 . . 4.600 3.956 3.642 4.411 . 0 0 "[ . 1 . 2]" 1
627 1 34 THR HB 1 97 PRO HG2 . . 4.940 2.583 2.276 2.866 . 0 0 "[ . 1 . 2]" 1
628 1 34 THR HB 1 97 PRO QG . . 4.270 2.543 2.251 2.816 . 0 0 "[ . 1 . 2]" 1
629 1 34 THR HB 1 97 PRO HG3 . . 4.940 3.814 3.461 4.141 . 0 0 "[ . 1 . 2]" 1
630 1 34 THR MG 1 35 THR H . . 4.210 3.927 3.737 4.131 . 0 0 "[ . 1 . 2]" 1
631 1 34 THR MG 1 97 PRO QG . . 4.470 2.638 2.236 3.199 . 0 0 "[ . 1 . 2]" 1
632 1 34 THR MG 1 99 LYS H . . 4.390 3.203 2.615 3.707 . 0 0 "[ . 1 . 2]" 1
633 1 34 THR MG 1 99 LYS HA . . 3.520 2.318 1.998 2.617 . 0 0 "[ . 1 . 2]" 1
634 1 34 THR MG 1 99 LYS QB . . 3.530 2.751 2.225 3.531 0.001 17 0 "[ . 1 . 2]" 1
635 1 34 THR MG 1 100 LEU H . . 5.210 4.943 4.573 5.196 . 0 0 "[ . 1 . 2]" 1
636 1 34 THR MG 1 102 MET H . . 5.120 4.899 4.538 5.117 . 0 0 "[ . 1 . 2]" 1
637 1 34 THR MG 1 102 MET HG2 . . 4.770 4.247 3.635 4.772 0.002 6 0 "[ . 1 . 2]" 1
638 1 34 THR MG 1 102 MET QG . . 4.060 3.081 2.778 3.497 . 0 0 "[ . 1 . 2]" 1
639 1 34 THR MG 1 102 MET HG3 . . 4.770 3.176 2.839 3.685 . 0 0 "[ . 1 . 2]" 1
640 1 35 THR H 1 35 THR HB . . 3.890 3.541 2.786 3.710 . 0 0 "[ . 1 . 2]" 1
641 1 35 THR H 1 35 THR MG . . 3.020 2.479 1.898 2.804 . 0 0 "[ . 1 . 2]" 1
642 1 35 THR H 1 36 SER H . . 3.780 2.323 2.095 2.529 . 0 0 "[ . 1 . 2]" 1
643 1 35 THR H 1 37 TRP H . . 5.160 3.881 3.521 4.094 . 0 0 "[ . 1 . 2]" 1
644 1 35 THR H 1 37 TRP HD1 . . 5.280 4.296 3.698 4.631 . 0 0 "[ . 1 . 2]" 1
645 1 35 THR H 1 38 ARG QD . . 5.340 5.153 4.617 5.339 . 0 0 "[ . 1 . 2]" 1
646 1 35 THR H 1 97 PRO HD2 . . 5.500 4.628 3.977 5.467 . 0 0 "[ . 1 . 2]" 1
647 1 35 THR HA 1 35 THR MG . . 3.410 2.449 2.220 3.200 . 0 0 "[ . 1 . 2]" 1
648 1 35 THR HA 1 37 TRP H . . 4.190 3.809 3.381 4.074 . 0 0 "[ . 1 . 2]" 1
649 1 35 THR HA 1 38 ARG H . . 4.110 3.539 3.103 3.680 . 0 0 "[ . 1 . 2]" 1
650 1 35 THR HA 1 38 ARG QB . . 4.510 2.045 1.988 2.259 . 0 0 "[ . 1 . 2]" 1
651 1 35 THR HA 1 38 ARG HD2 . . 4.720 3.394 2.385 4.357 . 0 0 "[ . 1 . 2]" 1
652 1 35 THR HA 1 38 ARG QD . . 3.950 2.688 2.202 3.022 . 0 0 "[ . 1 . 2]" 1
653 1 35 THR HA 1 38 ARG HD3 . . 4.720 3.435 2.227 4.640 . 0 0 "[ . 1 . 2]" 1
654 1 35 THR HA 1 38 ARG HG2 . . 3.820 3.739 3.565 3.827 0.007 18 0 "[ . 1 . 2]" 1
655 1 35 THR HA 1 38 ARG HG3 . . 4.950 4.731 4.571 4.888 . 0 0 "[ . 1 . 2]" 1
656 1 35 THR HB 1 36 SER H . . 4.970 3.738 3.418 4.198 . 0 0 "[ . 1 . 2]" 1
657 1 35 THR HB 1 38 ARG QB . . 4.640 3.776 3.558 4.066 . 0 0 "[ . 1 . 2]" 1
658 1 35 THR HB 1 38 ARG HD2 . . 4.820 3.601 2.183 4.642 . 0 0 "[ . 1 . 2]" 1
659 1 35 THR HB 1 38 ARG HD3 . . 4.820 3.239 2.059 4.726 . 0 0 "[ . 1 . 2]" 1
660 1 35 THR MG 1 36 SER H . . 4.690 3.655 2.096 4.018 . 0 0 "[ . 1 . 2]" 1
661 1 35 THR MG 1 38 ARG QD . . 4.510 3.249 2.661 4.041 . 0 0 "[ . 1 . 2]" 1
662 1 35 THR MG 1 96 GLU HA . . 5.420 3.869 3.236 5.041 . 0 0 "[ . 1 . 2]" 1
663 1 35 THR MG 1 97 PRO HD2 . . 5.090 3.730 3.113 4.815 . 0 0 "[ . 1 . 2]" 1
664 1 36 SER H 1 36 SER HB2 . . 3.780 2.652 2.314 3.578 . 0 0 "[ . 1 . 2]" 1
665 1 36 SER H 1 36 SER QB . . 3.300 2.478 2.271 2.655 . 0 0 "[ . 1 . 2]" 1
666 1 36 SER H 1 36 SER HB3 . . 3.780 3.460 2.298 3.599 . 0 0 "[ . 1 . 2]" 1
667 1 36 SER H 1 36 SER HG . . 3.570 2.686 1.977 3.570 . 0 0 "[ . 1 . 2]" 1
668 1 36 SER H 1 37 TRP H . . 3.520 2.732 2.578 2.830 . 0 0 "[ . 1 . 2]" 1
669 1 36 SER H 1 37 TRP HD1 . . 4.110 3.298 3.096 3.493 . 0 0 "[ . 1 . 2]" 1
670 1 36 SER H 1 38 ARG H . . 4.650 4.326 3.978 4.430 . 0 0 "[ . 1 . 2]" 1
671 1 36 SER HA 1 38 ARG H . . 4.000 3.887 3.807 3.985 . 0 0 "[ . 1 . 2]" 1
672 1 36 SER QB 1 37 TRP H . . 3.850 2.933 2.638 3.735 . 0 0 "[ . 1 . 2]" 1
673 1 36 SER QB 1 37 TRP HD1 . . 4.210 2.440 2.086 3.729 . 0 0 "[ . 1 . 2]" 1
674 1 36 SER QB 1 37 TRP HE1 . . 3.970 2.833 2.434 3.976 0.006 14 0 "[ . 1 . 2]" 1
675 1 36 SER QB 1 42 ALA MB . . 4.760 3.019 2.621 3.413 . 0 0 "[ . 1 . 2]" 1
676 1 36 SER HB2 1 37 TRP H . . 4.590 3.066 2.695 4.324 . 0 0 "[ . 1 . 2]" 1
677 1 36 SER HB2 1 37 TRP HD1 . . 4.990 2.529 2.100 4.454 . 0 0 "[ . 1 . 2]" 1
678 1 36 SER HB2 1 37 TRP HE1 . . 4.670 2.952 2.464 4.500 . 0 0 "[ . 1 . 2]" 1
679 1 36 SER HB2 1 42 ALA MB . . 5.450 3.860 3.290 4.487 . 0 0 "[ . 1 . 2]" 1
680 1 36 SER HB3 1 37 TRP H . . 4.590 3.910 3.601 4.241 . 0 0 "[ . 1 . 2]" 1
681 1 36 SER HB3 1 37 TRP HD1 . . 4.990 3.788 3.367 4.057 . 0 0 "[ . 1 . 2]" 1
682 1 36 SER HB3 1 37 TRP HE1 . . 4.670 3.859 3.446 4.429 . 0 0 "[ . 1 . 2]" 1
683 1 36 SER HB3 1 42 ALA MB . . 5.450 3.267 2.753 4.718 . 0 0 "[ . 1 . 2]" 1
684 1 37 TRP H 1 37 TRP HB2 . . 3.370 2.778 2.677 2.868 . 0 0 "[ . 1 . 2]" 1
685 1 37 TRP H 1 37 TRP HB3 . . 3.930 3.764 3.709 3.844 . 0 0 "[ . 1 . 2]" 1
686 1 37 TRP H 1 37 TRP HD1 . . 3.250 2.078 1.920 2.383 . 0 0 "[ . 1 . 2]" 1
687 1 37 TRP H 1 37 TRP HE1 . . 4.730 4.464 4.255 4.732 0.002 17 0 "[ . 1 . 2]" 1
688 1 37 TRP H 1 38 ARG H . . 3.020 2.642 2.140 2.828 . 0 0 "[ . 1 . 2]" 1
689 1 37 TRP H 1 38 ARG QB . . 4.090 3.972 3.770 4.091 0.001 18 0 "[ . 1 . 2]" 1
690 1 37 TRP H 1 39 SER H . . 5.080 4.860 4.498 5.062 . 0 0 "[ . 1 . 2]" 1
691 1 37 TRP H 1 91 MET ME . . 5.060 4.509 4.122 4.854 . 0 0 "[ . 1 . 2]" 1
692 1 37 TRP HA 1 37 TRP HD1 . . 4.890 3.972 3.868 4.066 . 0 0 "[ . 1 . 2]" 1
693 1 37 TRP HA 1 38 ARG HA . . 5.500 4.637 4.588 4.790 . 0 0 "[ . 1 . 2]" 1
694 1 37 TRP HA 1 40 GLY H . . 3.990 3.244 2.974 3.466 . 0 0 "[ . 1 . 2]" 1
695 1 37 TRP HA 1 42 ALA H . . 4.510 3.751 3.482 4.079 . 0 0 "[ . 1 . 2]" 1
696 1 37 TRP HA 1 42 ALA MB . . 3.960 2.233 1.973 2.887 . 0 0 "[ . 1 . 2]" 1
697 1 37 TRP HB2 1 38 ARG H . . 4.160 4.078 3.678 4.167 0.007 8 0 "[ . 1 . 2]" 1
698 1 37 TRP HB2 1 102 MET ME . . 3.770 2.840 2.033 3.714 . 0 0 "[ . 1 . 2]" 1
699 1 37 TRP HB3 1 38 ARG H . . 4.550 4.539 4.424 4.562 0.012 8 0 "[ . 1 . 2]" 1
700 1 37 TRP HB3 1 102 MET ME . . 3.790 3.116 2.471 3.792 0.002 5 0 "[ . 1 . 2]" 1
701 1 37 TRP HD1 1 38 ARG H . . 4.720 4.680 4.479 4.721 0.001 13 0 "[ . 1 . 2]" 1
702 1 37 TRP HE1 1 42 ALA MB . . 5.500 4.290 3.988 4.543 . 0 0 "[ . 1 . 2]" 1
703 1 37 TRP HE1 1 106 LEU MD1 . . 4.700 3.623 2.960 4.164 . 0 0 "[ . 1 . 2]" 1
704 1 37 TRP HE3 1 42 ALA MB . . 4.470 2.980 2.704 3.499 . 0 0 "[ . 1 . 2]" 1
705 1 37 TRP HE3 1 43 LEU H . . 4.310 2.955 2.572 3.258 . 0 0 "[ . 1 . 2]" 1
706 1 37 TRP HE3 1 43 LEU HA . . 3.790 3.461 3.270 3.765 . 0 0 "[ . 1 . 2]" 1
707 1 37 TRP HE3 1 43 LEU QB . . 4.530 2.152 1.998 2.546 . 0 0 "[ . 1 . 2]" 1
708 1 37 TRP HE3 1 43 LEU MD1 . . 3.920 3.410 2.939 3.845 . 0 0 "[ . 1 . 2]" 1
709 1 37 TRP HE3 1 46 ILE MD . . 4.460 4.219 3.971 4.430 . 0 0 "[ . 1 . 2]" 1
710 1 37 TRP HE3 1 106 LEU MD2 . . 4.340 2.822 2.508 3.263 . 0 0 "[ . 1 . 2]" 1
711 1 37 TRP HH2 1 42 ALA MB . . 4.390 4.172 3.939 4.389 . 0 0 "[ . 1 . 2]" 1
712 1 37 TRP HH2 1 43 LEU HA . . 4.840 4.189 3.923 4.540 . 0 0 "[ . 1 . 2]" 1
713 1 37 TRP HH2 1 46 ILE MD . . 3.350 1.998 1.919 2.222 . 0 0 "[ . 1 . 2]" 1
714 1 37 TRP HH2 1 46 ILE HG12 . . 5.500 4.406 4.124 4.698 . 0 0 "[ . 1 . 2]" 1
715 1 37 TRP HH2 1 46 ILE HG13 . . 4.900 4.233 4.033 4.552 . 0 0 "[ . 1 . 2]" 1
716 1 37 TRP HH2 1 46 ILE MG . . 5.290 4.860 4.578 5.099 . 0 0 "[ . 1 . 2]" 1
717 1 37 TRP HH2 1 106 LEU MD2 . . 4.550 2.941 2.504 3.428 . 0 0 "[ . 1 . 2]" 1
718 1 37 TRP HZ2 1 42 ALA MB . . 5.310 4.217 4.037 4.444 . 0 0 "[ . 1 . 2]" 1
719 1 37 TRP HZ2 1 46 ILE MD . . 4.190 3.939 3.641 4.192 0.002 17 0 "[ . 1 . 2]" 1
720 1 37 TRP HZ2 1 106 LEU MD1 . . 4.330 3.376 2.884 3.924 . 0 0 "[ . 1 . 2]" 1
721 1 37 TRP HZ3 1 42 ALA MB . . 4.310 3.630 3.345 3.995 . 0 0 "[ . 1 . 2]" 1
722 1 37 TRP HZ3 1 43 LEU H . . 4.060 3.846 3.378 4.025 . 0 0 "[ . 1 . 2]" 1
723 1 37 TRP HZ3 1 43 LEU HA . . 4.530 2.305 2.105 2.591 . 0 0 "[ . 1 . 2]" 1
724 1 37 TRP HZ3 1 43 LEU QB . . 4.000 2.772 2.394 3.254 . 0 0 "[ . 1 . 2]" 1
725 1 37 TRP HZ3 1 43 LEU MD1 . . 4.770 2.356 2.040 2.707 . 0 0 "[ . 1 . 2]" 1
726 1 37 TRP HZ3 1 106 LEU MD2 . . 4.800 2.654 2.435 2.922 . 0 0 "[ . 1 . 2]" 1
727 1 38 ARG H 1 38 ARG QB . . 2.860 2.466 2.300 2.557 . 0 0 "[ . 1 . 2]" 1
728 1 38 ARG H 1 38 ARG HD2 . . 5.020 4.470 3.813 4.985 . 0 0 "[ . 1 . 2]" 1
729 1 38 ARG H 1 38 ARG QD . . 4.280 3.798 3.457 4.018 . 0 0 "[ . 1 . 2]" 1
730 1 38 ARG H 1 38 ARG HD3 . . 5.020 4.243 3.595 4.708 . 0 0 "[ . 1 . 2]" 1
731 1 38 ARG H 1 38 ARG HG2 . . 2.980 2.343 2.198 2.525 . 0 0 "[ . 1 . 2]" 1
732 1 38 ARG H 1 38 ARG HG3 . . 3.760 3.562 3.440 3.739 . 0 0 "[ . 1 . 2]" 1
733 1 38 ARG H 1 39 SER H . . 3.520 2.359 2.242 2.638 . 0 0 "[ . 1 . 2]" 1
734 1 38 ARG H 1 91 MET ME . . 4.610 4.175 3.850 4.490 . 0 0 "[ . 1 . 2]" 1
735 1 38 ARG HA 1 38 ARG QD . . 4.750 4.345 4.225 4.491 . 0 0 "[ . 1 . 2]" 1
736 1 38 ARG HA 1 38 ARG HG3 . . 3.800 3.686 3.601 3.802 0.002 8 0 "[ . 1 . 2]" 1
737 1 38 ARG HA 1 39 SER HA . . 5.500 4.659 4.614 4.718 . 0 0 "[ . 1 . 2]" 1
738 1 38 ARG HA 1 91 MET HA . . 5.500 4.868 4.335 5.459 . 0 0 "[ . 1 . 2]" 1
739 1 38 ARG HA 1 91 MET ME . . 3.520 2.256 1.886 2.985 . 0 0 "[ . 1 . 2]" 1
740 1 38 ARG HA 1 91 MET HG2 . . 4.300 4.079 3.506 4.308 0.008 13 0 "[ . 1 . 2]" 1
741 1 38 ARG HA 1 91 MET QG . . 3.750 2.700 2.051 3.270 . 0 0 "[ . 1 . 2]" 1
742 1 38 ARG HA 1 91 MET HG3 . . 4.300 2.746 2.065 3.388 . 0 0 "[ . 1 . 2]" 1
743 1 38 ARG HA 1 92 ALA HA . . 4.780 4.340 3.773 4.785 0.005 17 0 "[ . 1 . 2]" 1
744 1 38 ARG QB 1 38 ARG HD2 . . 3.450 2.347 2.208 2.658 . 0 0 "[ . 1 . 2]" 1
745 1 38 ARG QB 1 38 ARG HD3 . . 3.450 2.777 2.201 3.282 . 0 0 "[ . 1 . 2]" 1
746 1 38 ARG QB 1 39 SER H . . 4.380 3.447 3.357 3.622 . 0 0 "[ . 1 . 2]" 1
747 1 38 ARG QB 1 92 ALA HA . . 4.150 3.532 3.129 4.064 . 0 0 "[ . 1 . 2]" 1
748 1 38 ARG QD 1 39 SER QB . . 4.680 4.320 3.925 4.678 . 0 0 "[ . 1 . 2]" 1
749 1 38 ARG HG2 1 39 SER H . . 3.520 2.277 2.046 2.761 . 0 0 "[ . 1 . 2]" 1
750 1 38 ARG HG2 1 39 SER QB . . 4.370 3.309 3.149 3.482 . 0 0 "[ . 1 . 2]" 1
751 1 38 ARG HG3 1 39 SER H . . 4.720 2.646 2.359 3.015 . 0 0 "[ . 1 . 2]" 1
752 1 38 ARG HG3 1 39 SER HA . . 4.410 3.312 3.100 3.616 . 0 0 "[ . 1 . 2]" 1
753 1 38 ARG HG3 1 39 SER HB2 . . 4.560 3.212 2.780 4.484 . 0 0 "[ . 1 . 2]" 1
754 1 38 ARG HG3 1 39 SER QB . . 3.830 2.980 2.740 3.246 . 0 0 "[ . 1 . 2]" 1
755 1 38 ARG HG3 1 39 SER HB3 . . 4.560 3.992 2.911 4.436 . 0 0 "[ . 1 . 2]" 1
756 1 39 SER H 1 39 SER QB . . 3.120 2.322 2.227 2.658 . 0 0 "[ . 1 . 2]" 1
757 1 39 SER H 1 39 SER HG . . 4.490 4.165 2.834 4.491 0.001 9 0 "[ . 1 . 2]" 1
758 1 39 SER H 1 40 GLY H . . 3.600 2.371 2.157 2.501 . 0 0 "[ . 1 . 2]" 1
759 1 39 SER H 1 41 LEU H . . 4.870 4.479 4.028 4.830 . 0 0 "[ . 1 . 2]" 1
760 1 39 SER H 1 65 ALA MB . . 4.610 4.456 4.219 4.609 . 0 0 "[ . 1 . 2]" 1
761 1 39 SER HA 1 41 LEU H . . 4.900 4.691 4.412 4.868 . 0 0 "[ . 1 . 2]" 1
762 1 39 SER HA 1 65 ALA MB . . 3.050 2.036 1.890 2.254 . 0 0 "[ . 1 . 2]" 1
763 1 39 SER QB 1 40 GLY H . . 4.030 2.690 2.417 3.302 . 0 0 "[ . 1 . 2]" 1
764 1 39 SER QB 1 41 LEU H . . 3.920 2.964 2.609 3.443 . 0 0 "[ . 1 . 2]" 1
765 1 39 SER QB 1 41 LEU HG . . 4.210 3.074 2.637 3.573 . 0 0 "[ . 1 . 2]" 1
766 1 39 SER HB2 1 41 LEU H . . 4.690 4.415 3.463 4.592 . 0 0 "[ . 1 . 2]" 1
767 1 39 SER HB2 1 41 LEU HG . . 4.900 4.280 3.273 4.632 . 0 0 "[ . 1 . 2]" 1
768 1 39 SER HB3 1 41 LEU H . . 4.690 3.117 2.629 4.636 . 0 0 "[ . 1 . 2]" 1
769 1 39 SER HB3 1 41 LEU HG . . 4.900 3.265 2.671 4.625 . 0 0 "[ . 1 . 2]" 1
770 1 39 SER HG 1 41 LEU H . . 4.400 3.123 2.092 4.269 . 0 0 "[ . 1 . 2]" 1
771 1 39 SER HG 1 41 LEU MD2 . . 5.500 3.886 3.278 4.767 . 0 0 "[ . 1 . 2]" 1
772 1 40 GLY H 1 41 LEU H . . 3.680 2.654 2.131 2.967 . 0 0 "[ . 1 . 2]" 1
773 1 40 GLY H 1 41 LEU HG . . 4.910 4.247 3.942 4.633 . 0 0 "[ . 1 . 2]" 1
774 1 40 GLY H 1 42 ALA H . . 4.510 3.327 2.989 3.693 . 0 0 "[ . 1 . 2]" 1
775 1 40 GLY H 1 65 ALA MB . . 5.390 4.858 4.430 5.157 . 0 0 "[ . 1 . 2]" 1
776 1 40 GLY H 1 69 ASN HD22 . . 4.540 4.099 3.447 4.451 . 0 0 "[ . 1 . 2]" 1
777 1 40 GLY QA 1 42 ALA H . . 4.570 3.845 3.303 4.123 . 0 0 "[ . 1 . 2]" 1
778 1 40 GLY QA 1 43 LEU H . . 4.400 3.491 3.342 3.714 . 0 0 "[ . 1 . 2]" 1
779 1 40 GLY QA 1 44 CYS H . . 4.390 3.823 3.571 4.208 . 0 0 "[ . 1 . 2]" 1
780 1 40 GLY QA 1 69 ASN HD22 . . 4.440 3.694 3.101 4.063 . 0 0 "[ . 1 . 2]" 1
781 1 41 LEU H 1 41 LEU HB2 . . 3.710 2.693 2.487 2.762 . 0 0 "[ . 1 . 2]" 1
782 1 41 LEU H 1 41 LEU QB . . 3.000 2.621 2.448 2.677 . 0 0 "[ . 1 . 2]" 1
783 1 41 LEU H 1 41 LEU HB3 . . 3.710 3.605 3.584 3.650 . 0 0 "[ . 1 . 2]" 1
784 1 41 LEU H 1 41 LEU MD1 . . 3.990 3.540 3.477 3.701 . 0 0 "[ . 1 . 2]" 1
785 1 41 LEU H 1 41 LEU MD2 . . 3.860 3.092 2.835 3.625 . 0 0 "[ . 1 . 2]" 1
786 1 41 LEU H 1 41 LEU HG . . 3.110 2.020 1.919 2.569 . 0 0 "[ . 1 . 2]" 1
787 1 41 LEU H 1 42 ALA H . . 3.510 2.986 2.243 3.163 . 0 0 "[ . 1 . 2]" 1
788 1 41 LEU H 1 42 ALA MB . . 4.820 4.496 3.900 4.632 . 0 0 "[ . 1 . 2]" 1
789 1 41 LEU H 1 68 ASN QB . . 5.140 3.397 2.771 4.184 . 0 0 "[ . 1 . 2]" 1
790 1 41 LEU HA 1 41 LEU MD1 . . 4.160 3.902 3.882 3.925 . 0 0 "[ . 1 . 2]" 1
791 1 41 LEU HA 1 41 LEU MD2 . . 3.200 2.074 1.975 2.290 . 0 0 "[ . 1 . 2]" 1
792 1 41 LEU HA 1 44 CYS H . . 4.020 3.761 3.535 3.960 . 0 0 "[ . 1 . 2]" 1
793 1 41 LEU HA 1 44 CYS HB2 . . 4.280 2.316 2.075 2.544 . 0 0 "[ . 1 . 2]" 1
794 1 41 LEU HA 1 44 CYS QB . . 3.520 2.298 2.061 2.521 . 0 0 "[ . 1 . 2]" 1
795 1 41 LEU HA 1 44 CYS HB3 . . 4.280 3.845 3.538 4.121 . 0 0 "[ . 1 . 2]" 1
796 1 41 LEU HA 1 44 CYS HG . . 4.180 3.674 3.307 3.977 . 0 0 "[ . 1 . 2]" 1
797 1 41 LEU HA 1 45 ALA H . . 4.260 3.897 3.570 4.235 . 0 0 "[ . 1 . 2]" 1
798 1 41 LEU HA 1 57 PHE QE . . 4.300 3.007 2.105 3.688 . 0 0 "[ . 1 . 2]" 1
799 1 41 LEU HA 1 60 LEU MD1 . . 4.470 3.188 2.807 3.611 . 0 0 "[ . 1 . 2]" 1
800 1 41 LEU HA 1 68 ASN QB . . 4.710 4.011 3.534 4.444 . 0 0 "[ . 1 . 2]" 1
801 1 41 LEU QB 1 41 LEU MD1 . . 3.030 2.077 2.044 2.098 . 0 0 "[ . 1 . 2]" 1
802 1 41 LEU QB 1 42 ALA H . . 3.620 2.447 2.203 3.108 . 0 0 "[ . 1 . 2]" 1
803 1 41 LEU QB 1 45 ALA H . . 5.340 4.602 4.431 4.830 . 0 0 "[ . 1 . 2]" 1
804 1 41 LEU QB 1 57 PHE QE . . 4.100 2.239 1.982 3.148 . 0 0 "[ . 1 . 2]" 1
805 1 41 LEU QB 1 57 PHE HZ . . 4.150 2.487 2.016 3.416 . 0 0 "[ . 1 . 2]" 1
806 1 41 LEU HB2 1 41 LEU MD1 . . 3.470 2.275 2.174 2.355 . 0 0 "[ . 1 . 2]" 1
807 1 41 LEU HB2 1 41 LEU MD2 . . 3.660 3.184 3.175 3.193 . 0 0 "[ . 1 . 2]" 1
808 1 41 LEU HB2 1 42 ALA H . . 4.350 2.491 2.231 3.209 . 0 0 "[ . 1 . 2]" 1
809 1 41 LEU HB2 1 57 PHE QE . . 4.870 3.800 3.371 4.581 . 0 0 "[ . 1 . 2]" 1
810 1 41 LEU HB2 1 57 PHE HZ . . 4.930 3.959 3.402 4.834 . 0 0 "[ . 1 . 2]" 1
811 1 41 LEU HB3 1 41 LEU MD1 . . 3.470 2.409 2.349 2.487 . 0 0 "[ . 1 . 2]" 1
812 1 41 LEU HB3 1 41 LEU MD2 . . 3.660 2.330 2.204 2.396 . 0 0 "[ . 1 . 2]" 1
813 1 41 LEU HB3 1 42 ALA H . . 4.350 3.604 3.352 4.161 . 0 0 "[ . 1 . 2]" 1
814 1 41 LEU HB3 1 57 PHE QE . . 4.870 2.256 1.996 3.207 . 0 0 "[ . 1 . 2]" 1
815 1 41 LEU HB3 1 57 PHE HZ . . 4.930 2.515 2.031 3.492 . 0 0 "[ . 1 . 2]" 1
816 1 41 LEU MD1 1 57 PHE HZ . . 4.220 2.715 2.075 3.767 . 0 0 "[ . 1 . 2]" 1
817 1 41 LEU MD1 1 62 GLU H . . 4.710 3.728 3.245 4.547 . 0 0 "[ . 1 . 2]" 1
818 1 41 LEU MD1 1 62 GLU HA . . 3.450 2.468 1.974 3.234 . 0 0 "[ . 1 . 2]" 1
819 1 41 LEU MD1 1 62 GLU QB . . 3.660 2.816 2.103 3.617 . 0 0 "[ . 1 . 2]" 1
820 1 41 LEU MD1 1 62 GLU QG . . 4.740 3.404 1.962 4.407 . 0 0 "[ . 1 . 2]" 1
821 1 41 LEU MD1 1 68 ASN HD21 . . 5.300 4.194 3.378 5.198 . 0 0 "[ . 1 . 2]" 1
822 1 41 LEU MD2 1 42 ALA H . . 4.790 4.634 4.555 4.735 . 0 0 "[ . 1 . 2]" 1
823 1 41 LEU MD2 1 45 ALA H . . 5.410 5.183 4.823 5.409 . 0 0 "[ . 1 . 2]" 1
824 1 41 LEU MD2 1 57 PHE QD . . 4.750 3.584 3.216 3.976 . 0 0 "[ . 1 . 2]" 1
825 1 41 LEU MD2 1 57 PHE QE . . 3.960 2.815 1.966 3.289 . 0 0 "[ . 1 . 2]" 1
826 1 41 LEU MD2 1 57 PHE HZ . . 4.170 2.912 2.125 3.616 . 0 0 "[ . 1 . 2]" 1
827 1 41 LEU MD2 1 60 LEU HA . . 4.520 4.269 3.877 4.504 . 0 0 "[ . 1 . 2]" 1
828 1 41 LEU MD2 1 60 LEU HB2 . . 3.780 2.812 2.395 3.130 . 0 0 "[ . 1 . 2]" 1
829 1 41 LEU MD2 1 60 LEU HB3 . . 3.160 2.468 1.936 2.872 . 0 0 "[ . 1 . 2]" 1
830 1 41 LEU MD2 1 61 ASN H . . 4.690 4.425 4.103 4.693 0.003 12 0 "[ . 1 . 2]" 1
831 1 41 LEU MD2 1 62 GLU HA . . 4.090 3.220 2.390 3.855 . 0 0 "[ . 1 . 2]" 1
832 1 41 LEU MD2 1 68 ASN HD21 . . 4.080 2.971 2.274 3.929 . 0 0 "[ . 1 . 2]" 1
833 1 41 LEU MD2 1 68 ASN HD22 . . 4.090 2.735 1.930 3.444 . 0 0 "[ . 1 . 2]" 1
834 1 41 LEU HG 1 62 GLU HA . . 4.430 3.650 3.092 4.294 . 0 0 "[ . 1 . 2]" 1
835 1 41 LEU HG 1 68 ASN HD21 . . 4.740 3.426 2.543 4.705 . 0 0 "[ . 1 . 2]" 1
836 1 41 LEU HG 1 68 ASN HD22 . . 4.420 4.102 3.507 4.353 . 0 0 "[ . 1 . 2]" 1
837 1 42 ALA H 1 42 ALA MB . . 3.020 2.172 2.108 2.253 . 0 0 "[ . 1 . 2]" 1
838 1 42 ALA H 1 43 LEU H . . 3.630 3.103 2.735 3.314 . 0 0 "[ . 1 . 2]" 1
839 1 42 ALA H 1 44 CYS H . . 4.800 4.436 3.875 4.691 . 0 0 "[ . 1 . 2]" 1
840 1 42 ALA HA 1 45 ALA H . . 4.080 3.975 3.723 4.062 . 0 0 "[ . 1 . 2]" 1
841 1 42 ALA HA 1 45 ALA MB . . 3.590 3.133 2.907 3.273 . 0 0 "[ . 1 . 2]" 1
842 1 42 ALA HA 1 46 ILE H . . 5.150 4.956 4.726 5.122 . 0 0 "[ . 1 . 2]" 1
843 1 42 ALA MB 1 43 LEU H . . 3.500 2.288 2.166 2.396 . 0 0 "[ . 1 . 2]" 1
844 1 42 ALA MB 1 43 LEU HA . . 4.250 3.701 3.644 3.782 . 0 0 "[ . 1 . 2]" 1
845 1 42 ALA MB 1 44 CYS H . . 5.070 4.479 4.339 4.640 . 0 0 "[ . 1 . 2]" 1
846 1 43 LEU H 1 43 LEU HB2 . . 3.490 2.522 2.350 2.691 . 0 0 "[ . 1 . 2]" 1
847 1 43 LEU H 1 43 LEU HB3 . . 3.490 2.490 2.329 2.666 . 0 0 "[ . 1 . 2]" 1
848 1 43 LEU H 1 43 LEU MD1 . . 4.270 4.066 3.902 4.159 . 0 0 "[ . 1 . 2]" 1
849 1 43 LEU H 1 43 LEU MD2 . . 4.420 4.198 4.150 4.241 . 0 0 "[ . 1 . 2]" 1
850 1 43 LEU H 1 43 LEU HG . . 4.580 4.473 4.355 4.568 . 0 0 "[ . 1 . 2]" 1
851 1 43 LEU H 1 44 CYS H . . 3.430 2.806 2.605 2.889 . 0 0 "[ . 1 . 2]" 1
852 1 43 LEU H 1 44 CYS HG . . 4.870 4.489 4.125 4.845 . 0 0 "[ . 1 . 2]" 1
853 1 43 LEU H 1 45 ALA H . . 4.820 4.127 4.000 4.267 . 0 0 "[ . 1 . 2]" 1
854 1 43 LEU HA 1 43 LEU MD1 . . 3.300 2.041 1.978 2.155 . 0 0 "[ . 1 . 2]" 1
855 1 43 LEU HA 1 43 LEU MD2 . . 4.000 3.879 3.794 3.950 . 0 0 "[ . 1 . 2]" 1
856 1 43 LEU HA 1 43 LEU HG . . 3.870 3.192 3.110 3.336 . 0 0 "[ . 1 . 2]" 1
857 1 43 LEU HA 1 45 ALA H . . 4.810 4.077 3.762 4.352 . 0 0 "[ . 1 . 2]" 1
858 1 43 LEU HA 1 46 ILE H . . 3.860 3.376 3.154 3.522 . 0 0 "[ . 1 . 2]" 1
859 1 43 LEU HA 1 46 ILE HB . . 3.620 3.228 2.976 3.479 . 0 0 "[ . 1 . 2]" 1
860 1 43 LEU HA 1 46 ILE MD . . 4.030 2.356 2.034 2.731 . 0 0 "[ . 1 . 2]" 1
861 1 43 LEU HA 1 46 ILE HG12 . . 4.910 4.704 4.501 4.878 . 0 0 "[ . 1 . 2]" 1
862 1 43 LEU HA 1 46 ILE HG13 . . 3.900 3.325 3.102 3.638 . 0 0 "[ . 1 . 2]" 1
863 1 43 LEU HA 1 46 ILE MG . . 5.030 4.522 4.326 4.727 . 0 0 "[ . 1 . 2]" 1
864 1 43 LEU HA 1 47 ILE H . . 4.650 4.449 4.177 4.605 . 0 0 "[ . 1 . 2]" 1
865 1 43 LEU QB 1 43 LEU MD2 . . 3.020 2.068 2.042 2.095 . 0 0 "[ . 1 . 2]" 1
866 1 43 LEU QB 1 44 CYS H . . 3.480 2.293 2.121 2.483 . 0 0 "[ . 1 . 2]" 1
867 1 43 LEU HB2 1 43 LEU MD2 . . 3.480 2.384 2.219 2.465 . 0 0 "[ . 1 . 2]" 1
868 1 43 LEU HB2 1 44 CYS H . . 4.170 3.729 3.565 3.862 . 0 0 "[ . 1 . 2]" 1
869 1 43 LEU HB3 1 43 LEU MD2 . . 3.480 2.276 2.202 2.420 . 0 0 "[ . 1 . 2]" 1
870 1 43 LEU HB3 1 44 CYS H . . 4.170 2.315 2.137 2.514 . 0 0 "[ . 1 . 2]" 1
871 1 43 LEU MD1 1 44 CYS H . . 4.720 4.309 4.164 4.474 . 0 0 "[ . 1 . 2]" 1
872 1 43 LEU MD1 1 44 CYS HA . . 5.120 4.689 4.307 4.886 . 0 0 "[ . 1 . 2]" 1
873 1 43 LEU MD1 1 46 ILE H . . 4.320 4.135 3.879 4.310 . 0 0 "[ . 1 . 2]" 1
874 1 43 LEU MD1 1 46 ILE HB . . 3.880 2.728 2.333 2.959 . 0 0 "[ . 1 . 2]" 1
875 1 43 LEU MD1 1 46 ILE MD . . 3.950 2.329 2.022 2.598 . 0 0 "[ . 1 . 2]" 1
876 1 43 LEU MD1 1 46 ILE MG . . 3.900 3.416 3.036 3.591 . 0 0 "[ . 1 . 2]" 1
877 1 43 LEU MD1 1 47 ILE H . . 4.600 3.838 3.275 4.191 . 0 0 "[ . 1 . 2]" 1
878 1 43 LEU MD1 1 47 ILE MD . . 4.140 2.851 2.289 3.147 . 0 0 "[ . 1 . 2]" 1
879 1 43 LEU MD1 1 47 ILE QG . . 4.550 2.933 2.148 3.429 . 0 0 "[ . 1 . 2]" 1
880 1 43 LEU MD1 1 105 TYR QE . . 4.320 3.896 3.188 4.206 . 0 0 "[ . 1 . 2]" 1
881 1 43 LEU MD1 1 109 PHE QD . . 4.660 2.971 2.418 3.486 . 0 0 "[ . 1 . 2]" 1
882 1 43 LEU MD1 1 109 PHE QE . . 4.390 2.966 2.198 3.607 . 0 0 "[ . 1 . 2]" 1
883 1 43 LEU MD1 1 109 PHE HZ . . 4.340 3.896 3.366 4.267 . 0 0 "[ . 1 . 2]" 1
884 1 43 LEU MD2 1 44 CYS H . . 4.440 4.027 3.699 4.342 . 0 0 "[ . 1 . 2]" 1
885 1 43 LEU MD2 1 72 ALA MB . . 3.050 1.938 1.749 2.267 . 0 0 "[ . 1 . 2]" 1
886 1 43 LEU MD2 1 73 PHE H . . 4.350 4.048 3.782 4.329 . 0 0 "[ . 1 . 2]" 1
887 1 43 LEU MD2 1 73 PHE QD . . 3.710 3.347 2.880 3.693 . 0 0 "[ . 1 . 2]" 1
888 1 43 LEU MD2 1 73 PHE QE . . 4.180 3.086 2.561 3.515 . 0 0 "[ . 1 . 2]" 1
889 1 43 LEU MD2 1 105 TYR QD . . 4.420 3.964 3.251 4.388 . 0 0 "[ . 1 . 2]" 1
890 1 43 LEU MD2 1 105 TYR QE . . 3.320 2.638 2.057 3.210 . 0 0 "[ . 1 . 2]" 1
891 1 43 LEU MD2 1 109 PHE QD . . 4.450 3.995 3.478 4.444 . 0 0 "[ . 1 . 2]" 1
892 1 43 LEU MD2 1 109 PHE QE . . 4.090 2.774 2.141 3.526 . 0 0 "[ . 1 . 2]" 1
893 1 43 LEU HG 1 44 CYS H . . 3.960 3.471 3.120 3.749 . 0 0 "[ . 1 . 2]" 1
894 1 43 LEU HG 1 44 CYS HA . . 4.080 3.584 3.245 3.912 . 0 0 "[ . 1 . 2]" 1
895 1 43 LEU HG 1 47 ILE H . . 4.490 4.230 3.860 4.483 . 0 0 "[ . 1 . 2]" 1
896 1 43 LEU HG 1 47 ILE MD . . 3.220 2.229 1.937 2.524 . 0 0 "[ . 1 . 2]" 1
897 1 44 CYS H 1 44 CYS HB2 . . 3.830 2.545 2.373 2.676 . 0 0 "[ . 1 . 2]" 1
898 1 44 CYS H 1 44 CYS QB . . 3.130 2.495 2.340 2.608 . 0 0 "[ . 1 . 2]" 1
899 1 44 CYS H 1 44 CYS HB3 . . 3.830 3.599 3.573 3.619 . 0 0 "[ . 1 . 2]" 1
900 1 44 CYS H 1 44 CYS HG . . 3.090 2.360 2.025 2.643 . 0 0 "[ . 1 . 2]" 1
901 1 44 CYS H 1 45 ALA H . . 3.390 2.891 2.741 3.013 . 0 0 "[ . 1 . 2]" 1
902 1 44 CYS H 1 45 ALA MB . . 5.430 4.505 4.375 4.610 . 0 0 "[ . 1 . 2]" 1
903 1 44 CYS H 1 55 ILE MD . . 4.680 4.253 3.998 4.440 . 0 0 "[ . 1 . 2]" 1
904 1 44 CYS H 1 55 ILE MG . . 5.030 4.882 4.799 5.010 . 0 0 "[ . 1 . 2]" 1
905 1 44 CYS H 1 60 LEU MD1 . . 5.160 4.492 4.243 4.796 . 0 0 "[ . 1 . 2]" 1
906 1 44 CYS H 1 72 ALA MB . . 4.370 3.355 3.165 3.545 . 0 0 "[ . 1 . 2]" 1
907 1 44 CYS HA 1 44 CYS HG . . 4.240 3.419 3.098 3.677 . 0 0 "[ . 1 . 2]" 1
908 1 44 CYS HA 1 46 ILE H . . 5.060 4.602 4.319 4.979 . 0 0 "[ . 1 . 2]" 1
909 1 44 CYS HA 1 47 ILE H . . 4.210 3.674 3.484 4.015 . 0 0 "[ . 1 . 2]" 1
910 1 44 CYS HA 1 47 ILE HB . . 4.340 3.037 2.831 3.229 . 0 0 "[ . 1 . 2]" 1
911 1 44 CYS HA 1 47 ILE MD . . 3.670 2.557 2.228 2.850 . 0 0 "[ . 1 . 2]" 1
912 1 44 CYS HA 1 48 HIS H . . 4.390 3.723 3.521 3.926 . 0 0 "[ . 1 . 2]" 1
913 1 44 CYS HA 1 55 ILE HB . . 4.250 4.220 4.067 4.267 0.017 20 0 "[ . 1 . 2]" 1
914 1 44 CYS HA 1 55 ILE MD . . 3.560 2.079 1.908 2.413 . 0 0 "[ . 1 . 2]" 1
915 1 44 CYS HA 1 55 ILE MG . . 3.950 3.144 2.965 3.421 . 0 0 "[ . 1 . 2]" 1
916 1 44 CYS HA 1 60 LEU MD1 . . 5.290 3.964 3.794 4.294 . 0 0 "[ . 1 . 2]" 1
917 1 44 CYS HA 1 72 ALA MB . . 3.940 3.056 2.862 3.242 . 0 0 "[ . 1 . 2]" 1
918 1 44 CYS QB 1 45 ALA H . . 3.210 2.658 2.492 2.907 . 0 0 "[ . 1 . 2]" 1
919 1 44 CYS QB 1 55 ILE MD . . 3.810 2.835 2.519 3.084 . 0 0 "[ . 1 . 2]" 1
920 1 44 CYS QB 1 55 ILE MG . . 3.260 2.025 1.944 2.181 . 0 0 "[ . 1 . 2]" 1
921 1 44 CYS QB 1 57 PHE QE . . 4.720 3.609 2.841 4.086 . 0 0 "[ . 1 . 2]" 1
922 1 44 CYS QB 1 60 LEU MD1 . . 3.420 1.981 1.781 2.363 . 0 0 "[ . 1 . 2]" 1
923 1 44 CYS HB2 1 45 ALA H . . 3.910 2.730 2.547 3.019 . 0 0 "[ . 1 . 2]" 1
924 1 44 CYS HB2 1 55 ILE MD . . 4.380 4.075 3.873 4.248 . 0 0 "[ . 1 . 2]" 1
925 1 44 CYS HB2 1 55 ILE MG . . 3.780 3.580 3.434 3.772 . 0 0 "[ . 1 . 2]" 1
926 1 44 CYS HB2 1 57 PHE QD . . 4.440 3.479 2.554 4.063 . 0 0 "[ . 1 . 2]" 1
927 1 44 CYS HB2 1 60 LEU MD1 . . 3.950 2.644 2.388 3.037 . 0 0 "[ . 1 . 2]" 1
928 1 44 CYS HB3 1 45 ALA H . . 3.910 3.667 3.463 3.852 . 0 0 "[ . 1 . 2]" 1
929 1 44 CYS HB3 1 55 ILE MD . . 4.380 2.893 2.552 3.172 . 0 0 "[ . 1 . 2]" 1
930 1 44 CYS HB3 1 55 ILE MG . . 3.780 2.037 1.954 2.195 . 0 0 "[ . 1 . 2]" 1
931 1 44 CYS HB3 1 57 PHE QD . . 4.440 3.517 2.711 4.041 . 0 0 "[ . 1 . 2]" 1
932 1 44 CYS HB3 1 60 LEU MD1 . . 3.950 2.048 1.825 2.463 . 0 0 "[ . 1 . 2]" 1
933 1 44 CYS HG 1 60 LEU MD1 . . 4.620 3.527 3.239 3.782 . 0 0 "[ . 1 . 2]" 1
934 1 44 CYS HG 1 69 ASN HA . . 4.250 3.943 3.713 4.177 . 0 0 "[ . 1 . 2]" 1
935 1 44 CYS HG 1 72 ALA H . . 4.700 4.016 3.508 4.695 . 0 0 "[ . 1 . 2]" 1
936 1 44 CYS HG 1 72 ALA MB . . 3.780 2.589 2.164 3.161 . 0 0 "[ . 1 . 2]" 1
937 1 45 ALA H 1 45 ALA MB . . 2.980 2.173 2.031 2.236 . 0 0 "[ . 1 . 2]" 1
938 1 45 ALA H 1 46 ILE H . . 3.230 2.777 2.506 2.917 . 0 0 "[ . 1 . 2]" 1
939 1 45 ALA H 1 46 ILE HB . . 5.080 4.912 4.682 5.035 . 0 0 "[ . 1 . 2]" 1
940 1 45 ALA H 1 46 ILE HG13 . . 4.840 4.430 4.193 4.608 . 0 0 "[ . 1 . 2]" 1
941 1 45 ALA H 1 47 ILE H . . 5.010 4.341 4.058 4.520 . 0 0 "[ . 1 . 2]" 1
942 1 45 ALA H 1 57 PHE QD . . 4.230 3.879 3.438 4.233 0.003 11 0 "[ . 1 . 2]" 1
943 1 45 ALA H 1 60 LEU MD1 . . 5.500 4.621 4.209 4.996 . 0 0 "[ . 1 . 2]" 1
944 1 45 ALA H 1 72 ALA MB . . 5.500 5.465 5.341 5.507 0.007 15 0 "[ . 1 . 2]" 1
945 1 45 ALA HA 1 47 ILE H . . 5.100 4.647 4.360 4.848 . 0 0 "[ . 1 . 2]" 1
946 1 45 ALA HA 1 48 HIS H . . 4.430 3.923 3.623 4.194 . 0 0 "[ . 1 . 2]" 1
947 1 45 ALA HA 1 49 ARG H . . 4.720 3.860 3.569 4.140 . 0 0 "[ . 1 . 2]" 1
948 1 45 ALA HA 1 57 PHE QD . . 3.980 3.027 2.332 3.559 . 0 0 "[ . 1 . 2]" 1
949 1 45 ALA HA 1 57 PHE QE . . 5.280 4.068 2.696 4.748 . 0 0 "[ . 1 . 2]" 1
950 1 45 ALA MB 1 46 ILE H . . 3.340 2.424 2.182 2.683 . 0 0 "[ . 1 . 2]" 1
951 1 45 ALA MB 1 46 ILE HA . . 4.410 3.741 3.576 3.829 . 0 0 "[ . 1 . 2]" 1
952 1 45 ALA MB 1 57 PHE QD . . 4.350 3.349 2.637 3.892 . 0 0 "[ . 1 . 2]" 1
953 1 45 ALA MB 1 57 PHE QE . . 4.090 2.847 2.111 3.434 . 0 0 "[ . 1 . 2]" 1
954 1 46 ILE H 1 46 ILE HB . . 3.100 2.549 2.462 2.655 . 0 0 "[ . 1 . 2]" 1
955 1 46 ILE H 1 46 ILE MD . . 3.650 3.392 3.218 3.562 . 0 0 "[ . 1 . 2]" 1
956 1 46 ILE H 1 46 ILE HG12 . . 3.550 3.466 3.291 3.552 0.002 15 0 "[ . 1 . 2]" 1
957 1 46 ILE H 1 46 ILE HG13 . . 3.300 2.067 1.913 2.228 . 0 0 "[ . 1 . 2]" 1
958 1 46 ILE H 1 46 ILE MG . . 4.060 3.763 3.752 3.774 . 0 0 "[ . 1 . 2]" 1
959 1 46 ILE H 1 47 ILE H . . 3.510 2.855 2.715 3.101 . 0 0 "[ . 1 . 2]" 1
960 1 46 ILE H 1 47 ILE MD . . 5.500 5.077 4.839 5.293 . 0 0 "[ . 1 . 2]" 1
961 1 46 ILE H 1 48 HIS H . . 4.940 4.599 4.300 4.869 . 0 0 "[ . 1 . 2]" 1
962 1 46 ILE H 1 49 ARG H . . 5.500 4.779 4.614 4.960 . 0 0 "[ . 1 . 2]" 1
963 1 46 ILE HA 1 46 ILE MD . . 3.920 3.857 3.815 3.882 . 0 0 "[ . 1 . 2]" 1
964 1 46 ILE HA 1 46 ILE HG12 . . 3.780 2.621 2.508 2.728 . 0 0 "[ . 1 . 2]" 1
965 1 46 ILE HA 1 46 ILE HG13 . . 4.070 2.848 2.736 2.947 . 0 0 "[ . 1 . 2]" 1
966 1 46 ILE HA 1 46 ILE MG . . 3.400 2.401 2.333 2.457 . 0 0 "[ . 1 . 2]" 1
967 1 46 ILE HA 1 49 ARG H . . 4.300 3.918 3.662 4.099 . 0 0 "[ . 1 . 2]" 1
968 1 46 ILE HA 1 49 ARG HB2 . . 4.300 3.236 2.686 3.692 . 0 0 "[ . 1 . 2]" 1
969 1 46 ILE HA 1 49 ARG QB . . 3.720 2.891 2.434 3.132 . 0 0 "[ . 1 . 2]" 1
970 1 46 ILE HA 1 49 ARG HB3 . . 4.300 3.333 2.493 3.689 . 0 0 "[ . 1 . 2]" 1
971 1 46 ILE HA 1 49 ARG QG . . 5.190 4.166 3.553 4.801 . 0 0 "[ . 1 . 2]" 1
972 1 46 ILE HA 1 50 PHE QD . . 4.620 4.291 4.042 4.628 0.008 17 0 "[ . 1 . 2]" 1
973 1 46 ILE HB 1 46 ILE MD . . 3.670 2.323 2.196 2.419 . 0 0 "[ . 1 . 2]" 1
974 1 46 ILE HB 1 47 ILE H . . 3.530 2.423 2.213 2.652 . 0 0 "[ . 1 . 2]" 1
975 1 46 ILE HG13 1 47 ILE H . . 4.450 4.233 4.108 4.329 . 0 0 "[ . 1 . 2]" 1
976 1 46 ILE MG 1 47 ILE H . . 3.730 3.274 3.131 3.562 . 0 0 "[ . 1 . 2]" 1
977 1 46 ILE MG 1 47 ILE HA . . 4.210 3.429 3.243 3.651 . 0 0 "[ . 1 . 2]" 1
978 1 46 ILE MG 1 49 ARG H . . 5.190 4.867 4.608 5.137 . 0 0 "[ . 1 . 2]" 1
979 1 46 ILE MG 1 50 PHE H . . 4.910 4.479 4.085 4.771 . 0 0 "[ . 1 . 2]" 1
980 1 46 ILE MG 1 50 PHE QD . . 3.480 3.246 2.896 3.483 0.003 16 0 "[ . 1 . 2]" 1
981 1 46 ILE MG 1 109 PHE HB2 . . 4.820 4.586 4.347 4.818 . 0 0 "[ . 1 . 2]" 1
982 1 46 ILE MG 1 109 PHE HB3 . . 4.190 3.672 3.356 3.982 . 0 0 "[ . 1 . 2]" 1
983 1 46 ILE MG 1 109 PHE QD . . 4.760 4.536 4.022 4.739 . 0 0 "[ . 1 . 2]" 1
984 1 46 ILE MG 1 113 PHE QD . . 4.070 3.395 2.818 4.060 . 0 0 "[ . 1 . 2]" 1
985 1 46 ILE MG 1 113 PHE QE . . 4.250 2.711 2.076 3.855 . 0 0 "[ . 1 . 2]" 1
986 1 46 ILE MG 1 113 PHE HZ . . 4.840 3.535 2.779 4.467 . 0 0 "[ . 1 . 2]" 1
987 1 47 ILE H 1 47 ILE HB . . 3.240 2.566 2.520 2.636 . 0 0 "[ . 1 . 2]" 1
988 1 47 ILE H 1 47 ILE MD . . 3.400 3.289 3.129 3.399 . 0 0 "[ . 1 . 2]" 1
989 1 47 ILE H 1 47 ILE HG12 . . 3.630 3.493 3.342 3.610 . 0 0 "[ . 1 . 2]" 1
990 1 47 ILE H 1 47 ILE QG . . 3.060 2.029 1.892 2.126 . 0 0 "[ . 1 . 2]" 1
991 1 47 ILE H 1 47 ILE HG13 . . 3.630 2.042 1.903 2.141 . 0 0 "[ . 1 . 2]" 1
992 1 47 ILE H 1 47 ILE MG . . 4.220 3.765 3.762 3.773 . 0 0 "[ . 1 . 2]" 1
993 1 47 ILE H 1 48 HIS H . . 3.480 2.871 2.644 3.032 . 0 0 "[ . 1 . 2]" 1
994 1 47 ILE H 1 48 HIS QB . . 5.400 4.436 4.303 4.551 . 0 0 "[ . 1 . 2]" 1
995 1 47 ILE H 1 49 ARG H . . 5.010 4.082 3.635 4.354 . 0 0 "[ . 1 . 2]" 1
996 1 47 ILE HA 1 47 ILE MD . . 4.190 3.889 3.864 3.918 . 0 0 "[ . 1 . 2]" 1
997 1 47 ILE HA 1 47 ILE HG12 . . 3.860 2.710 2.625 2.825 . 0 0 "[ . 1 . 2]" 1
998 1 47 ILE HA 1 47 ILE QG . . 3.340 2.468 2.432 2.514 . 0 0 "[ . 1 . 2]" 1
999 1 47 ILE HA 1 47 ILE HG13 . . 3.860 2.846 2.748 2.909 . 0 0 "[ . 1 . 2]" 1
1000 1 47 ILE HA 1 47 ILE MG . . 3.290 2.354 2.261 2.448 . 0 0 "[ . 1 . 2]" 1
1001 1 47 ILE HA 1 49 ARG H . . 5.450 4.311 3.871 4.580 . 0 0 "[ . 1 . 2]" 1
1002 1 47 ILE HA 1 50 PHE H . . 4.530 3.830 3.589 4.001 . 0 0 "[ . 1 . 2]" 1
1003 1 47 ILE HA 1 50 PHE QB . . 4.720 3.685 3.132 4.454 . 0 0 "[ . 1 . 2]" 1
1004 1 47 ILE HA 1 51 ARG H . . 4.630 3.950 3.447 4.302 . 0 0 "[ . 1 . 2]" 1
1005 1 47 ILE HA 1 113 PHE QE . . 4.810 3.913 3.281 4.616 . 0 0 "[ . 1 . 2]" 1
1006 1 47 ILE HA 1 113 PHE HZ . . 4.680 3.106 2.385 4.083 . 0 0 "[ . 1 . 2]" 1
1007 1 47 ILE HB 1 47 ILE MD . . 3.280 2.310 2.157 2.375 . 0 0 "[ . 1 . 2]" 1
1008 1 47 ILE HB 1 48 HIS H . . 3.450 2.170 2.008 2.387 . 0 0 "[ . 1 . 2]" 1
1009 1 47 ILE HB 1 48 HIS HA . . 4.770 4.131 4.047 4.229 . 0 0 "[ . 1 . 2]" 1
1010 1 47 ILE HB 1 48 HIS QB . . 4.970 3.926 3.834 4.016 . 0 0 "[ . 1 . 2]" 1
1011 1 47 ILE HB 1 55 ILE MD . . 3.460 2.069 1.849 2.427 . 0 0 "[ . 1 . 2]" 1
1012 1 47 ILE HB 1 55 ILE HG12 . . 5.000 4.741 4.412 4.998 . 0 0 "[ . 1 . 2]" 1
1013 1 47 ILE HB 1 55 ILE HG13 . . 4.100 3.736 3.081 4.030 . 0 0 "[ . 1 . 2]" 1
1014 1 47 ILE MD 1 55 ILE MD . . 3.380 1.905 1.805 2.066 . 0 0 "[ . 1 . 2]" 1
1015 1 47 ILE MD 1 72 ALA H . . 4.830 4.786 4.653 4.835 0.005 11 0 "[ . 1 . 2]" 1
1016 1 47 ILE MD 1 72 ALA HA . . 3.510 2.822 2.657 2.981 . 0 0 "[ . 1 . 2]" 1
1017 1 47 ILE MD 1 72 ALA MB . . 3.100 2.412 2.166 2.621 . 0 0 "[ . 1 . 2]" 1
1018 1 47 ILE MD 1 75 VAL MG1 . . 3.600 3.010 2.595 3.596 . 0 0 "[ . 1 . 2]" 1
1019 1 47 ILE MD 1 76 ALA H . . 4.440 4.043 3.699 4.441 0.001 11 0 "[ . 1 . 2]" 1
1020 1 47 ILE MD 1 80 PHE QE . . 4.100 3.259 2.732 4.060 . 0 0 "[ . 1 . 2]" 1
1021 1 47 ILE MD 1 80 PHE HZ . . 5.110 4.621 3.885 4.960 . 0 0 "[ . 1 . 2]" 1
1022 1 47 ILE MD 1 109 PHE QE . . 4.220 3.862 3.369 4.217 . 0 0 "[ . 1 . 2]" 1
1023 1 47 ILE MD 1 109 PHE HZ . . 5.350 4.123 3.730 4.626 . 0 0 "[ . 1 . 2]" 1
1024 1 47 ILE QG 1 48 HIS H . . 4.350 3.903 3.838 4.010 . 0 0 "[ . 1 . 2]" 1
1025 1 47 ILE QG 1 80 PHE QE . . 4.530 2.759 2.237 4.023 . 0 0 "[ . 1 . 2]" 1
1026 1 47 ILE MG 1 48 HIS H . . 3.790 3.092 2.827 3.313 . 0 0 "[ . 1 . 2]" 1
1027 1 47 ILE MG 1 48 HIS HA . . 4.510 3.342 3.189 3.529 . 0 0 "[ . 1 . 2]" 1
1028 1 47 ILE MG 1 50 PHE H . . 5.250 4.736 4.428 5.007 . 0 0 "[ . 1 . 2]" 1
1029 1 47 ILE MG 1 51 ARG H . . 4.330 3.575 3.119 3.919 . 0 0 "[ . 1 . 2]" 1
1030 1 47 ILE MG 1 51 ARG QB . . 4.400 3.085 2.791 3.478 . 0 0 "[ . 1 . 2]" 1
1031 1 47 ILE MG 1 54 LEU H . . 4.720 4.450 4.065 4.649 . 0 0 "[ . 1 . 2]" 1
1032 1 47 ILE MG 1 54 LEU HB2 . . 4.440 2.658 2.233 2.833 . 0 0 "[ . 1 . 2]" 1
1033 1 47 ILE MG 1 54 LEU QB . . 3.710 2.577 2.187 2.743 . 0 0 "[ . 1 . 2]" 1
1034 1 47 ILE MG 1 54 LEU HB3 . . 4.440 3.471 3.134 3.682 . 0 0 "[ . 1 . 2]" 1
1035 1 47 ILE MG 1 54 LEU MD1 . . 3.240 2.401 2.061 2.646 . 0 0 "[ . 1 . 2]" 1
1036 1 47 ILE MG 1 55 ILE H . . 4.190 3.644 3.093 3.937 . 0 0 "[ . 1 . 2]" 1
1037 1 47 ILE MG 1 55 ILE HB . . 4.010 3.347 2.882 3.661 . 0 0 "[ . 1 . 2]" 1
1038 1 47 ILE MG 1 55 ILE MD . . 3.240 2.174 1.987 2.610 . 0 0 "[ . 1 . 2]" 1
1039 1 47 ILE MG 1 55 ILE HG13 . . 3.650 2.633 2.050 2.983 . 0 0 "[ . 1 . 2]" 1
1040 1 47 ILE MG 1 75 VAL MG1 . . 3.590 2.499 2.008 3.072 . 0 0 "[ . 1 . 2]" 1
1041 1 47 ILE MG 1 80 PHE QE . . 3.860 3.366 3.014 3.838 . 0 0 "[ . 1 . 2]" 1
1042 1 47 ILE MG 1 80 PHE HZ . . 3.710 3.209 2.306 3.679 . 0 0 "[ . 1 . 2]" 1
1043 1 48 HIS H 1 48 HIS QB . . 2.890 2.224 2.175 2.278 . 0 0 "[ . 1 . 2]" 1
1044 1 48 HIS H 1 50 PHE H . . 5.030 4.856 4.681 4.940 . 0 0 "[ . 1 . 2]" 1
1045 1 48 HIS H 1 55 ILE HB . . 4.130 3.177 2.911 3.465 . 0 0 "[ . 1 . 2]" 1
1046 1 48 HIS H 1 55 ILE HG13 . . 4.730 4.641 4.343 4.736 0.006 19 0 "[ . 1 . 2]" 1
1047 1 48 HIS H 1 55 ILE MG . . 4.080 3.849 3.484 4.072 . 0 0 "[ . 1 . 2]" 1
1048 1 48 HIS HA 1 48 HIS HD2 . . 4.430 3.522 2.822 4.067 . 0 0 "[ . 1 . 2]" 1
1049 1 48 HIS HA 1 50 PHE H . . 5.090 4.751 4.425 5.085 . 0 0 "[ . 1 . 2]" 1
1050 1 48 HIS HA 1 51 ARG H . . 4.150 3.654 3.319 4.138 . 0 0 "[ . 1 . 2]" 1
1051 1 48 HIS HA 1 52 PRO HA . . 3.420 2.235 2.000 2.449 . 0 0 "[ . 1 . 2]" 1
1052 1 48 HIS HA 1 55 ILE H . . 4.570 3.305 3.164 3.499 . 0 0 "[ . 1 . 2]" 1
1053 1 48 HIS HA 1 55 ILE HB . . 4.240 3.110 2.776 3.336 . 0 0 "[ . 1 . 2]" 1
1054 1 48 HIS HA 1 55 ILE HG13 . . 4.750 4.656 4.401 4.751 0.001 14 0 "[ . 1 . 2]" 1
1055 1 48 HIS QB 1 49 ARG H . . 3.320 2.709 2.515 3.205 . 0 0 "[ . 1 . 2]" 1
1056 1 48 HIS QB 1 50 PHE H . . 5.500 5.246 5.039 5.463 . 0 0 "[ . 1 . 2]" 1
1057 1 48 HIS QB 1 52 PRO HA . . 4.390 3.195 2.958 3.644 . 0 0 "[ . 1 . 2]" 1
1058 1 48 HIS QB 1 55 ILE H . . 4.880 3.865 3.403 4.347 . 0 0 "[ . 1 . 2]" 1
1059 1 48 HIS QB 1 55 ILE HB . . 4.100 2.363 2.161 2.638 . 0 0 "[ . 1 . 2]" 1
1060 1 48 HIS QB 1 57 PHE H . . 4.430 3.288 2.852 3.788 . 0 0 "[ . 1 . 2]" 1
1061 1 48 HIS QB 1 57 PHE HB2 . . 4.400 3.396 2.819 3.735 . 0 0 "[ . 1 . 2]" 1
1062 1 48 HIS QB 1 57 PHE HB3 . . 5.180 4.760 4.100 5.163 . 0 0 "[ . 1 . 2]" 1
1063 1 48 HIS HD2 1 52 PRO HA . . 3.950 2.360 2.001 3.048 . 0 0 "[ . 1 . 2]" 1
1064 1 48 HIS HD2 1 52 PRO QB . . 4.920 2.721 2.080 3.454 . 0 0 "[ . 1 . 2]" 1
1065 1 48 HIS HD2 1 55 ILE H . . 4.540 4.454 4.184 4.544 0.004 12 0 "[ . 1 . 2]" 1
1066 1 48 HIS HD2 1 55 ILE HB . . 4.950 4.374 4.011 4.727 . 0 0 "[ . 1 . 2]" 1
1067 1 48 HIS HD2 1 56 ASN HA . . 4.570 2.753 2.223 3.110 . 0 0 "[ . 1 . 2]" 1
1068 1 48 HIS HD2 1 57 PHE H . . 3.680 2.921 2.210 3.550 . 0 0 "[ . 1 . 2]" 1
1069 1 49 ARG H 1 49 ARG HB2 . . 3.230 2.383 2.169 2.844 . 0 0 "[ . 1 . 2]" 1
1070 1 49 ARG H 1 49 ARG HB3 . . 3.230 2.726 2.291 3.028 . 0 0 "[ . 1 . 2]" 1
1071 1 49 ARG H 1 49 ARG QD . . 4.480 4.183 3.833 4.486 0.006 8 0 "[ . 1 . 2]" 1
1072 1 49 ARG H 1 49 ARG HG2 . . 4.750 4.493 4.021 4.650 . 0 0 "[ . 1 . 2]" 1
1073 1 49 ARG H 1 49 ARG HG3 . . 4.750 4.465 4.241 4.618 . 0 0 "[ . 1 . 2]" 1
1074 1 49 ARG H 1 50 PHE H . . 3.530 3.070 2.658 3.193 . 0 0 "[ . 1 . 2]" 1
1075 1 49 ARG H 1 50 PHE QD . . 4.580 4.416 4.162 4.580 . 0 0 "[ . 1 . 2]" 1
1076 1 49 ARG H 1 51 ARG H . . 4.490 4.302 3.706 4.476 . 0 0 "[ . 1 . 2]" 1
1077 1 49 ARG HA 1 49 ARG QD . . 3.600 2.544 1.985 3.620 0.020 16 0 "[ . 1 . 2]" 1
1078 1 49 ARG HA 1 49 ARG QG . . 3.710 2.674 2.231 3.040 . 0 0 "[ . 1 . 2]" 1
1079 1 49 ARG HA 1 51 ARG H . . 5.100 4.985 4.789 5.085 . 0 0 "[ . 1 . 2]" 1
1080 1 49 ARG QB 1 49 ARG QD . . 3.320 2.226 2.050 2.495 . 0 0 "[ . 1 . 2]" 1
1081 1 49 ARG QB 1 50 PHE H . . 3.310 2.140 2.032 2.365 . 0 0 "[ . 1 . 2]" 1
1082 1 49 ARG QB 1 51 ARG H . . 5.080 4.499 4.406 4.656 . 0 0 "[ . 1 . 2]" 1
1083 1 49 ARG HB2 1 50 PHE H . . 3.870 3.555 3.300 3.816 . 0 0 "[ . 1 . 2]" 1
1084 1 49 ARG HB3 1 50 PHE H . . 3.870 2.158 2.051 2.388 . 0 0 "[ . 1 . 2]" 1
1085 1 49 ARG QG 1 50 PHE H . . 4.460 3.449 2.882 4.152 . 0 0 "[ . 1 . 2]" 1
1086 1 50 PHE H 1 50 PHE HB2 . . 3.640 2.429 2.251 3.564 . 0 0 "[ . 1 . 2]" 1
1087 1 50 PHE H 1 50 PHE QB . . 3.100 2.334 2.227 2.487 . 0 0 "[ . 1 . 2]" 1
1088 1 50 PHE H 1 50 PHE HB3 . . 3.640 3.510 2.297 3.600 . 0 0 "[ . 1 . 2]" 1
1089 1 50 PHE H 1 50 PHE QD . . 3.360 2.149 1.999 2.568 . 0 0 "[ . 1 . 2]" 1
1090 1 50 PHE H 1 51 ARG H . . 3.040 2.644 2.429 2.810 . 0 0 "[ . 1 . 2]" 1
1091 1 50 PHE H 1 52 PRO HD3 . . 5.500 4.843 4.771 4.934 . 0 0 "[ . 1 . 2]" 1
1092 1 50 PHE HA 1 50 PHE QD . . 3.440 3.068 2.903 3.594 0.154 17 0 "[ . 1 . 2]" 1
1093 1 50 PHE QB 1 51 ARG H . . 3.320 2.466 2.336 3.351 0.031 17 0 "[ . 1 . 2]" 1
1094 1 50 PHE QB 1 51 ARG QG . . 4.530 3.302 2.605 4.190 . 0 0 "[ . 1 . 2]" 1
1095 1 50 PHE HB2 1 51 ARG H . . 4.060 2.560 2.385 4.038 . 0 0 "[ . 1 . 2]" 1
1096 1 50 PHE HB3 1 51 ARG H . . 4.060 3.374 3.070 3.579 . 0 0 "[ . 1 . 2]" 1
1097 1 50 PHE QD 1 51 ARG H . . 4.320 4.017 2.885 4.286 . 0 0 "[ . 1 . 2]" 1
1098 1 51 ARG H 1 51 ARG QB . . 3.390 2.520 2.434 2.644 . 0 0 "[ . 1 . 2]" 1
1099 1 51 ARG H 1 51 ARG QG . . 4.100 3.429 2.836 4.022 . 0 0 "[ . 1 . 2]" 1
1100 1 51 ARG H 1 52 PRO HD2 . . 5.380 4.324 4.270 4.360 . 0 0 "[ . 1 . 2]" 1
1101 1 51 ARG H 1 52 PRO HD3 . . 3.990 3.703 3.614 3.762 . 0 0 "[ . 1 . 2]" 1
1102 1 51 ARG H 1 54 LEU MD1 . . 4.720 4.234 3.920 4.687 . 0 0 "[ . 1 . 2]" 1
1103 1 51 ARG H 1 54 LEU HG . . 5.500 5.372 5.186 5.502 0.002 17 0 "[ . 1 . 2]" 1
1104 1 51 ARG HA 1 51 ARG HD2 . . 4.000 3.191 2.021 3.941 . 0 0 "[ . 1 . 2]" 1
1105 1 51 ARG HA 1 51 ARG HD3 . . 4.000 2.829 2.002 3.964 . 0 0 "[ . 1 . 2]" 1
1106 1 51 ARG HA 1 52 PRO HD2 . . 3.530 1.942 1.930 1.944 . 0 0 "[ . 1 . 2]" 1
1107 1 51 ARG HA 1 52 PRO HD3 . . 3.700 2.653 2.616 2.659 . 0 0 "[ . 1 . 2]" 1
1108 1 51 ARG HA 1 52 PRO QG . . 4.680 3.809 3.797 3.811 . 0 0 "[ . 1 . 2]" 1
1109 1 51 ARG HA 1 53 GLU H . . 4.350 3.274 3.201 3.384 . 0 0 "[ . 1 . 2]" 1
1110 1 51 ARG QB 1 51 ARG QD . . 3.330 2.257 2.071 2.556 . 0 0 "[ . 1 . 2]" 1
1111 1 51 ARG QB 1 53 GLU H . . 3.980 3.301 2.981 3.613 . 0 0 "[ . 1 . 2]" 1
1112 1 51 ARG QB 1 54 LEU H . . 3.890 2.830 2.581 3.149 . 0 0 "[ . 1 . 2]" 1
1113 1 51 ARG QB 1 54 LEU QB . . 4.410 3.171 2.903 3.490 . 0 0 "[ . 1 . 2]" 1
1114 1 51 ARG QB 1 54 LEU MD1 . . 3.160 2.026 1.739 2.314 . 0 0 "[ . 1 . 2]" 1
1115 1 51 ARG QB 1 54 LEU HG . . 3.120 2.085 1.967 2.314 . 0 0 "[ . 1 . 2]" 1
1116 1 51 ARG HB2 1 54 LEU MD1 . . 3.790 2.191 1.835 2.592 . 0 0 "[ . 1 . 2]" 1
1117 1 51 ARG HB2 1 54 LEU HG . . 3.890 3.193 2.737 3.621 . 0 0 "[ . 1 . 2]" 1
1118 1 51 ARG HB3 1 54 LEU MD1 . . 3.790 2.450 2.087 2.770 . 0 0 "[ . 1 . 2]" 1
1119 1 51 ARG HB3 1 54 LEU HG . . 3.890 2.117 2.001 2.350 . 0 0 "[ . 1 . 2]" 1
1120 1 51 ARG QD 1 54 LEU MD1 . . 4.350 3.528 3.035 4.274 . 0 0 "[ . 1 . 2]" 1
1121 1 51 ARG HD2 1 54 LEU MD1 . . 5.090 4.027 3.132 4.839 . 0 0 "[ . 1 . 2]" 1
1122 1 51 ARG HD3 1 54 LEU MD1 . . 5.090 4.189 3.312 4.870 . 0 0 "[ . 1 . 2]" 1
1123 1 51 ARG QG 1 54 LEU MD1 . . 4.220 2.584 1.984 3.291 . 0 0 "[ . 1 . 2]" 1
1124 1 52 PRO HA 1 55 ILE H . . 3.810 3.460 3.185 3.655 . 0 0 "[ . 1 . 2]" 1
1125 1 52 PRO HA 1 55 ILE HB . . 4.480 4.314 4.122 4.444 . 0 0 "[ . 1 . 2]" 1
1126 1 52 PRO QB 1 53 GLU H . . 4.010 3.487 3.331 3.689 . 0 0 "[ . 1 . 2]" 1
1127 1 52 PRO HD2 1 53 GLU H . . 4.100 2.766 2.667 2.976 . 0 0 "[ . 1 . 2]" 1
1128 1 52 PRO HD3 1 53 GLU H . . 4.480 3.906 3.852 4.016 . 0 0 "[ . 1 . 2]" 1
1129 1 52 PRO QG 1 53 GLU H . . 4.180 2.811 2.540 3.203 . 0 0 "[ . 1 . 2]" 1
1130 1 52 PRO QG 1 53 GLU HA . . 5.140 4.168 4.053 4.323 . 0 0 "[ . 1 . 2]" 1
1131 1 53 GLU H 1 53 GLU QB . . 3.140 2.394 2.182 2.639 . 0 0 "[ . 1 . 2]" 1
1132 1 53 GLU H 1 53 GLU HG2 . . 4.560 3.498 1.913 4.578 0.018 11 0 "[ . 1 . 2]" 1
1133 1 53 GLU H 1 53 GLU HG3 . . 4.560 3.883 2.639 4.468 . 0 0 "[ . 1 . 2]" 1
1134 1 53 GLU H 1 54 LEU H . . 3.340 2.534 2.297 2.728 . 0 0 "[ . 1 . 2]" 1
1135 1 53 GLU H 1 54 LEU MD2 . . 5.090 4.952 4.809 5.085 . 0 0 "[ . 1 . 2]" 1
1136 1 53 GLU H 1 54 LEU HG . . 4.920 3.983 3.789 4.178 . 0 0 "[ . 1 . 2]" 1
1137 1 53 GLU H 1 55 ILE H . . 4.580 4.238 3.998 4.567 . 0 0 "[ . 1 . 2]" 1
1138 1 53 GLU HA 1 53 GLU QG . . 3.690 3.048 2.479 3.431 . 0 0 "[ . 1 . 2]" 1
1139 1 53 GLU QB 1 54 LEU H . . 4.050 3.075 2.631 3.717 . 0 0 "[ . 1 . 2]" 1
1140 1 53 GLU QG 1 54 LEU H . . 3.820 2.912 1.978 3.703 . 0 0 "[ . 1 . 2]" 1
1141 1 53 GLU QG 1 54 LEU HA . . 4.580 3.452 3.290 3.641 . 0 0 "[ . 1 . 2]" 1
1142 1 53 GLU QG 1 54 LEU MD2 . . 3.700 2.905 2.432 3.634 . 0 0 "[ . 1 . 2]" 1
1143 1 53 GLU QG 1 54 LEU HG . . 4.370 3.235 2.156 4.220 . 0 0 "[ . 1 . 2]" 1
1144 1 53 GLU HG2 1 54 LEU MD2 . . 4.390 3.547 2.501 4.255 . 0 0 "[ . 1 . 2]" 1
1145 1 53 GLU HG3 1 54 LEU MD2 . . 4.390 3.360 2.609 4.363 . 0 0 "[ . 1 . 2]" 1
1146 1 54 LEU H 1 54 LEU HB2 . . 4.000 2.571 2.443 2.626 . 0 0 "[ . 1 . 2]" 1
1147 1 54 LEU H 1 54 LEU QB . . 3.410 2.518 2.405 2.565 . 0 0 "[ . 1 . 2]" 1
1148 1 54 LEU H 1 54 LEU HB3 . . 4.000 3.598 3.583 3.643 . 0 0 "[ . 1 . 2]" 1
1149 1 54 LEU H 1 54 LEU MD1 . . 3.660 3.542 3.436 3.658 . 0 0 "[ . 1 . 2]" 1
1150 1 54 LEU H 1 54 LEU MD2 . . 3.610 3.275 3.086 3.531 . 0 0 "[ . 1 . 2]" 1
1151 1 54 LEU H 1 54 LEU HG . . 3.350 2.144 2.037 2.361 . 0 0 "[ . 1 . 2]" 1
1152 1 54 LEU H 1 55 ILE H . . 3.100 2.612 2.322 2.797 . 0 0 "[ . 1 . 2]" 1
1153 1 54 LEU HA 1 54 LEU MD1 . . 4.240 3.918 3.870 3.952 . 0 0 "[ . 1 . 2]" 1
1154 1 54 LEU HA 1 54 LEU MD2 . . 3.030 2.242 2.002 2.400 . 0 0 "[ . 1 . 2]" 1
1155 1 54 LEU HA 1 54 LEU HG . . 3.710 3.166 3.040 3.277 . 0 0 "[ . 1 . 2]" 1
1156 1 54 LEU QB 1 54 LEU MD1 . . 3.180 2.055 2.005 2.099 . 0 0 "[ . 1 . 2]" 1
1157 1 54 LEU QB 1 55 ILE H . . 3.520 2.412 2.133 2.627 . 0 0 "[ . 1 . 2]" 1
1158 1 54 LEU QB 1 55 ILE HG12 . . 5.130 3.893 3.515 4.108 . 0 0 "[ . 1 . 2]" 1
1159 1 54 LEU QB 1 55 ILE HG13 . . 3.930 2.620 2.532 2.720 . 0 0 "[ . 1 . 2]" 1
1160 1 54 LEU QB 1 75 VAL MG1 . . 3.350 2.032 1.898 2.522 . 0 0 "[ . 1 . 2]" 1
1161 1 54 LEU QB 1 75 VAL MG2 . . 4.600 2.878 2.385 3.543 . 0 0 "[ . 1 . 2]" 1
1162 1 54 LEU HB2 1 54 LEU MD2 . . 3.530 3.180 3.165 3.193 . 0 0 "[ . 1 . 2]" 1
1163 1 54 LEU HB2 1 55 ILE H . . 4.110 2.449 2.158 2.675 . 0 0 "[ . 1 . 2]" 1
1164 1 54 LEU HB2 1 55 ILE HG13 . . 4.620 2.816 2.679 2.961 . 0 0 "[ . 1 . 2]" 1
1165 1 54 LEU HB2 1 75 VAL MG1 . . 3.830 3.066 2.666 3.526 . 0 0 "[ . 1 . 2]" 1
1166 1 54 LEU HB3 1 54 LEU MD2 . . 3.530 2.253 2.152 2.420 . 0 0 "[ . 1 . 2]" 1
1167 1 54 LEU HB3 1 55 ILE H . . 4.110 3.633 3.332 3.827 . 0 0 "[ . 1 . 2]" 1
1168 1 54 LEU HB3 1 55 ILE HG13 . . 4.620 3.131 2.999 3.287 . 0 0 "[ . 1 . 2]" 1
1169 1 54 LEU HB3 1 75 VAL MG1 . . 3.830 2.064 1.921 2.583 . 0 0 "[ . 1 . 2]" 1
1170 1 54 LEU MD1 1 79 GLU QB . . 4.310 3.229 2.905 3.798 . 0 0 "[ . 1 . 2]" 1
1171 1 54 LEU MD1 1 79 GLU QG . . 3.820 2.302 1.864 3.787 . 0 0 "[ . 1 . 2]" 1
1172 1 54 LEU MD1 1 80 PHE QE . . 4.350 4.028 2.926 4.285 . 0 0 "[ . 1 . 2]" 1
1173 1 54 LEU MD1 1 80 PHE HZ . . 3.940 3.847 3.044 3.942 0.002 12 0 "[ . 1 . 2]" 1
1174 1 54 LEU HG 1 55 ILE H . . 4.590 4.109 4.002 4.362 . 0 0 "[ . 1 . 2]" 1
1175 1 55 ILE H 1 55 ILE HB . . 3.350 2.695 2.560 2.772 . 0 0 "[ . 1 . 2]" 1
1176 1 55 ILE H 1 55 ILE MD . . 4.360 4.117 3.897 4.357 . 0 0 "[ . 1 . 2]" 1
1177 1 55 ILE H 1 55 ILE HG12 . . 4.210 3.982 3.679 4.098 . 0 0 "[ . 1 . 2]" 1
1178 1 55 ILE H 1 55 ILE HG13 . . 3.780 2.907 2.656 3.058 . 0 0 "[ . 1 . 2]" 1
1179 1 55 ILE H 1 55 ILE MG . . 3.970 3.866 3.810 3.901 . 0 0 "[ . 1 . 2]" 1
1180 1 55 ILE H 1 56 ASN H . . 4.500 4.388 4.311 4.486 . 0 0 "[ . 1 . 2]" 1
1181 1 55 ILE HA 1 55 ILE MD . . 3.940 3.819 3.662 3.864 . 0 0 "[ . 1 . 2]" 1
1182 1 55 ILE HA 1 55 ILE HG12 . . 3.830 2.529 2.420 2.607 . 0 0 "[ . 1 . 2]" 1
1183 1 55 ILE HA 1 55 ILE HG13 . . 4.190 3.037 2.916 3.335 . 0 0 "[ . 1 . 2]" 1
1184 1 55 ILE HA 1 55 ILE MG . . 3.520 2.412 2.300 2.467 . 0 0 "[ . 1 . 2]" 1
1185 1 55 ILE HA 1 56 ASN H . . 3.130 2.191 2.146 2.267 . 0 0 "[ . 1 . 2]" 1
1186 1 55 ILE HA 1 71 LEU MD2 . . 3.780 2.967 2.516 3.629 . 0 0 "[ . 1 . 2]" 1
1187 1 55 ILE HB 1 55 ILE MD . . 3.620 2.414 2.281 2.566 . 0 0 "[ . 1 . 2]" 1
1188 1 55 ILE HB 1 56 ASN H . . 5.060 4.044 3.805 4.213 . 0 0 "[ . 1 . 2]" 1
1189 1 55 ILE MD 1 55 ILE MG . . 3.070 2.030 1.872 2.231 . 0 0 "[ . 1 . 2]" 1
1190 1 55 ILE MD 1 71 LEU HG . . 3.560 3.049 2.652 3.378 . 0 0 "[ . 1 . 2]" 1
1191 1 55 ILE MD 1 72 ALA H . . 4.150 3.644 3.309 4.065 . 0 0 "[ . 1 . 2]" 1
1192 1 55 ILE MD 1 72 ALA HA . . 3.510 2.157 1.949 2.608 . 0 0 "[ . 1 . 2]" 1
1193 1 55 ILE MD 1 72 ALA MB . . 3.750 2.674 2.395 3.075 . 0 0 "[ . 1 . 2]" 1
1194 1 55 ILE MD 1 75 VAL HB . . 3.950 3.220 2.763 3.471 . 0 0 "[ . 1 . 2]" 1
1195 1 55 ILE MD 1 76 ALA H . . 5.480 5.029 4.573 5.288 . 0 0 "[ . 1 . 2]" 1
1196 1 55 ILE HG12 1 55 ILE MG . . 3.640 2.320 2.204 2.579 . 0 0 "[ . 1 . 2]" 1
1197 1 55 ILE HG12 1 56 ASN H . . 5.100 4.289 4.164 4.418 . 0 0 "[ . 1 . 2]" 1
1198 1 55 ILE HG12 1 71 LEU MD2 . . 3.490 2.580 1.996 3.337 . 0 0 "[ . 1 . 2]" 1
1199 1 55 ILE HG13 1 55 ILE MG . . 3.710 3.191 3.169 3.202 . 0 0 "[ . 1 . 2]" 1
1200 1 55 ILE HG13 1 56 ASN H . . 5.130 5.009 4.894 5.131 0.001 4 0 "[ . 1 . 2]" 1
1201 1 55 ILE HG13 1 75 VAL MG1 . . 3.830 2.976 2.230 3.499 . 0 0 "[ . 1 . 2]" 1
1202 1 55 ILE HG13 1 75 VAL MG2 . . 3.910 2.892 2.412 3.342 . 0 0 "[ . 1 . 2]" 1
1203 1 55 ILE MG 1 56 ASN H . . 3.900 2.209 1.930 2.445 . 0 0 "[ . 1 . 2]" 1
1204 1 55 ILE MG 1 57 PHE H . . 4.020 3.167 2.777 3.473 . 0 0 "[ . 1 . 2]" 1
1205 1 55 ILE MG 1 57 PHE HA . . 3.800 3.417 3.235 3.603 . 0 0 "[ . 1 . 2]" 1
1206 1 55 ILE MG 1 57 PHE QD . . 4.520 4.052 3.602 4.516 . 0 0 "[ . 1 . 2]" 1
1207 1 55 ILE MG 1 59 SER H . . 5.500 5.335 5.125 5.494 . 0 0 "[ . 1 . 2]" 1
1208 1 55 ILE MG 1 60 LEU MD1 . . 3.270 1.868 1.639 2.061 . 0 0 "[ . 1 . 2]" 1
1209 1 55 ILE MG 1 60 LEU MD2 . . 3.780 2.682 1.931 3.333 . 0 0 "[ . 1 . 2]" 1
1210 1 55 ILE MG 1 60 LEU HG . . 4.150 3.014 2.591 3.313 . 0 0 "[ . 1 . 2]" 1
1211 1 55 ILE MG 1 71 LEU MD2 . . 3.330 1.986 1.799 2.239 . 0 0 "[ . 1 . 2]" 1
1212 1 56 ASN H 1 56 ASN HB2 . . 3.720 3.105 2.398 3.641 . 0 0 "[ . 1 . 2]" 1
1213 1 56 ASN H 1 56 ASN HB3 . . 3.720 2.972 2.469 3.750 0.030 4 0 "[ . 1 . 2]" 1
1214 1 56 ASN H 1 57 PHE H . . 4.940 3.871 3.703 4.020 . 0 0 "[ . 1 . 2]" 1
1215 1 56 ASN H 1 71 LEU MD2 . . 4.530 3.300 2.533 4.069 . 0 0 "[ . 1 . 2]" 1
1216 1 56 ASN HA 1 56 ASN QD . . 4.410 3.835 3.264 4.182 . 0 0 "[ . 1 . 2]" 1
1217 1 56 ASN HA 1 56 ASN HD22 . . 5.010 4.677 4.152 4.975 . 0 0 "[ . 1 . 2]" 1
1218 1 56 ASN HA 1 57 PHE H . . 3.010 2.261 2.184 2.341 . 0 0 "[ . 1 . 2]" 1
1219 1 56 ASN HA 1 58 ASP H . . 4.550 3.786 3.397 4.132 . 0 0 "[ . 1 . 2]" 1
1220 1 56 ASN HA 1 59 SER H . . 5.250 4.336 3.992 4.659 . 0 0 "[ . 1 . 2]" 1
1221 1 56 ASN QB 1 56 ASN QD . . 3.070 2.234 2.069 2.631 . 0 0 "[ . 1 . 2]" 1
1222 1 56 ASN QB 1 59 SER H . . 4.370 3.012 2.236 3.652 . 0 0 "[ . 1 . 2]" 1
1223 1 56 ASN HB2 1 57 PHE H . . 4.780 4.406 3.890 4.631 . 0 0 "[ . 1 . 2]" 1
1224 1 56 ASN HB3 1 57 PHE H . . 4.780 4.399 4.003 4.560 . 0 0 "[ . 1 . 2]" 1
1225 1 56 ASN QD 1 59 SER QB . . 3.660 2.261 1.830 3.432 . 0 0 "[ . 1 . 2]" 1
1226 1 56 ASN HD21 1 59 SER HB2 . . 4.850 2.735 1.906 4.551 . 0 0 "[ . 1 . 2]" 1
1227 1 56 ASN HD21 1 59 SER HB3 . . 4.850 3.190 1.928 4.845 . 0 0 "[ . 1 . 2]" 1
1228 1 56 ASN HD22 1 59 SER HB2 . . 4.850 3.596 2.454 4.843 . 0 0 "[ . 1 . 2]" 1
1229 1 56 ASN HD22 1 59 SER HB3 . . 4.850 4.080 2.707 4.857 0.007 4 0 "[ . 1 . 2]" 1
1230 1 57 PHE H 1 57 PHE HB2 . . 3.370 2.261 2.181 2.351 . 0 0 "[ . 1 . 2]" 1
1231 1 57 PHE H 1 57 PHE HB3 . . 3.420 2.872 2.775 3.024 . 0 0 "[ . 1 . 2]" 1
1232 1 57 PHE H 1 57 PHE QD . . 4.150 4.020 3.842 4.154 0.004 12 0 "[ . 1 . 2]" 1
1233 1 57 PHE H 1 58 ASP H . . 3.620 2.948 2.679 3.172 . 0 0 "[ . 1 . 2]" 1
1234 1 57 PHE H 1 60 LEU HG . . 5.270 4.082 3.766 4.380 . 0 0 "[ . 1 . 2]" 1
1235 1 57 PHE HA 1 57 PHE QD . . 3.830 2.985 2.751 3.132 . 0 0 "[ . 1 . 2]" 1
1236 1 57 PHE HA 1 59 SER H . . 4.470 4.015 3.593 4.389 . 0 0 "[ . 1 . 2]" 1
1237 1 57 PHE HA 1 60 LEU H . . 3.990 3.058 2.895 3.306 . 0 0 "[ . 1 . 2]" 1
1238 1 57 PHE HA 1 60 LEU HB2 . . 4.710 2.407 2.136 2.751 . 0 0 "[ . 1 . 2]" 1
1239 1 57 PHE HA 1 60 LEU HB3 . . 4.340 3.865 3.561 4.091 . 0 0 "[ . 1 . 2]" 1
1240 1 57 PHE HA 1 60 LEU MD1 . . 3.370 2.009 1.888 2.285 . 0 0 "[ . 1 . 2]" 1
1241 1 57 PHE HA 1 60 LEU MD2 . . 4.330 3.942 3.724 4.214 . 0 0 "[ . 1 . 2]" 1
1242 1 57 PHE HA 1 60 LEU HG . . 3.540 2.458 2.078 2.815 . 0 0 "[ . 1 . 2]" 1
1243 1 57 PHE HB2 1 58 ASP H . . 3.990 3.612 3.441 3.802 . 0 0 "[ . 1 . 2]" 1
1244 1 57 PHE HB3 1 58 ASP H . . 3.620 2.443 2.064 2.820 . 0 0 "[ . 1 . 2]" 1
1245 1 57 PHE HB3 1 58 ASP HA . . 4.430 3.942 3.852 4.033 . 0 0 "[ . 1 . 2]" 1
1246 1 57 PHE QD 1 58 ASP H . . 4.180 3.686 2.949 4.170 . 0 0 "[ . 1 . 2]" 1
1247 1 57 PHE QD 1 58 ASP HA . . 4.520 3.371 2.611 3.854 . 0 0 "[ . 1 . 2]" 1
1248 1 57 PHE QD 1 60 LEU MD1 . . 4.110 2.911 2.304 3.417 . 0 0 "[ . 1 . 2]" 1
1249 1 57 PHE QE 1 60 LEU MD1 . . 4.540 3.913 3.417 4.388 . 0 0 "[ . 1 . 2]" 1
1250 1 58 ASP H 1 58 ASP HB2 . . 3.730 2.540 2.255 3.616 . 0 0 "[ . 1 . 2]" 1
1251 1 58 ASP H 1 58 ASP QB . . 3.060 2.387 2.182 2.783 . 0 0 "[ . 1 . 2]" 1
1252 1 58 ASP H 1 58 ASP HB3 . . 3.730 3.153 2.522 3.612 . 0 0 "[ . 1 . 2]" 1
1253 1 58 ASP H 1 59 SER H . . 3.320 2.895 2.673 3.031 . 0 0 "[ . 1 . 2]" 1
1254 1 58 ASP H 1 60 LEU H . . 4.640 4.260 3.914 4.506 . 0 0 "[ . 1 . 2]" 1
1255 1 58 ASP QB 1 59 SER H . . 3.630 2.700 2.461 3.410 . 0 0 "[ . 1 . 2]" 1
1256 1 58 ASP HB2 1 59 SER H . . 4.270 3.284 2.498 4.030 . 0 0 "[ . 1 . 2]" 1
1257 1 58 ASP HB3 1 59 SER H . . 4.270 3.253 2.567 4.107 . 0 0 "[ . 1 . 2]" 1
1258 1 59 SER H 1 59 SER HB2 . . 3.710 2.579 2.216 3.612 . 0 0 "[ . 1 . 2]" 1
1259 1 59 SER H 1 59 SER QB . . 3.150 2.274 2.194 2.393 . 0 0 "[ . 1 . 2]" 1
1260 1 59 SER H 1 59 SER HB3 . . 3.710 2.880 2.272 3.619 . 0 0 "[ . 1 . 2]" 1
1261 1 59 SER H 1 60 LEU H . . 3.080 2.419 2.093 2.496 . 0 0 "[ . 1 . 2]" 1
1262 1 59 SER H 1 60 LEU HB2 . . 4.700 4.633 4.234 4.705 0.005 4 0 "[ . 1 . 2]" 1
1263 1 59 SER H 1 60 LEU MD1 . . 5.210 4.916 4.624 5.140 . 0 0 "[ . 1 . 2]" 1
1264 1 59 SER H 1 60 LEU MD2 . . 5.180 4.878 4.592 5.175 . 0 0 "[ . 1 . 2]" 1
1265 1 59 SER H 1 60 LEU HG . . 4.010 3.879 3.673 4.015 0.005 4 0 "[ . 1 . 2]" 1
1266 1 59 SER QB 1 60 LEU H . . 4.010 2.679 2.418 3.280 . 0 0 "[ . 1 . 2]" 1
1267 1 59 SER HB2 1 60 LEU H . . 4.570 3.505 2.662 4.149 . 0 0 "[ . 1 . 2]" 1
1268 1 59 SER HB3 1 60 LEU H . . 4.570 3.004 2.455 3.968 . 0 0 "[ . 1 . 2]" 1
1269 1 60 LEU H 1 60 LEU HB2 . . 3.250 2.593 2.474 2.734 . 0 0 "[ . 1 . 2]" 1
1270 1 60 LEU H 1 60 LEU HB3 . . 3.750 3.584 3.571 3.593 . 0 0 "[ . 1 . 2]" 1
1271 1 60 LEU H 1 60 LEU MD1 . . 3.740 3.553 3.400 3.725 . 0 0 "[ . 1 . 2]" 1
1272 1 60 LEU H 1 60 LEU MD2 . . 3.570 3.166 2.891 3.421 . 0 0 "[ . 1 . 2]" 1
1273 1 60 LEU H 1 60 LEU HG . . 2.960 2.080 1.905 2.330 . 0 0 "[ . 1 . 2]" 1
1274 1 60 LEU H 1 61 ASN H . . 4.480 4.420 4.303 4.487 0.007 16 0 "[ . 1 . 2]" 1
1275 1 60 LEU HA 1 60 LEU MD1 . . 4.430 3.892 3.847 3.936 . 0 0 "[ . 1 . 2]" 1
1276 1 60 LEU HA 1 60 LEU MD2 . . 3.130 2.056 1.975 2.213 . 0 0 "[ . 1 . 2]" 1
1277 1 60 LEU HA 1 60 LEU HG . . 4.230 3.152 3.006 3.285 . 0 0 "[ . 1 . 2]" 1
1278 1 60 LEU HA 1 61 ASN H . . 2.880 2.151 2.139 2.180 . 0 0 "[ . 1 . 2]" 1
1279 1 60 LEU HA 1 61 ASN HB2 . . 5.080 4.928 4.337 5.093 0.013 11 0 "[ . 1 . 2]" 1
1280 1 60 LEU HA 1 61 ASN QB . . 4.430 4.090 4.049 4.163 . 0 0 "[ . 1 . 2]" 1
1281 1 60 LEU HA 1 61 ASN HB3 . . 5.080 4.392 4.280 4.990 . 0 0 "[ . 1 . 2]" 1
1282 1 60 LEU HB2 1 60 LEU MD1 . . 3.540 2.248 2.124 2.362 . 0 0 "[ . 1 . 2]" 1
1283 1 60 LEU HB2 1 61 ASN H . . 4.470 4.310 4.195 4.411 . 0 0 "[ . 1 . 2]" 1
1284 1 60 LEU HB3 1 61 ASN H . . 3.820 3.586 3.445 3.804 . 0 0 "[ . 1 . 2]" 1
1285 1 60 LEU HB3 1 68 ASN HD21 . . 5.470 3.936 3.107 4.422 . 0 0 "[ . 1 . 2]" 1
1286 1 60 LEU HB3 1 68 ASN HD22 . . 4.540 3.082 2.433 3.586 . 0 0 "[ . 1 . 2]" 1
1287 1 60 LEU MD2 1 61 ASN H . . 3.970 3.726 3.469 3.953 . 0 0 "[ . 1 . 2]" 1
1288 1 60 LEU MD2 1 68 ASN HA . . 4.310 2.396 1.927 3.115 . 0 0 "[ . 1 . 2]" 1
1289 1 60 LEU MD2 1 68 ASN QB . . 4.720 3.303 2.223 4.280 . 0 0 "[ . 1 . 2]" 1
1290 1 60 LEU MD2 1 71 LEU MD2 . . 3.200 1.883 1.746 2.039 . 0 0 "[ . 1 . 2]" 1
1291 1 60 LEU HG 1 61 ASN H . . 5.290 5.207 5.078 5.282 . 0 0 "[ . 1 . 2]" 1
1292 1 61 ASN H 1 61 ASN HB2 . . 3.470 3.128 2.198 3.323 . 0 0 "[ . 1 . 2]" 1
1293 1 61 ASN H 1 61 ASN HB3 . . 3.470 2.364 2.248 2.931 . 0 0 "[ . 1 . 2]" 1
1294 1 61 ASN H 1 61 ASN HD21 . . 4.570 4.382 4.223 4.489 . 0 0 "[ . 1 . 2]" 1
1295 1 61 ASN H 1 61 ASN HD22 . . 5.500 5.537 5.448 5.652 0.152 8 0 "[ . 1 . 2]" 1
1296 1 61 ASN H 1 62 GLU H . . 4.680 4.428 4.315 4.549 . 0 0 "[ . 1 . 2]" 1
1297 1 61 ASN H 1 64 ASP H . . 4.910 4.048 3.588 4.577 . 0 0 "[ . 1 . 2]" 1
1298 1 61 ASN H 1 68 ASN HD21 . . 4.950 4.653 4.130 4.952 0.002 12 0 "[ . 1 . 2]" 1
1299 1 61 ASN H 1 68 ASN HD22 . . 4.120 3.070 2.461 3.575 . 0 0 "[ . 1 . 2]" 1
1300 1 61 ASN HA 1 62 GLU H . . 3.300 2.181 2.140 2.419 . 0 0 "[ . 1 . 2]" 1
1301 1 61 ASN HA 1 62 GLU HA . . 4.970 4.356 4.302 4.425 . 0 0 "[ . 1 . 2]" 1
1302 1 61 ASN HA 1 63 ASP H . . 4.570 4.167 3.573 4.570 0.000 6 0 "[ . 1 . 2]" 1
1303 1 61 ASN QB 1 63 ASP H . . 4.110 3.970 3.245 4.121 0.011 19 0 "[ . 1 . 2]" 1
1304 1 61 ASN QB 1 64 ASP H . . 4.150 3.025 1.935 3.478 . 0 0 "[ . 1 . 2]" 1
1305 1 61 ASN QB 1 64 ASP HB2 . . 4.560 2.412 1.967 3.276 . 0 0 "[ . 1 . 2]" 1
1306 1 61 ASN HB2 1 62 GLU H . . 4.700 4.007 3.549 4.485 . 0 0 "[ . 1 . 2]" 1
1307 1 61 ASN HB2 1 63 ASP H . . 4.760 4.637 4.365 4.783 0.023 11 0 "[ . 1 . 2]" 1
1308 1 61 ASN HB3 1 62 GLU H . . 4.700 4.324 3.787 4.529 . 0 0 "[ . 1 . 2]" 1
1309 1 61 ASN HB3 1 63 ASP H . . 4.760 4.348 3.311 4.696 . 0 0 "[ . 1 . 2]" 1
1310 1 61 ASN HD21 1 63 ASP QB . . 4.900 3.080 2.330 3.615 . 0 0 "[ . 1 . 2]" 1
1311 1 61 ASN HD21 1 64 ASP H . . 4.250 3.270 2.668 3.725 . 0 0 "[ . 1 . 2]" 1
1312 1 61 ASN HD21 1 64 ASP HB2 . . 5.150 3.796 2.311 4.952 . 0 0 "[ . 1 . 2]" 1
1313 1 61 ASN HD22 1 63 ASP H . . 5.200 2.714 1.787 3.646 . 0 0 "[ . 1 . 2]" 1
1314 1 61 ASN HD22 1 63 ASP HB2 . . 5.240 2.525 1.887 3.663 . 0 0 "[ . 1 . 2]" 1
1315 1 61 ASN HD22 1 63 ASP QB . . 4.470 1.988 1.692 3.374 . 0 0 "[ . 1 . 2]" 1
1316 1 61 ASN HD22 1 63 ASP HB3 . . 5.240 2.326 1.897 3.948 . 0 0 "[ . 1 . 2]" 1
1317 1 62 GLU H 1 62 GLU QB . . 3.370 2.433 2.217 2.756 . 0 0 "[ . 1 . 2]" 1
1318 1 62 GLU H 1 62 GLU HG2 . . 5.210 3.412 1.958 4.629 . 0 0 "[ . 1 . 2]" 1
1319 1 62 GLU H 1 62 GLU QG . . 4.370 2.958 1.898 4.071 . 0 0 "[ . 1 . 2]" 1
1320 1 62 GLU H 1 62 GLU HG3 . . 5.210 3.466 1.997 4.523 . 0 0 "[ . 1 . 2]" 1
1321 1 62 GLU H 1 63 ASP H . . 3.810 2.999 2.572 3.178 . 0 0 "[ . 1 . 2]" 1
1322 1 62 GLU HA 1 62 GLU QG . . 3.590 2.871 2.303 3.511 . 0 0 "[ . 1 . 2]" 1
1323 1 62 GLU HA 1 64 ASP H . . 4.540 4.177 3.537 4.410 . 0 0 "[ . 1 . 2]" 1
1324 1 62 GLU HA 1 68 ASN HD21 . . 4.640 3.569 2.973 4.642 0.002 7 0 "[ . 1 . 2]" 1
1325 1 62 GLU HA 1 68 ASN HD22 . . 4.470 3.319 2.822 4.071 . 0 0 "[ . 1 . 2]" 1
1326 1 62 GLU QB 1 63 ASP H . . 3.700 2.758 2.181 3.532 . 0 0 "[ . 1 . 2]" 1
1327 1 62 GLU QB 1 64 ASP H . . 5.120 4.697 4.235 5.115 . 0 0 "[ . 1 . 2]" 1
1328 1 62 GLU QG 1 63 ASP H . . 4.030 2.866 1.857 3.812 . 0 0 "[ . 1 . 2]" 1
1329 1 62 GLU QG 1 64 ASP H . . 5.340 4.750 4.102 5.323 . 0 0 "[ . 1 . 2]" 1
1330 1 62 GLU HG2 1 63 ASP H . . 4.670 3.439 1.948 4.669 . 0 0 "[ . 1 . 2]" 1
1331 1 62 GLU HG3 1 63 ASP H . . 4.670 3.487 1.899 4.672 0.002 18 0 "[ . 1 . 2]" 1
1332 1 63 ASP H 1 63 ASP HB2 . . 3.540 2.480 2.177 2.940 . 0 0 "[ . 1 . 2]" 1
1333 1 63 ASP H 1 63 ASP QB . . 2.980 2.230 2.128 2.729 . 0 0 "[ . 1 . 2]" 1
1334 1 63 ASP H 1 63 ASP HB3 . . 3.540 2.813 2.189 3.554 0.014 15 0 "[ . 1 . 2]" 1
1335 1 63 ASP H 1 64 ASP H . . 3.230 2.702 2.439 2.916 . 0 0 "[ . 1 . 2]" 1
1336 1 63 ASP HA 1 65 ALA H . . 4.370 3.683 3.427 4.368 . 0 0 "[ . 1 . 2]" 1
1337 1 63 ASP QB 1 64 ASP H . . 3.690 2.793 2.466 3.595 . 0 0 "[ . 1 . 2]" 1
1338 1 63 ASP HB2 1 64 ASP H . . 4.300 3.718 2.820 4.302 0.002 7 0 "[ . 1 . 2]" 1
1339 1 63 ASP HB3 1 64 ASP H . . 4.300 3.036 2.510 4.015 . 0 0 "[ . 1 . 2]" 1
1340 1 64 ASP H 1 64 ASP HB2 . . 3.220 2.313 2.201 2.445 . 0 0 "[ . 1 . 2]" 1
1341 1 64 ASP H 1 64 ASP HB3 . . 3.640 3.560 3.491 3.638 . 0 0 "[ . 1 . 2]" 1
1342 1 64 ASP H 1 65 ALA HA . . 4.900 4.826 4.362 4.905 0.005 5 0 "[ . 1 . 2]" 1
1343 1 64 ASP H 1 65 ALA MB . . 4.990 4.740 4.292 4.894 . 0 0 "[ . 1 . 2]" 1
1344 1 64 ASP H 1 67 GLU QB . . 5.500 5.384 5.179 5.500 0.000 5 0 "[ . 1 . 2]" 1
1345 1 64 ASP H 1 68 ASN HD22 . . 3.950 3.710 3.449 3.953 0.003 4 0 "[ . 1 . 2]" 1
1346 1 64 ASP HA 1 65 ALA H . . 3.110 2.691 2.382 2.915 . 0 0 "[ . 1 . 2]" 1
1347 1 64 ASP HA 1 66 VAL H . . 4.260 3.947 3.639 4.255 . 0 0 "[ . 1 . 2]" 1
1348 1 64 ASP HA 1 67 GLU H . . 4.920 3.784 3.530 3.937 . 0 0 "[ . 1 . 2]" 1
1349 1 64 ASP HB2 1 65 ALA H . . 4.500 4.359 4.170 4.495 . 0 0 "[ . 1 . 2]" 1
1350 1 64 ASP HB2 1 67 GLU H . . 5.320 5.062 4.542 5.320 . 0 0 "[ . 1 . 2]" 1
1351 1 64 ASP HB2 1 67 GLU QB . . 4.200 3.727 3.187 4.065 . 0 0 "[ . 1 . 2]" 1
1352 1 64 ASP HB2 1 68 ASN H . . 4.540 4.390 4.117 4.541 0.001 11 0 "[ . 1 . 2]" 1
1353 1 64 ASP HB2 1 68 ASN HD21 . . 4.760 4.358 3.063 4.759 . 0 0 "[ . 1 . 2]" 1
1354 1 64 ASP HB2 1 68 ASN HD22 . . 4.260 3.325 2.944 3.710 . 0 0 "[ . 1 . 2]" 1
1355 1 64 ASP HB3 1 65 ALA H . . 4.600 4.363 4.213 4.433 . 0 0 "[ . 1 . 2]" 1
1356 1 64 ASP HB3 1 67 GLU H . . 4.260 3.566 3.130 3.975 . 0 0 "[ . 1 . 2]" 1
1357 1 64 ASP HB3 1 67 GLU QB . . 3.520 2.198 1.988 2.419 . 0 0 "[ . 1 . 2]" 1
1358 1 64 ASP HB3 1 68 ASN H . . 3.850 3.428 3.091 3.701 . 0 0 "[ . 1 . 2]" 1
1359 1 65 ALA H 1 65 ALA MB . . 2.790 2.093 2.027 2.220 . 0 0 "[ . 1 . 2]" 1
1360 1 65 ALA H 1 66 VAL H . . 3.360 2.913 2.650 3.139 . 0 0 "[ . 1 . 2]" 1
1361 1 65 ALA H 1 66 VAL HB . . 5.500 4.981 4.713 5.195 . 0 0 "[ . 1 . 2]" 1
1362 1 65 ALA H 1 66 VAL MG2 . . 4.560 4.293 4.042 4.472 . 0 0 "[ . 1 . 2]" 1
1363 1 65 ALA H 1 67 GLU QB . . 5.500 5.216 4.973 5.401 . 0 0 "[ . 1 . 2]" 1
1364 1 65 ALA H 1 92 ALA MB . . 5.320 4.808 4.363 5.222 . 0 0 "[ . 1 . 2]" 1
1365 1 65 ALA HA 1 67 GLU H . . 4.750 4.615 4.330 4.751 0.001 12 0 "[ . 1 . 2]" 1
1366 1 65 ALA HA 1 68 ASN QB . . 3.970 2.366 2.107 2.593 . 0 0 "[ . 1 . 2]" 1
1367 1 65 ALA HA 1 68 ASN HD21 . . 4.310 2.419 1.905 2.952 . 0 0 "[ . 1 . 2]" 1
1368 1 65 ALA HA 1 68 ASN HD22 . . 4.520 3.681 3.367 4.116 . 0 0 "[ . 1 . 2]" 1
1369 1 65 ALA HA 1 69 ASN H . . 4.210 3.842 3.583 4.212 0.002 1 0 "[ . 1 . 2]" 1
1370 1 65 ALA MB 1 66 VAL H . . 3.290 2.340 2.093 2.550 . 0 0 "[ . 1 . 2]" 1
1371 1 65 ALA MB 1 66 VAL HA . . 4.670 3.635 3.566 3.735 . 0 0 "[ . 1 . 2]" 1
1372 1 65 ALA MB 1 68 ASN H . . 4.780 4.606 4.437 4.728 . 0 0 "[ . 1 . 2]" 1
1373 1 65 ALA MB 1 69 ASN HD21 . . 4.250 3.323 2.917 4.098 . 0 0 "[ . 1 . 2]" 1
1374 1 65 ALA MB 1 69 ASN HD22 . . 4.380 3.175 2.781 3.737 . 0 0 "[ . 1 . 2]" 1
1375 1 65 ALA MB 1 92 ALA MB . . 3.130 2.238 1.856 2.642 . 0 0 "[ . 1 . 2]" 1
1376 1 66 VAL H 1 66 VAL HB . . 2.740 2.634 2.551 2.704 . 0 0 "[ . 1 . 2]" 1
1377 1 66 VAL H 1 66 VAL MG1 . . 3.980 3.773 3.765 3.786 . 0 0 "[ . 1 . 2]" 1
1378 1 66 VAL H 1 66 VAL MG2 . . 2.950 2.070 1.875 2.252 . 0 0 "[ . 1 . 2]" 1
1379 1 66 VAL H 1 68 ASN H . . 5.260 4.363 4.219 4.482 . 0 0 "[ . 1 . 2]" 1
1380 1 66 VAL H 1 92 ALA MB . . 3.700 3.396 3.009 3.698 . 0 0 "[ . 1 . 2]" 1
1381 1 66 VAL HA 1 66 VAL MG1 . . 3.310 2.420 2.320 2.466 . 0 0 "[ . 1 . 2]" 1
1382 1 66 VAL HA 1 66 VAL MG2 . . 3.210 2.324 2.214 2.427 . 0 0 "[ . 1 . 2]" 1
1383 1 66 VAL HA 1 69 ASN H . . 4.450 4.007 3.738 4.242 . 0 0 "[ . 1 . 2]" 1
1384 1 66 VAL HA 1 69 ASN HB2 . . 4.610 3.303 2.925 3.604 . 0 0 "[ . 1 . 2]" 1
1385 1 66 VAL HA 1 69 ASN HB3 . . 5.500 4.922 4.499 5.260 . 0 0 "[ . 1 . 2]" 1
1386 1 66 VAL HA 1 69 ASN HD21 . . 4.760 2.930 2.341 3.359 . 0 0 "[ . 1 . 2]" 1
1387 1 66 VAL HA 1 69 ASN HD22 . . 5.270 4.484 3.859 5.053 . 0 0 "[ . 1 . 2]" 1
1388 1 66 VAL HA 1 70 GLN H . . 4.810 4.087 3.744 4.408 . 0 0 "[ . 1 . 2]" 1
1389 1 66 VAL HA 1 88 GLY HA2 . . 4.720 4.027 3.608 4.487 . 0 0 "[ . 1 . 2]" 1
1390 1 66 VAL HA 1 88 GLY QA . . 4.100 3.237 2.760 3.829 . 0 0 "[ . 1 . 2]" 1
1391 1 66 VAL HA 1 88 GLY HA3 . . 4.720 3.416 2.865 4.153 . 0 0 "[ . 1 . 2]" 1
1392 1 66 VAL HA 1 89 LYS HA . . 4.340 3.633 3.284 3.851 . 0 0 "[ . 1 . 2]" 1
1393 1 66 VAL HA 1 89 LYS QB . . 5.500 5.432 4.867 5.502 0.002 1 0 "[ . 1 . 2]" 1
1394 1 66 VAL HA 1 92 ALA H . . 4.730 4.419 4.016 4.703 . 0 0 "[ . 1 . 2]" 1
1395 1 66 VAL HA 1 92 ALA MB . . 3.630 3.124 2.473 3.618 . 0 0 "[ . 1 . 2]" 1
1396 1 66 VAL HB 1 67 GLU H . . 2.990 2.347 2.203 2.487 . 0 0 "[ . 1 . 2]" 1
1397 1 66 VAL HB 1 67 GLU HA . . 4.930 4.256 4.208 4.344 . 0 0 "[ . 1 . 2]" 1
1398 1 66 VAL MG1 1 67 GLU H . . 3.730 3.194 3.034 3.376 . 0 0 "[ . 1 . 2]" 1
1399 1 66 VAL MG1 1 67 GLU HA . . 3.840 3.324 3.154 3.479 . 0 0 "[ . 1 . 2]" 1
1400 1 66 VAL MG1 1 68 ASN H . . 5.080 5.034 4.939 5.081 0.001 6 0 "[ . 1 . 2]" 1
1401 1 66 VAL MG1 1 70 GLN H . . 4.690 4.065 3.769 4.403 . 0 0 "[ . 1 . 2]" 1
1402 1 66 VAL MG1 1 88 GLY QA . . 4.390 3.197 2.913 3.880 . 0 0 "[ . 1 . 2]" 1
1403 1 66 VAL MG1 1 89 LYS H . . 3.430 3.019 2.332 3.418 . 0 0 "[ . 1 . 2]" 1
1404 1 66 VAL MG1 1 89 LYS HA . . 3.250 2.383 1.976 2.910 . 0 0 "[ . 1 . 2]" 1
1405 1 66 VAL MG1 1 89 LYS QB . . 3.830 3.511 2.479 3.833 0.003 3 0 "[ . 1 . 2]" 1
1406 1 66 VAL MG1 1 89 LYS QE . . 4.300 3.226 1.930 4.072 . 0 0 "[ . 1 . 2]" 1
1407 1 66 VAL MG1 1 89 LYS HG2 . . 3.960 2.256 1.916 3.357 . 0 0 "[ . 1 . 2]" 1
1408 1 66 VAL MG1 1 89 LYS HG3 . . 3.960 2.927 2.006 3.851 . 0 0 "[ . 1 . 2]" 1
1409 1 66 VAL MG2 1 67 GLU H . . 3.840 3.754 3.686 3.819 . 0 0 "[ . 1 . 2]" 1
1410 1 66 VAL MG2 1 68 ASN H . . 5.500 5.470 5.399 5.502 0.002 4 0 "[ . 1 . 2]" 1
1411 1 66 VAL MG2 1 89 LYS HA . . 3.100 2.415 2.073 2.726 . 0 0 "[ . 1 . 2]" 1
1412 1 66 VAL MG2 1 89 LYS QE . . 4.400 3.645 1.901 4.404 0.004 12 0 "[ . 1 . 2]" 1
1413 1 66 VAL MG2 1 92 ALA H . . 4.260 4.091 3.752 4.262 0.002 20 0 "[ . 1 . 2]" 1
1414 1 66 VAL MG2 1 92 ALA MB . . 3.010 2.418 2.180 2.571 . 0 0 "[ . 1 . 2]" 1
1415 1 67 GLU H 1 67 GLU QB . . 3.210 2.337 2.209 2.504 . 0 0 "[ . 1 . 2]" 1
1416 1 67 GLU H 1 67 GLU HG2 . . 3.950 2.887 2.129 3.763 . 0 0 "[ . 1 . 2]" 1
1417 1 67 GLU H 1 67 GLU HG3 . . 3.950 3.202 2.287 3.923 . 0 0 "[ . 1 . 2]" 1
1418 1 67 GLU H 1 68 ASN H . . 3.300 2.724 2.567 2.840 . 0 0 "[ . 1 . 2]" 1
1419 1 67 GLU H 1 69 ASN H . . 4.700 4.473 4.042 4.670 . 0 0 "[ . 1 . 2]" 1
1420 1 67 GLU HA 1 67 GLU HG2 . . 3.900 2.653 2.232 3.247 . 0 0 "[ . 1 . 2]" 1
1421 1 67 GLU HA 1 67 GLU QG . . 3.280 2.561 2.184 3.050 . 0 0 "[ . 1 . 2]" 1
1422 1 67 GLU HA 1 67 GLU HG3 . . 3.900 3.441 2.771 3.825 . 0 0 "[ . 1 . 2]" 1
1423 1 67 GLU HA 1 70 GLN H . . 4.260 3.860 3.511 4.127 . 0 0 "[ . 1 . 2]" 1
1424 1 67 GLU HA 1 70 GLN HB2 . . 3.590 3.139 2.474 3.589 . 0 0 "[ . 1 . 2]" 1
1425 1 67 GLU HA 1 70 GLN HB3 . . 4.070 3.403 2.654 4.070 0.000 10 0 "[ . 1 . 2]" 1
1426 1 67 GLU HA 1 71 LEU H . . 4.610 3.904 3.767 4.171 . 0 0 "[ . 1 . 2]" 1
1427 1 67 GLU QB 1 68 ASN H . . 3.250 2.467 2.334 2.563 . 0 0 "[ . 1 . 2]" 1
1428 1 67 GLU QB 1 68 ASN HA . . 4.910 3.809 3.774 3.831 . 0 0 "[ . 1 . 2]" 1
1429 1 67 GLU QG 1 68 ASN H . . 4.500 4.115 3.895 4.255 . 0 0 "[ . 1 . 2]" 1
1430 1 68 ASN H 1 68 ASN HB2 . . 3.640 2.451 2.262 2.618 . 0 0 "[ . 1 . 2]" 1
1431 1 68 ASN H 1 68 ASN QB . . 3.120 2.411 2.237 2.558 . 0 0 "[ . 1 . 2]" 1
1432 1 68 ASN H 1 68 ASN HB3 . . 3.640 3.583 3.540 3.597 . 0 0 "[ . 1 . 2]" 1
1433 1 68 ASN H 1 68 ASN HD21 . . 4.920 3.655 2.282 4.252 . 0 0 "[ . 1 . 2]" 1
1434 1 68 ASN H 1 68 ASN HD22 . . 4.730 4.140 3.776 4.409 . 0 0 "[ . 1 . 2]" 1
1435 1 68 ASN H 1 69 ASN H . . 3.330 2.969 2.725 3.117 . 0 0 "[ . 1 . 2]" 1
1436 1 68 ASN H 1 70 GLN H . . 4.920 4.684 4.517 4.881 . 0 0 "[ . 1 . 2]" 1
1437 1 68 ASN H 1 71 LEU H . . 5.500 4.809 4.706 4.959 . 0 0 "[ . 1 . 2]" 1
1438 1 68 ASN H 1 71 LEU MD2 . . 5.500 5.331 5.108 5.502 0.002 11 0 "[ . 1 . 2]" 1
1439 1 68 ASN HA 1 69 ASN HA . . 5.070 4.791 4.691 4.836 . 0 0 "[ . 1 . 2]" 1
1440 1 68 ASN HA 1 71 LEU H . . 4.340 3.893 3.716 4.078 . 0 0 "[ . 1 . 2]" 1
1441 1 68 ASN HA 1 71 LEU HB2 . . 3.860 3.681 3.454 3.860 . 0 0 "[ . 1 . 2]" 1
1442 1 68 ASN HA 1 71 LEU QB . . 3.330 2.901 2.741 3.098 . 0 0 "[ . 1 . 2]" 1
1443 1 68 ASN HA 1 71 LEU HB3 . . 3.860 3.040 2.826 3.263 . 0 0 "[ . 1 . 2]" 1
1444 1 68 ASN HA 1 71 LEU MD2 . . 3.970 3.197 2.946 3.391 . 0 0 "[ . 1 . 2]" 1
1445 1 68 ASN HA 1 72 ALA H . . 4.780 4.318 4.121 4.586 . 0 0 "[ . 1 . 2]" 1
1446 1 68 ASN QB 1 69 ASN H . . 3.380 2.335 2.174 2.804 . 0 0 "[ . 1 . 2]" 1
1447 1 68 ASN QB 1 69 ASN HA . . 4.170 3.806 3.722 3.974 . 0 0 "[ . 1 . 2]" 1
1448 1 68 ASN HB2 1 69 ASN H . . 3.910 2.402 2.203 2.883 . 0 0 "[ . 1 . 2]" 1
1449 1 68 ASN HB3 1 69 ASN H . . 3.910 3.244 2.825 3.831 . 0 0 "[ . 1 . 2]" 1
1450 1 69 ASN H 1 69 ASN HB2 . . 3.280 2.404 2.291 2.515 . 0 0 "[ . 1 . 2]" 1
1451 1 69 ASN H 1 69 ASN HB3 . . 3.780 3.578 3.550 3.597 . 0 0 "[ . 1 . 2]" 1
1452 1 69 ASN H 1 69 ASN HD21 . . 3.680 3.131 2.806 3.466 . 0 0 "[ . 1 . 2]" 1
1453 1 69 ASN H 1 69 ASN HD22 . . 4.080 3.906 3.573 4.069 . 0 0 "[ . 1 . 2]" 1
1454 1 69 ASN H 1 70 GLN H . . 3.420 2.957 2.617 3.122 . 0 0 "[ . 1 . 2]" 1
1455 1 69 ASN H 1 71 LEU H . . 4.780 4.168 3.898 4.315 . 0 0 "[ . 1 . 2]" 1
1456 1 69 ASN HA 1 69 ASN HD21 . . 4.530 4.267 4.136 4.371 . 0 0 "[ . 1 . 2]" 1
1457 1 69 ASN HA 1 69 ASN HD22 . . 4.980 4.517 4.394 4.606 . 0 0 "[ . 1 . 2]" 1
1458 1 69 ASN HA 1 71 LEU H . . 5.120 4.342 4.182 4.495 . 0 0 "[ . 1 . 2]" 1
1459 1 69 ASN HA 1 72 ALA H . . 3.920 3.763 3.526 3.895 . 0 0 "[ . 1 . 2]" 1
1460 1 69 ASN HA 1 72 ALA MB . . 3.470 3.032 2.745 3.261 . 0 0 "[ . 1 . 2]" 1
1461 1 69 ASN HA 1 73 PHE H . . 4.420 4.152 3.908 4.288 . 0 0 "[ . 1 . 2]" 1
1462 1 69 ASN HB2 1 69 ASN HD22 . . 4.030 3.439 3.434 3.453 . 0 0 "[ . 1 . 2]" 1
1463 1 69 ASN HB2 1 70 GLN H . . 3.470 2.241 2.068 2.408 . 0 0 "[ . 1 . 2]" 1
1464 1 69 ASN HB2 1 71 LEU H . . 5.360 4.830 4.676 4.949 . 0 0 "[ . 1 . 2]" 1
1465 1 69 ASN HB2 1 73 PHE QE . . 5.500 3.559 3.339 3.965 . 0 0 "[ . 1 . 2]" 1
1466 1 69 ASN HB2 1 73 PHE HZ . . 5.460 5.118 4.245 5.459 . 0 0 "[ . 1 . 2]" 1
1467 1 69 ASN HB2 1 88 GLY H . . 5.100 4.381 4.034 4.843 . 0 0 "[ . 1 . 2]" 1
1468 1 69 ASN HB2 1 88 GLY HA2 . . 4.420 2.387 2.148 2.635 . 0 0 "[ . 1 . 2]" 1
1469 1 69 ASN HB2 1 88 GLY QA . . 3.830 2.199 2.018 2.502 . 0 0 "[ . 1 . 2]" 1
1470 1 69 ASN HB2 1 88 GLY HA3 . . 4.420 2.609 2.305 3.170 . 0 0 "[ . 1 . 2]" 1
1471 1 69 ASN HB3 1 70 GLN H . . 3.780 3.061 2.806 3.243 . 0 0 "[ . 1 . 2]" 1
1472 1 69 ASN HB3 1 70 GLN HA . . 4.890 4.113 3.960 4.277 . 0 0 "[ . 1 . 2]" 1
1473 1 69 ASN HB3 1 73 PHE QE . . 4.460 2.119 1.999 2.781 . 0 0 "[ . 1 . 2]" 1
1474 1 69 ASN HB3 1 73 PHE HZ . . 4.530 3.421 2.608 3.768 . 0 0 "[ . 1 . 2]" 1
1475 1 69 ASN HB3 1 86 THR MG . . 5.290 4.758 4.528 5.047 . 0 0 "[ . 1 . 2]" 1
1476 1 69 ASN HB3 1 88 GLY H . . 4.450 4.097 3.605 4.450 0.000 3 0 "[ . 1 . 2]" 1
1477 1 69 ASN HB3 1 88 GLY HA2 . . 4.350 2.318 2.130 2.590 . 0 0 "[ . 1 . 2]" 1
1478 1 69 ASN HB3 1 88 GLY QA . . 3.750 2.268 2.079 2.538 . 0 0 "[ . 1 . 2]" 1
1479 1 69 ASN HB3 1 88 GLY HA3 . . 4.350 3.249 2.797 3.640 . 0 0 "[ . 1 . 2]" 1
1480 1 69 ASN HD21 1 70 GLN H . . 4.710 4.213 3.939 4.402 . 0 0 "[ . 1 . 2]" 1
1481 1 69 ASN HD21 1 91 MET HB3 . . 4.730 2.999 2.174 3.820 . 0 0 "[ . 1 . 2]" 1
1482 1 69 ASN HD21 1 92 ALA H . . 4.850 3.805 3.255 4.324 . 0 0 "[ . 1 . 2]" 1
1483 1 69 ASN HD21 1 92 ALA MB . . 4.210 3.109 2.467 3.680 . 0 0 "[ . 1 . 2]" 1
1484 1 69 ASN HD22 1 88 GLY QA . . 5.340 4.287 3.929 4.716 . 0 0 "[ . 1 . 2]" 1
1485 1 69 ASN HD22 1 91 MET HB3 . . 4.760 3.344 2.674 3.885 . 0 0 "[ . 1 . 2]" 1
1486 1 69 ASN HD22 1 92 ALA H . . 5.060 4.320 3.795 4.995 . 0 0 "[ . 1 . 2]" 1
1487 1 69 ASN HD22 1 92 ALA MB . . 4.430 3.379 2.411 4.109 . 0 0 "[ . 1 . 2]" 1
1488 1 70 GLN H 1 70 GLN HB2 . . 3.310 2.244 2.169 2.382 . 0 0 "[ . 1 . 2]" 1
1489 1 70 GLN H 1 70 GLN HB3 . . 3.590 3.158 2.745 3.586 . 0 0 "[ . 1 . 2]" 1
1490 1 70 GLN H 1 70 GLN HG2 . . 4.920 3.758 2.525 4.656 . 0 0 "[ . 1 . 2]" 1
1491 1 70 GLN H 1 70 GLN QG . . 4.200 3.473 2.470 4.056 . 0 0 "[ . 1 . 2]" 1
1492 1 70 GLN H 1 70 GLN HG3 . . 4.920 4.222 3.500 4.608 . 0 0 "[ . 1 . 2]" 1
1493 1 70 GLN H 1 88 GLY H . . 4.950 4.093 3.717 4.765 . 0 0 "[ . 1 . 2]" 1
1494 1 70 GLN H 1 88 GLY HA2 . . 3.830 3.526 2.989 3.834 0.004 1 0 "[ . 1 . 2]" 1
1495 1 70 GLN H 1 88 GLY HA3 . . 3.830 2.647 2.283 3.220 . 0 0 "[ . 1 . 2]" 1
1496 1 70 GLN HA 1 70 GLN HE21 . . 4.830 2.430 1.902 3.163 . 0 0 "[ . 1 . 2]" 1
1497 1 70 GLN HA 1 70 GLN QE . . 4.210 2.369 1.894 3.017 . 0 0 "[ . 1 . 2]" 1
1498 1 70 GLN HA 1 70 GLN HE22 . . 4.830 3.455 2.891 3.821 . 0 0 "[ . 1 . 2]" 1
1499 1 70 GLN HA 1 70 GLN QG . . 3.690 2.557 2.372 2.868 . 0 0 "[ . 1 . 2]" 1
1500 1 70 GLN HA 1 73 PHE H . . 3.900 3.774 3.620 3.889 . 0 0 "[ . 1 . 2]" 1
1501 1 70 GLN HA 1 73 PHE QB . . 4.060 2.707 2.515 2.838 . 0 0 "[ . 1 . 2]" 1
1502 1 70 GLN HA 1 73 PHE QD . . 3.910 2.209 2.002 2.769 . 0 0 "[ . 1 . 2]" 1
1503 1 70 GLN HA 1 74 ASP H . . 4.360 3.957 3.693 4.128 . 0 0 "[ . 1 . 2]" 1
1504 1 70 GLN HA 1 88 GLY H . . 4.590 3.298 2.895 4.042 . 0 0 "[ . 1 . 2]" 1
1505 1 70 GLN HB2 1 71 LEU H . . 4.040 3.311 2.707 3.831 . 0 0 "[ . 1 . 2]" 1
1506 1 70 GLN HB2 1 88 GLY H . . 4.930 4.197 3.520 4.930 . 0 0 "[ . 1 . 2]" 1
1507 1 70 GLN HB3 1 70 GLN HE22 . . 5.210 4.623 3.876 5.272 0.062 1 0 "[ . 1 . 2]" 1
1508 1 70 GLN HB3 1 71 LEU H . . 3.700 2.802 2.444 3.369 . 0 0 "[ . 1 . 2]" 1
1509 1 70 GLN HB3 1 74 ASP H . . 5.360 5.126 4.741 5.363 0.003 1 0 "[ . 1 . 2]" 1
1510 1 70 GLN QE 1 73 PHE QB . . 4.010 2.992 2.320 3.526 . 0 0 "[ . 1 . 2]" 1
1511 1 70 GLN QE 1 73 PHE QD . . 4.670 3.008 2.189 3.586 . 0 0 "[ . 1 . 2]" 1
1512 1 70 GLN QE 1 87 THR HA . . 4.840 3.540 2.289 4.521 . 0 0 "[ . 1 . 2]" 1
1513 1 70 GLN QE 1 88 GLY H . . 4.790 2.996 1.857 4.154 . 0 0 "[ . 1 . 2]" 1
1514 1 70 GLN HE21 1 73 PHE HB2 . . 5.210 3.322 2.501 3.937 . 0 0 "[ . 1 . 2]" 1
1515 1 70 GLN HE21 1 73 PHE HB3 . . 5.210 4.273 3.519 4.880 . 0 0 "[ . 1 . 2]" 1
1516 1 70 GLN HE22 1 73 PHE HB2 . . 5.210 3.900 2.967 4.658 . 0 0 "[ . 1 . 2]" 1
1517 1 70 GLN HE22 1 73 PHE HB3 . . 5.210 4.554 3.795 5.195 . 0 0 "[ . 1 . 2]" 1
1518 1 70 GLN QG 1 71 LEU H . . 4.690 4.211 3.814 4.440 . 0 0 "[ . 1 . 2]" 1
1519 1 70 GLN QG 1 88 GLY H . . 5.340 3.402 2.148 5.195 . 0 0 "[ . 1 . 2]" 1
1520 1 70 GLN HG2 1 71 LEU H . . 5.500 4.841 4.564 5.085 . 0 0 "[ . 1 . 2]" 1
1521 1 70 GLN HG3 1 71 LEU H . . 5.500 4.671 4.060 5.100 . 0 0 "[ . 1 . 2]" 1
1522 1 71 LEU H 1 71 LEU HB2 . . 3.160 2.520 2.416 2.618 . 0 0 "[ . 1 . 2]" 1
1523 1 71 LEU H 1 71 LEU HB3 . . 3.160 2.488 2.394 2.592 . 0 0 "[ . 1 . 2]" 1
1524 1 71 LEU H 1 71 LEU MD1 . . 4.600 4.060 3.931 4.153 . 0 0 "[ . 1 . 2]" 1
1525 1 71 LEU H 1 71 LEU MD2 . . 4.970 4.184 4.150 4.235 . 0 0 "[ . 1 . 2]" 1
1526 1 71 LEU H 1 71 LEU HG . . 4.600 4.471 4.408 4.531 . 0 0 "[ . 1 . 2]" 1
1527 1 71 LEU H 1 72 ALA H . . 3.360 3.011 2.879 3.093 . 0 0 "[ . 1 . 2]" 1
1528 1 71 LEU H 1 73 PHE H . . 4.540 4.210 4.017 4.335 . 0 0 "[ . 1 . 2]" 1
1529 1 71 LEU HA 1 71 LEU MD1 . . 3.090 2.194 2.013 2.432 . 0 0 "[ . 1 . 2]" 1
1530 1 71 LEU HA 1 71 LEU MD2 . . 3.980 3.904 3.843 3.957 . 0 0 "[ . 1 . 2]" 1
1531 1 71 LEU HA 1 71 LEU HG . . 4.040 3.170 3.078 3.264 . 0 0 "[ . 1 . 2]" 1
1532 1 71 LEU HA 1 74 ASP H . . 4.420 3.615 3.430 3.986 . 0 0 "[ . 1 . 2]" 1
1533 1 71 LEU HA 1 74 ASP HB2 . . 4.110 3.329 2.556 4.003 . 0 0 "[ . 1 . 2]" 1
1534 1 71 LEU HA 1 74 ASP QB . . 3.600 2.852 2.533 3.256 . 0 0 "[ . 1 . 2]" 1
1535 1 71 LEU HA 1 74 ASP HB3 . . 4.110 3.338 2.771 4.114 0.004 11 0 "[ . 1 . 2]" 1
1536 1 71 LEU HA 1 75 VAL H . . 4.580 3.949 3.777 4.164 . 0 0 "[ . 1 . 2]" 1
1537 1 71 LEU HA 1 75 VAL MG2 . . 4.380 3.637 3.458 3.942 . 0 0 "[ . 1 . 2]" 1
1538 1 71 LEU QB 1 72 ALA H . . 3.170 2.091 1.979 2.217 . 0 0 "[ . 1 . 2]" 1
1539 1 71 LEU QB 1 73 PHE H . . 5.340 4.543 4.377 4.695 . 0 0 "[ . 1 . 2]" 1
1540 1 71 LEU QB 1 75 VAL MG2 . . 4.200 4.067 3.914 4.202 0.002 17 0 "[ . 1 . 2]" 1
1541 1 71 LEU HB2 1 71 LEU MD1 . . 3.350 2.289 2.152 2.366 . 0 0 "[ . 1 . 2]" 1
1542 1 71 LEU HB2 1 71 LEU MD2 . . 3.430 2.379 2.253 2.540 . 0 0 "[ . 1 . 2]" 1
1543 1 71 LEU HB3 1 71 LEU MD1 . . 3.350 3.185 3.169 3.197 . 0 0 "[ . 1 . 2]" 1
1544 1 71 LEU HB3 1 71 LEU MD2 . . 3.430 2.265 2.082 2.415 . 0 0 "[ . 1 . 2]" 1
1545 1 71 LEU MD1 1 75 VAL H . . 4.130 3.871 3.548 4.130 0.000 1 0 "[ . 1 . 2]" 1
1546 1 71 LEU MD1 1 75 VAL MG2 . . 3.030 2.321 1.974 2.671 . 0 0 "[ . 1 . 2]" 1
1547 1 71 LEU MD2 1 72 ALA H . . 4.480 3.680 3.471 3.893 . 0 0 "[ . 1 . 2]" 1
1548 1 71 LEU HG 1 72 ALA H . . 4.020 3.122 2.903 3.286 . 0 0 "[ . 1 . 2]" 1
1549 1 71 LEU HG 1 72 ALA HA . . 4.580 3.372 3.158 3.565 . 0 0 "[ . 1 . 2]" 1
1550 1 71 LEU HG 1 72 ALA MB . . 4.330 4.157 3.934 4.329 . 0 0 "[ . 1 . 2]" 1
1551 1 71 LEU HG 1 75 VAL H . . 5.160 4.381 4.118 4.776 . 0 0 "[ . 1 . 2]" 1
1552 1 71 LEU HG 1 75 VAL MG2 . . 3.730 2.528 2.253 2.762 . 0 0 "[ . 1 . 2]" 1
1553 1 72 ALA H 1 72 ALA MB . . 2.870 2.136 2.029 2.254 . 0 0 "[ . 1 . 2]" 1
1554 1 72 ALA H 1 73 PHE H . . 3.350 2.937 2.788 3.019 . 0 0 "[ . 1 . 2]" 1
1555 1 72 ALA H 1 74 ASP H . . 4.770 4.496 4.284 4.741 . 0 0 "[ . 1 . 2]" 1
1556 1 72 ALA HA 1 75 VAL H . . 4.200 3.712 3.528 3.891 . 0 0 "[ . 1 . 2]" 1
1557 1 72 ALA HA 1 75 VAL HB . . 3.860 2.801 2.577 3.030 . 0 0 "[ . 1 . 2]" 1
1558 1 72 ALA HA 1 75 VAL MG1 . . 4.490 4.072 3.783 4.281 . 0 0 "[ . 1 . 2]" 1
1559 1 72 ALA HA 1 75 VAL MG2 . . 3.890 3.162 2.774 3.620 . 0 0 "[ . 1 . 2]" 1
1560 1 72 ALA HA 1 76 ALA H . . 4.460 4.079 3.884 4.382 . 0 0 "[ . 1 . 2]" 1
1561 1 72 ALA MB 1 73 PHE H . . 3.260 2.512 2.386 2.671 . 0 0 "[ . 1 . 2]" 1
1562 1 72 ALA MB 1 74 ASP H . . 4.930 4.652 4.516 4.918 . 0 0 "[ . 1 . 2]" 1
1563 1 72 ALA MB 1 75 VAL H . . 4.950 4.775 4.611 4.947 . 0 0 "[ . 1 . 2]" 1
1564 1 72 ALA MB 1 75 VAL HB . . 4.480 4.255 4.036 4.463 . 0 0 "[ . 1 . 2]" 1
1565 1 72 ALA MB 1 76 ALA H . . 4.900 4.608 4.444 4.860 . 0 0 "[ . 1 . 2]" 1
1566 1 72 ALA MB 1 105 TYR QE . . 5.500 4.915 4.595 5.257 . 0 0 "[ . 1 . 2]" 1
1567 1 73 PHE H 1 73 PHE HB2 . . 3.680 2.501 2.412 2.607 . 0 0 "[ . 1 . 2]" 1
1568 1 73 PHE H 1 73 PHE QB . . 3.150 2.456 2.377 2.548 . 0 0 "[ . 1 . 2]" 1
1569 1 73 PHE H 1 73 PHE HB3 . . 3.680 3.589 3.581 3.597 . 0 0 "[ . 1 . 2]" 1
1570 1 73 PHE H 1 73 PHE QD . . 3.670 3.090 2.436 3.240 . 0 0 "[ . 1 . 2]" 1
1571 1 73 PHE H 1 73 PHE QE . . 4.740 4.458 4.107 4.627 . 0 0 "[ . 1 . 2]" 1
1572 1 73 PHE H 1 74 ASP H . . 3.420 2.805 2.676 3.011 . 0 0 "[ . 1 . 2]" 1
1573 1 73 PHE H 1 74 ASP QB . . 5.080 4.511 4.343 4.651 . 0 0 "[ . 1 . 2]" 1
1574 1 73 PHE H 1 75 VAL H . . 4.850 4.263 3.974 4.581 . 0 0 "[ . 1 . 2]" 1
1575 1 73 PHE H 1 76 ALA MB . . 5.500 4.632 4.414 4.881 . 0 0 "[ . 1 . 2]" 1
1576 1 73 PHE HA 1 73 PHE QD . . 3.660 2.012 1.996 2.066 . 0 0 "[ . 1 . 2]" 1
1577 1 73 PHE HA 1 76 ALA H . . 4.730 3.595 3.367 3.865 . 0 0 "[ . 1 . 2]" 1
1578 1 73 PHE QB 1 74 ASP H . . 3.380 2.357 2.120 2.538 . 0 0 "[ . 1 . 2]" 1
1579 1 73 PHE QB 1 84 PRO HB2 . . 4.620 3.314 3.020 3.713 . 0 0 "[ . 1 . 2]" 1
1580 1 73 PHE QB 1 84 PRO HB3 . . 4.140 2.124 1.984 2.602 . 0 0 "[ . 1 . 2]" 1
1581 1 73 PHE QB 1 84 PRO HD3 . . 5.000 3.641 3.155 4.171 . 0 0 "[ . 1 . 2]" 1
1582 1 73 PHE QB 1 84 PRO QG . . 4.650 2.580 2.152 3.266 . 0 0 "[ . 1 . 2]" 1
1583 1 73 PHE HB2 1 74 ASP H . . 3.970 2.400 2.147 2.594 . 0 0 "[ . 1 . 2]" 1
1584 1 73 PHE HB2 1 84 PRO HB3 . . 4.940 3.760 3.499 4.155 . 0 0 "[ . 1 . 2]" 1
1585 1 73 PHE HB2 1 84 PRO QG . . 5.350 3.877 3.495 4.415 . 0 0 "[ . 1 . 2]" 1
1586 1 73 PHE HB3 1 74 ASP H . . 3.970 3.441 3.258 3.609 . 0 0 "[ . 1 . 2]" 1
1587 1 73 PHE HB3 1 84 PRO HB3 . . 4.940 2.136 1.993 2.629 . 0 0 "[ . 1 . 2]" 1
1588 1 73 PHE HB3 1 84 PRO QG . . 5.350 2.624 2.168 3.380 . 0 0 "[ . 1 . 2]" 1
1589 1 73 PHE QD 1 74 ASP H . . 5.110 4.251 4.161 4.360 . 0 0 "[ . 1 . 2]" 1
1590 1 73 PHE QD 1 86 THR MG . . 4.940 4.499 4.202 4.698 . 0 0 "[ . 1 . 2]" 1
1591 1 73 PHE QD 1 88 GLY H . . 4.180 2.887 2.382 3.609 . 0 0 "[ . 1 . 2]" 1
1592 1 73 PHE QE 1 86 THR MG . . 3.480 3.150 2.957 3.379 . 0 0 "[ . 1 . 2]" 1
1593 1 73 PHE QE 1 88 GLY H . . 4.430 3.160 2.829 3.640 . 0 0 "[ . 1 . 2]" 1
1594 1 73 PHE QE 1 88 GLY HA2 . . 4.800 2.456 2.163 2.802 . 0 0 "[ . 1 . 2]" 1
1595 1 73 PHE QE 1 88 GLY QA . . 4.060 2.417 2.136 2.747 . 0 0 "[ . 1 . 2]" 1
1596 1 73 PHE QE 1 88 GLY HA3 . . 4.800 3.623 3.326 3.953 . 0 0 "[ . 1 . 2]" 1
1597 1 73 PHE QE 1 91 MET HB2 . . 4.700 3.127 2.646 3.441 . 0 0 "[ . 1 . 2]" 1
1598 1 73 PHE QE 1 91 MET HB3 . . 4.760 3.767 3.279 4.162 . 0 0 "[ . 1 . 2]" 1
1599 1 73 PHE QE 1 91 MET QG . . 4.340 3.358 3.003 3.745 . 0 0 "[ . 1 . 2]" 1
1600 1 73 PHE HZ 1 86 THR MG . . 3.530 2.961 2.548 3.332 . 0 0 "[ . 1 . 2]" 1
1601 1 73 PHE HZ 1 91 MET HB2 . . 4.620 3.723 3.414 4.089 . 0 0 "[ . 1 . 2]" 1
1602 1 73 PHE HZ 1 91 MET HB3 . . 4.730 4.548 4.153 4.722 . 0 0 "[ . 1 . 2]" 1
1603 1 73 PHE HZ 1 91 MET ME . . 5.500 4.584 3.949 4.987 . 0 0 "[ . 1 . 2]" 1
1604 1 73 PHE HZ 1 91 MET HG2 . . 4.680 2.952 2.619 3.654 . 0 0 "[ . 1 . 2]" 1
1605 1 73 PHE HZ 1 91 MET QG . . 4.070 2.851 2.599 3.054 . 0 0 "[ . 1 . 2]" 1
1606 1 73 PHE HZ 1 91 MET HG3 . . 4.680 4.332 3.111 4.659 . 0 0 "[ . 1 . 2]" 1
1607 1 74 ASP H 1 74 ASP HB2 . . 3.630 2.292 2.190 2.654 . 0 0 "[ . 1 . 2]" 1
1608 1 74 ASP H 1 74 ASP QB . . 3.100 2.191 2.134 2.242 . 0 0 "[ . 1 . 2]" 1
1609 1 74 ASP H 1 74 ASP HB3 . . 3.630 2.930 2.417 3.528 . 0 0 "[ . 1 . 2]" 1
1610 1 74 ASP H 1 75 VAL H . . 3.490 2.800 2.676 2.947 . 0 0 "[ . 1 . 2]" 1
1611 1 74 ASP H 1 75 VAL HB . . 5.000 4.929 4.779 5.001 0.001 7 0 "[ . 1 . 2]" 1
1612 1 74 ASP H 1 75 VAL MG2 . . 4.680 4.352 4.154 4.559 . 0 0 "[ . 1 . 2]" 1
1613 1 74 ASP H 1 76 ALA H . . 4.880 4.187 3.935 4.556 . 0 0 "[ . 1 . 2]" 1
1614 1 74 ASP HA 1 77 GLU H . . 4.020 3.443 3.278 3.701 . 0 0 "[ . 1 . 2]" 1
1615 1 74 ASP HA 1 77 GLU HB2 . . 4.440 3.595 3.198 4.033 . 0 0 "[ . 1 . 2]" 1
1616 1 74 ASP HA 1 77 GLU HB3 . . 4.340 3.012 2.680 3.526 . 0 0 "[ . 1 . 2]" 1
1617 1 74 ASP HA 1 78 ARG H . . 4.650 4.351 4.050 4.652 0.002 12 0 "[ . 1 . 2]" 1
1618 1 74 ASP QB 1 75 VAL H . . 3.260 2.445 2.170 2.686 . 0 0 "[ . 1 . 2]" 1
1619 1 74 ASP HB2 1 75 VAL H . . 3.810 3.439 2.473 3.769 . 0 0 "[ . 1 . 2]" 1
1620 1 74 ASP HB3 1 75 VAL H . . 3.810 2.598 2.189 3.312 . 0 0 "[ . 1 . 2]" 1
1621 1 75 VAL H 1 75 VAL HB . . 3.080 2.501 2.377 2.618 . 0 0 "[ . 1 . 2]" 1
1622 1 75 VAL H 1 75 VAL MG1 . . 3.840 3.757 3.727 3.769 . 0 0 "[ . 1 . 2]" 1
1623 1 75 VAL H 1 75 VAL MG2 . . 3.100 2.246 1.940 2.517 . 0 0 "[ . 1 . 2]" 1
1624 1 75 VAL H 1 76 ALA H . . 3.370 2.730 2.624 2.914 . 0 0 "[ . 1 . 2]" 1
1625 1 75 VAL H 1 76 ALA MB . . 4.630 4.346 4.218 4.502 . 0 0 "[ . 1 . 2]" 1
1626 1 75 VAL H 1 77 GLU H . . 4.910 4.071 3.764 4.660 . 0 0 "[ . 1 . 2]" 1
1627 1 75 VAL HA 1 75 VAL MG1 . . 3.380 2.428 2.351 2.515 . 0 0 "[ . 1 . 2]" 1
1628 1 75 VAL HA 1 75 VAL MG2 . . 3.180 2.289 2.123 2.420 . 0 0 "[ . 1 . 2]" 1
1629 1 75 VAL HA 1 77 GLU H . . 5.120 4.260 3.937 5.003 . 0 0 "[ . 1 . 2]" 1
1630 1 75 VAL HA 1 78 ARG H . . 4.000 3.380 3.159 3.627 . 0 0 "[ . 1 . 2]" 1
1631 1 75 VAL HA 1 78 ARG HB2 . . 4.330 3.258 2.511 3.959 . 0 0 "[ . 1 . 2]" 1
1632 1 75 VAL HA 1 78 ARG QB . . 3.560 2.455 2.073 2.735 . 0 0 "[ . 1 . 2]" 1
1633 1 75 VAL HA 1 78 ARG HB3 . . 4.330 3.109 2.088 4.337 0.007 15 0 "[ . 1 . 2]" 1
1634 1 75 VAL HA 1 78 ARG HG2 . . 4.960 4.448 3.839 4.917 . 0 0 "[ . 1 . 2]" 1
1635 1 75 VAL HA 1 78 ARG QG . . 4.230 3.891 3.202 4.233 0.003 7 0 "[ . 1 . 2]" 1
1636 1 75 VAL HA 1 78 ARG HG3 . . 4.960 4.491 3.249 4.956 . 0 0 "[ . 1 . 2]" 1
1637 1 75 VAL HA 1 79 GLU H . . 4.360 3.769 3.492 4.101 . 0 0 "[ . 1 . 2]" 1
1638 1 75 VAL HB 1 76 ALA H . . 3.340 2.636 2.353 2.804 . 0 0 "[ . 1 . 2]" 1
1639 1 75 VAL HB 1 76 ALA MB . . 4.630 3.960 3.825 4.157 . 0 0 "[ . 1 . 2]" 1
1640 1 75 VAL MG1 1 76 ALA H . . 3.850 3.385 3.108 3.539 . 0 0 "[ . 1 . 2]" 1
1641 1 75 VAL MG1 1 76 ALA HA . . 4.300 3.417 3.187 3.578 . 0 0 "[ . 1 . 2]" 1
1642 1 75 VAL MG1 1 79 GLU H . . 4.210 3.674 3.338 3.983 . 0 0 "[ . 1 . 2]" 1
1643 1 75 VAL MG1 1 79 GLU QB . . 3.830 2.863 2.525 3.426 . 0 0 "[ . 1 . 2]" 1
1644 1 75 VAL MG1 1 79 GLU HG2 . . 4.110 3.199 2.200 4.110 . 0 0 "[ . 1 . 2]" 1
1645 1 75 VAL MG1 1 79 GLU QG . . 3.370 2.546 2.165 2.803 . 0 0 "[ . 1 . 2]" 1
1646 1 75 VAL MG1 1 79 GLU HG3 . . 4.110 2.767 2.221 3.636 . 0 0 "[ . 1 . 2]" 1
1647 1 75 VAL MG1 1 80 PHE H . . 4.740 4.442 4.189 4.694 . 0 0 "[ . 1 . 2]" 1
1648 1 75 VAL MG1 1 80 PHE QD . . 4.960 4.538 3.602 4.781 . 0 0 "[ . 1 . 2]" 1
1649 1 75 VAL MG1 1 80 PHE QE . . 4.870 3.848 2.879 4.080 . 0 0 "[ . 1 . 2]" 1
1650 1 75 VAL MG1 1 80 PHE HZ . . 4.760 4.563 4.060 4.807 0.047 20 0 "[ . 1 . 2]" 1
1651 1 75 VAL MG2 1 76 ALA H . . 4.330 3.891 3.772 4.047 . 0 0 "[ . 1 . 2]" 1
1652 1 76 ALA H 1 76 ALA MB . . 3.000 2.113 2.027 2.228 . 0 0 "[ . 1 . 2]" 1
1653 1 76 ALA H 1 77 GLU H . . 3.550 2.576 2.417 2.829 . 0 0 "[ . 1 . 2]" 1
1654 1 76 ALA H 1 80 PHE QD . . 4.940 4.557 4.320 4.939 . 0 0 "[ . 1 . 2]" 1
1655 1 76 ALA H 1 109 PHE HZ . . 4.940 4.836 4.645 4.947 0.007 2 0 "[ . 1 . 2]" 1
1656 1 76 ALA HA 1 80 PHE H . . 3.820 2.801 2.590 3.051 . 0 0 "[ . 1 . 2]" 1
1657 1 76 ALA HA 1 80 PHE HB2 . . 4.820 3.139 2.645 3.363 . 0 0 "[ . 1 . 2]" 1
1658 1 76 ALA HA 1 80 PHE QB . . 4.090 3.090 2.620 3.302 . 0 0 "[ . 1 . 2]" 1
1659 1 76 ALA HA 1 80 PHE HB3 . . 4.820 4.639 4.257 4.814 . 0 0 "[ . 1 . 2]" 1
1660 1 76 ALA HA 1 80 PHE QD . . 3.490 2.101 1.930 2.587 . 0 0 "[ . 1 . 2]" 1
1661 1 76 ALA HA 1 80 PHE QE . . 4.490 3.259 2.973 3.699 . 0 0 "[ . 1 . 2]" 1
1662 1 76 ALA HA 1 81 GLY H . . 4.270 4.183 4.032 4.327 0.057 20 0 "[ . 1 . 2]" 1
1663 1 76 ALA HA 1 82 ILE H . . 4.700 4.414 4.137 4.600 . 0 0 "[ . 1 . 2]" 1
1664 1 76 ALA MB 1 77 GLU H . . 3.460 2.793 2.380 2.981 . 0 0 "[ . 1 . 2]" 1
1665 1 76 ALA MB 1 77 GLU HB2 . . 4.980 3.887 3.627 4.011 . 0 0 "[ . 1 . 2]" 1
1666 1 76 ALA MB 1 80 PHE H . . 4.420 4.098 3.879 4.363 . 0 0 "[ . 1 . 2]" 1
1667 1 76 ALA MB 1 80 PHE QD . . 3.770 2.199 1.915 3.467 . 0 0 "[ . 1 . 2]" 1
1668 1 76 ALA MB 1 80 PHE QE . . 3.990 3.193 2.622 4.092 0.102 20 0 "[ . 1 . 2]" 1
1669 1 76 ALA MB 1 81 GLY H . . 4.960 4.552 4.396 4.748 . 0 0 "[ . 1 . 2]" 1
1670 1 76 ALA MB 1 82 ILE H . . 4.230 3.555 3.319 3.775 . 0 0 "[ . 1 . 2]" 1
1671 1 76 ALA MB 1 82 ILE HB . . 3.490 2.732 2.378 2.890 . 0 0 "[ . 1 . 2]" 1
1672 1 76 ALA MB 1 82 ILE MD . . 3.920 3.345 3.158 3.527 . 0 0 "[ . 1 . 2]" 1
1673 1 76 ALA MB 1 82 ILE MG . . 3.910 3.709 3.417 3.911 0.001 9 0 "[ . 1 . 2]" 1
1674 1 76 ALA MB 1 105 TYR HH . . 4.090 3.104 2.280 3.982 . 0 0 "[ . 1 . 2]" 1
1675 1 76 ALA MB 1 109 PHE QD . . 4.320 4.224 3.965 4.325 0.005 2 0 "[ . 1 . 2]" 1
1676 1 76 ALA MB 1 109 PHE QE . . 3.600 2.288 2.008 2.536 . 0 0 "[ . 1 . 2]" 1
1677 1 76 ALA MB 1 109 PHE HZ . . 3.230 2.028 1.898 2.285 . 0 0 "[ . 1 . 2]" 1
1678 1 77 GLU H 1 77 GLU HB2 . . 3.310 2.459 2.253 2.653 . 0 0 "[ . 1 . 2]" 1
1679 1 77 GLU H 1 77 GLU HB3 . . 3.180 2.739 2.622 2.842 . 0 0 "[ . 1 . 2]" 1
1680 1 77 GLU H 1 77 GLU QG . . 4.450 3.979 3.868 4.035 . 0 0 "[ . 1 . 2]" 1
1681 1 77 GLU H 1 82 ILE H . . 4.790 4.224 4.007 4.632 . 0 0 "[ . 1 . 2]" 1
1682 1 77 GLU H 1 84 PRO HD3 . . 5.500 4.759 4.258 5.246 . 0 0 "[ . 1 . 2]" 1
1683 1 77 GLU HA 1 77 GLU QG . . 3.250 2.327 2.183 2.420 . 0 0 "[ . 1 . 2]" 1
1684 1 77 GLU HA 1 80 PHE H . . 4.860 4.445 4.198 4.863 0.003 4 0 "[ . 1 . 2]" 1
1685 1 77 GLU HA 1 81 GLY H . . 4.630 2.823 2.535 3.369 . 0 0 "[ . 1 . 2]" 1
1686 1 77 GLU HA 1 82 ILE H . . 3.060 2.123 1.906 2.592 . 0 0 "[ . 1 . 2]" 1
1687 1 77 GLU HA 1 83 PRO HD3 . . 5.500 5.055 4.722 5.265 . 0 0 "[ . 1 . 2]" 1
1688 1 77 GLU HA 1 84 PRO HD3 . . 5.500 4.699 4.253 5.165 . 0 0 "[ . 1 . 2]" 1
1689 1 77 GLU HB2 1 78 ARG H . . 4.140 4.037 3.923 4.136 . 0 0 "[ . 1 . 2]" 1
1690 1 77 GLU HB2 1 84 PRO HD3 . . 4.790 2.637 2.246 3.181 . 0 0 "[ . 1 . 2]" 1
1691 1 77 GLU HB3 1 78 ARG H . . 3.480 3.288 3.199 3.346 . 0 0 "[ . 1 . 2]" 1
1692 1 77 GLU HB3 1 84 PRO HD3 . . 4.520 4.023 3.657 4.496 . 0 0 "[ . 1 . 2]" 1
1693 1 77 GLU QG 1 81 GLY H . . 4.930 4.564 4.277 4.860 . 0 0 "[ . 1 . 2]" 1
1694 1 77 GLU QG 1 82 ILE H . . 4.160 3.697 3.377 4.071 . 0 0 "[ . 1 . 2]" 1
1695 1 77 GLU QG 1 83 PRO HA . . 4.180 2.360 2.053 2.786 . 0 0 "[ . 1 . 2]" 1
1696 1 77 GLU QG 1 83 PRO QB . . 3.770 3.513 3.140 3.745 . 0 0 "[ . 1 . 2]" 1
1697 1 77 GLU QG 1 83 PRO HD3 . . 3.980 3.832 3.589 3.984 0.004 4 0 "[ . 1 . 2]" 1
1698 1 77 GLU QG 1 84 PRO HD2 . . 3.880 3.253 2.603 3.883 0.003 3 0 "[ . 1 . 2]" 1
1699 1 77 GLU QG 1 84 PRO HD3 . . 3.870 2.865 2.173 3.508 . 0 0 "[ . 1 . 2]" 1
1700 1 78 ARG H 1 78 ARG QB . . 3.170 2.322 2.251 2.515 . 0 0 "[ . 1 . 2]" 1
1701 1 78 ARG H 1 78 ARG HG2 . . 4.740 4.019 3.018 4.715 . 0 0 "[ . 1 . 2]" 1
1702 1 78 ARG H 1 78 ARG QG . . 4.100 3.523 2.493 4.026 . 0 0 "[ . 1 . 2]" 1
1703 1 78 ARG H 1 78 ARG HG3 . . 4.740 4.098 2.521 4.697 . 0 0 "[ . 1 . 2]" 1
1704 1 78 ARG H 1 79 GLU H . . 3.440 2.190 2.087 2.460 . 0 0 "[ . 1 . 2]" 1
1705 1 78 ARG H 1 80 PHE H . . 4.590 3.836 3.590 3.908 . 0 0 "[ . 1 . 2]" 1
1706 1 78 ARG H 1 81 GLY H . . 5.090 3.610 3.380 3.705 . 0 0 "[ . 1 . 2]" 1
1707 1 78 ARG HA 1 78 ARG HG2 . . 3.890 3.152 2.377 3.874 . 0 0 "[ . 1 . 2]" 1
1708 1 78 ARG HA 1 78 ARG QG . . 3.340 2.690 2.335 3.011 . 0 0 "[ . 1 . 2]" 1
1709 1 78 ARG HA 1 78 ARG HG3 . . 3.890 3.156 2.657 3.700 . 0 0 "[ . 1 . 2]" 1
1710 1 78 ARG QB 1 79 GLU H . . 3.420 2.727 2.160 2.855 . 0 0 "[ . 1 . 2]" 1
1711 1 78 ARG QB 1 80 PHE H . . 5.180 4.887 4.571 5.002 . 0 0 "[ . 1 . 2]" 1
1712 1 78 ARG HB2 1 78 ARG QD . . 3.900 2.736 2.235 3.509 . 0 0 "[ . 1 . 2]" 1
1713 1 78 ARG HB2 1 79 GLU H . . 4.140 3.550 2.686 4.099 . 0 0 "[ . 1 . 2]" 1
1714 1 78 ARG HB3 1 78 ARG QD . . 3.900 2.742 2.209 3.495 . 0 0 "[ . 1 . 2]" 1
1715 1 78 ARG HB3 1 79 GLU H . . 4.140 3.116 2.175 3.923 . 0 0 "[ . 1 . 2]" 1
1716 1 78 ARG QG 1 79 GLU H . . 4.490 3.815 3.072 4.318 . 0 0 "[ . 1 . 2]" 1
1717 1 78 ARG HG2 1 79 GLU H . . 5.130 4.397 3.557 5.166 0.036 15 0 "[ . 1 . 2]" 1
1718 1 78 ARG HG3 1 79 GLU H . . 5.130 4.452 3.179 5.120 . 0 0 "[ . 1 . 2]" 1
1719 1 79 GLU H 1 79 GLU HB2 . . 3.780 2.371 2.249 2.522 . 0 0 "[ . 1 . 2]" 1
1720 1 79 GLU H 1 79 GLU QB . . 3.230 2.340 2.225 2.481 . 0 0 "[ . 1 . 2]" 1
1721 1 79 GLU H 1 79 GLU HB3 . . 3.780 3.601 3.533 3.691 . 0 0 "[ . 1 . 2]" 1
1722 1 79 GLU H 1 79 GLU QG . . 3.270 2.919 2.489 3.279 0.009 9 0 "[ . 1 . 2]" 1
1723 1 79 GLU H 1 80 PHE H . . 3.200 2.383 2.290 2.678 . 0 0 "[ . 1 . 2]" 1
1724 1 79 GLU H 1 81 GLY H . . 4.220 3.147 3.020 3.483 . 0 0 "[ . 1 . 2]" 1
1725 1 79 GLU HA 1 79 GLU QG . . 3.690 2.627 2.212 2.948 . 0 0 "[ . 1 . 2]" 1
1726 1 79 GLU HA 1 81 GLY H . . 4.490 4.376 4.166 4.537 0.047 20 0 "[ . 1 . 2]" 1
1727 1 79 GLU QB 1 80 PHE H . . 3.480 2.350 2.252 2.538 . 0 0 "[ . 1 . 2]" 1
1728 1 79 GLU QB 1 80 PHE QE . . 4.590 3.498 2.659 3.707 . 0 0 "[ . 1 . 2]" 1
1729 1 79 GLU QB 1 81 GLY H . . 4.710 4.206 4.171 4.314 . 0 0 "[ . 1 . 2]" 1
1730 1 79 GLU HB2 1 80 PHE H . . 4.030 2.424 2.287 2.628 . 0 0 "[ . 1 . 2]" 1
1731 1 79 GLU HB2 1 80 PHE QD . . 4.760 3.849 2.315 4.161 . 0 0 "[ . 1 . 2]" 1
1732 1 79 GLU HB2 1 81 GLY H . . 5.500 4.471 4.399 4.584 . 0 0 "[ . 1 . 2]" 1
1733 1 79 GLU HB3 1 80 PHE H . . 4.030 3.198 3.007 3.406 . 0 0 "[ . 1 . 2]" 1
1734 1 79 GLU HB3 1 80 PHE QD . . 4.760 3.668 3.192 4.008 . 0 0 "[ . 1 . 2]" 1
1735 1 79 GLU HB3 1 81 GLY H . . 5.500 5.130 4.985 5.280 . 0 0 "[ . 1 . 2]" 1
1736 1 79 GLU QG 1 80 PHE H . . 4.220 4.088 3.880 4.208 . 0 0 "[ . 1 . 2]" 1
1737 1 79 GLU HG2 1 80 PHE H . . 4.920 4.506 4.155 4.860 . 0 0 "[ . 1 . 2]" 1
1738 1 79 GLU HG3 1 80 PHE H . . 4.920 4.709 4.391 4.947 0.027 9 0 "[ . 1 . 2]" 1
1739 1 80 PHE H 1 80 PHE HB2 . . 3.900 2.629 2.538 2.715 . 0 0 "[ . 1 . 2]" 1
1740 1 80 PHE H 1 80 PHE QB . . 3.360 2.571 2.492 2.644 . 0 0 "[ . 1 . 2]" 1
1741 1 80 PHE H 1 80 PHE HB3 . . 3.900 3.636 3.625 3.683 . 0 0 "[ . 1 . 2]" 1
1742 1 80 PHE H 1 80 PHE QD . . 3.980 3.052 1.834 3.228 . 0 0 "[ . 1 . 2]" 1
1743 1 80 PHE H 1 81 GLY H . . 3.050 2.319 2.137 2.377 . 0 0 "[ . 1 . 2]" 1
1744 1 80 PHE H 1 81 GLY QA . . 5.120 4.249 4.097 4.303 . 0 0 "[ . 1 . 2]" 1
1745 1 80 PHE H 1 82 ILE H . . 4.170 3.977 3.824 4.081 . 0 0 "[ . 1 . 2]" 1
1746 1 80 PHE H 1 82 ILE MD . . 5.100 4.997 4.705 5.105 0.005 1 0 "[ . 1 . 2]" 1
1747 1 80 PHE H 1 82 ILE HG13 . . 5.060 4.838 4.635 4.941 . 0 0 "[ . 1 . 2]" 1
1748 1 80 PHE HA 1 80 PHE QD . . 3.380 2.307 2.089 3.221 . 0 0 "[ . 1 . 2]" 1
1749 1 80 PHE HA 1 82 ILE H . . 5.030 4.703 4.148 4.869 . 0 0 "[ . 1 . 2]" 1
1750 1 80 PHE QB 1 81 GLY H . . 3.920 3.003 2.927 3.129 . 0 0 "[ . 1 . 2]" 1
1751 1 80 PHE QB 1 82 ILE H . . 3.700 2.735 2.376 2.908 . 0 0 "[ . 1 . 2]" 1
1752 1 80 PHE QB 1 82 ILE HG12 . . 4.160 3.676 3.495 3.794 . 0 0 "[ . 1 . 2]" 1
1753 1 80 PHE QB 1 112 LEU MD1 . . 4.950 3.722 3.045 4.421 . 0 0 "[ . 1 . 2]" 1
1754 1 80 PHE QB 1 112 LEU MD2 . . 3.680 2.737 2.251 3.215 . 0 0 "[ . 1 . 2]" 1
1755 1 80 PHE HB2 1 81 GLY H . . 4.540 3.083 2.999 3.225 . 0 0 "[ . 1 . 2]" 1
1756 1 80 PHE HB2 1 82 ILE H . . 4.320 2.785 2.423 2.967 . 0 0 "[ . 1 . 2]" 1
1757 1 80 PHE HB2 1 82 ILE HB . . 4.450 3.303 3.104 3.459 . 0 0 "[ . 1 . 2]" 1
1758 1 80 PHE HB2 1 82 ILE MD . . 3.960 2.734 2.406 2.920 . 0 0 "[ . 1 . 2]" 1
1759 1 80 PHE HB2 1 82 ILE HG12 . . 4.890 4.218 4.065 4.384 . 0 0 "[ . 1 . 2]" 1
1760 1 80 PHE HB2 1 82 ILE HG13 . . 4.410 2.521 2.344 2.689 . 0 0 "[ . 1 . 2]" 1
1761 1 80 PHE HB2 1 112 LEU MD2 . . 4.340 3.930 3.387 4.371 0.031 20 0 "[ . 1 . 2]" 1
1762 1 80 PHE HB3 1 81 GLY H . . 4.540 4.138 4.077 4.221 . 0 0 "[ . 1 . 2]" 1
1763 1 80 PHE HB3 1 82 ILE H . . 4.320 4.007 3.424 4.235 . 0 0 "[ . 1 . 2]" 1
1764 1 80 PHE HB3 1 82 ILE HB . . 4.450 4.331 4.067 4.451 0.001 20 0 "[ . 1 . 2]" 1
1765 1 80 PHE HB3 1 82 ILE MD . . 3.960 2.490 1.994 2.679 . 0 0 "[ . 1 . 2]" 1
1766 1 80 PHE HB3 1 82 ILE HG12 . . 4.890 4.052 3.792 4.211 . 0 0 "[ . 1 . 2]" 1
1767 1 80 PHE HB3 1 82 ILE HG13 . . 4.410 2.621 2.395 2.794 . 0 0 "[ . 1 . 2]" 1
1768 1 80 PHE HB3 1 112 LEU MD2 . . 4.340 2.795 2.285 3.315 . 0 0 "[ . 1 . 2]" 1
1769 1 80 PHE QD 1 82 ILE MD . . 3.780 3.171 2.676 3.433 . 0 0 "[ . 1 . 2]" 1
1770 1 80 PHE QD 1 82 ILE HG13 . . 4.550 4.192 3.931 4.375 . 0 0 "[ . 1 . 2]" 1
1771 1 80 PHE QD 1 112 LEU MD1 . . 4.660 3.674 3.175 4.489 . 0 0 "[ . 1 . 2]" 1
1772 1 80 PHE QD 1 112 LEU MD2 . . 4.310 2.678 1.784 3.073 . 0 0 "[ . 1 . 2]" 1
1773 1 80 PHE QE 1 113 PHE HZ . . 4.320 3.599 2.452 4.232 . 0 0 "[ . 1 . 2]" 1
1774 1 80 PHE HZ 1 113 PHE HZ . . 4.600 2.869 2.000 3.639 . 0 0 "[ . 1 . 2]" 1
1775 1 81 GLY H 1 82 ILE H . . 3.330 2.564 2.470 2.690 . 0 0 "[ . 1 . 2]" 1
1776 1 81 GLY H 1 82 ILE HG13 . . 4.440 4.122 3.924 4.311 . 0 0 "[ . 1 . 2]" 1
1777 1 81 GLY QA 1 82 ILE HA . . 4.890 4.043 4.019 4.090 . 0 0 "[ . 1 . 2]" 1
1778 1 82 ILE H 1 82 ILE HB . . 3.340 2.537 2.482 2.610 . 0 0 "[ . 1 . 2]" 1
1779 1 82 ILE H 1 82 ILE MD . . 4.030 3.747 3.404 3.871 . 0 0 "[ . 1 . 2]" 1
1780 1 82 ILE H 1 82 ILE HG12 . . 3.890 3.761 3.537 3.891 0.001 12 0 "[ . 1 . 2]" 1
1781 1 82 ILE H 1 82 ILE HG13 . . 3.570 2.511 2.126 2.682 . 0 0 "[ . 1 . 2]" 1
1782 1 82 ILE H 1 82 ILE MG . . 3.930 3.800 3.773 3.828 . 0 0 "[ . 1 . 2]" 1
1783 1 82 ILE H 1 83 PRO HD3 . . 4.750 4.627 4.503 4.727 . 0 0 "[ . 1 . 2]" 1
1784 1 82 ILE HA 1 82 ILE MD . . 4.390 3.849 3.828 3.888 . 0 0 "[ . 1 . 2]" 1
1785 1 82 ILE HA 1 82 ILE HG12 . . 3.930 2.575 2.529 2.679 . 0 0 "[ . 1 . 2]" 1
1786 1 82 ILE HA 1 82 ILE HG13 . . 4.130 2.973 2.890 3.066 . 0 0 "[ . 1 . 2]" 1
1787 1 82 ILE HA 1 82 ILE MG . . 3.650 2.378 2.276 2.474 . 0 0 "[ . 1 . 2]" 1
1788 1 82 ILE HA 1 83 PRO HD3 . . 3.530 2.314 2.284 2.382 . 0 0 "[ . 1 . 2]" 1
1789 1 82 ILE HB 1 82 ILE MD . . 3.580 2.373 2.264 2.471 . 0 0 "[ . 1 . 2]" 1
1790 1 82 ILE MD 1 82 ILE MG . . 3.120 2.047 1.942 2.231 . 0 0 "[ . 1 . 2]" 1
1791 1 82 ILE MD 1 108 LYS H . . 5.210 5.071 4.673 5.208 . 0 0 "[ . 1 . 2]" 1
1792 1 82 ILE MD 1 108 LYS HB2 . . 4.000 2.954 2.174 3.195 . 0 0 "[ . 1 . 2]" 1
1793 1 82 ILE MD 1 108 LYS QB . . 3.410 2.103 1.807 2.490 . 0 0 "[ . 1 . 2]" 1
1794 1 82 ILE MD 1 108 LYS HB3 . . 4.000 2.164 1.829 2.662 . 0 0 "[ . 1 . 2]" 1
1795 1 82 ILE MD 1 109 PHE H . . 4.470 4.203 3.919 4.425 . 0 0 "[ . 1 . 2]" 1
1796 1 82 ILE MD 1 109 PHE HA . . 4.030 3.845 3.440 4.034 0.004 4 0 "[ . 1 . 2]" 1
1797 1 82 ILE MD 1 109 PHE QD . . 4.480 3.448 2.749 3.949 . 0 0 "[ . 1 . 2]" 1
1798 1 82 ILE MD 1 109 PHE QE . . 4.510 2.896 1.990 3.598 . 0 0 "[ . 1 . 2]" 1
1799 1 82 ILE MD 1 109 PHE HZ . . 4.950 3.730 3.175 4.370 . 0 0 "[ . 1 . 2]" 1
1800 1 82 ILE HG12 1 108 LYS QB . . 4.310 3.824 2.935 4.158 . 0 0 "[ . 1 . 2]" 1
1801 1 82 ILE MG 1 83 PRO HD2 . . 3.860 2.208 1.978 2.446 . 0 0 "[ . 1 . 2]" 1
1802 1 82 ILE MG 1 83 PRO HD3 . . 3.920 3.548 3.376 3.705 . 0 0 "[ . 1 . 2]" 1
1803 1 82 ILE MG 1 105 TYR QE . . 3.150 2.675 2.395 3.133 . 0 0 "[ . 1 . 2]" 1
1804 1 82 ILE MG 1 105 TYR HH . . 4.570 3.398 2.457 4.569 . 0 0 "[ . 1 . 2]" 1
1805 1 82 ILE MG 1 108 LYS H . . 5.400 5.290 4.549 5.408 0.008 19 0 "[ . 1 . 2]" 1
1806 1 82 ILE MG 1 108 LYS HB2 . . 3.770 3.338 2.574 3.548 . 0 0 "[ . 1 . 2]" 1
1807 1 82 ILE MG 1 108 LYS QB . . 3.290 2.819 2.082 3.092 . 0 0 "[ . 1 . 2]" 1
1808 1 82 ILE MG 1 108 LYS HB3 . . 3.770 3.054 2.199 3.422 . 0 0 "[ . 1 . 2]" 1
1809 1 82 ILE MG 1 108 LYS QD . . 3.490 2.102 1.773 3.495 0.005 17 0 "[ . 1 . 2]" 1
1810 1 82 ILE MG 1 108 LYS HG2 . . 4.310 4.024 1.949 4.317 0.007 18 0 "[ . 1 . 2]" 1
1811 1 82 ILE MG 1 108 LYS QG . . 3.710 3.352 1.930 3.710 . 0 0 "[ . 1 . 2]" 1
1812 1 82 ILE MG 1 108 LYS HG3 . . 4.310 3.731 2.662 4.308 . 0 0 "[ . 1 . 2]" 1
1813 1 82 ILE MG 1 109 PHE QE . . 4.200 4.000 3.548 4.205 0.005 3 0 "[ . 1 . 2]" 1
1814 1 82 ILE MG 1 109 PHE HZ . . 4.280 4.073 3.502 4.285 0.005 17 0 "[ . 1 . 2]" 1
1815 1 83 PRO HA 1 84 PRO HD2 . . 3.400 2.030 1.960 2.146 . 0 0 "[ . 1 . 2]" 1
1816 1 83 PRO HA 1 84 PRO HD3 . . 3.520 2.307 2.263 2.365 . 0 0 "[ . 1 . 2]" 1
1817 1 83 PRO HA 1 84 PRO QG . . 4.120 3.807 3.780 3.859 . 0 0 "[ . 1 . 2]" 1
1818 1 83 PRO QB 1 84 PRO HD2 . . 3.390 3.027 2.760 3.228 . 0 0 "[ . 1 . 2]" 1
1819 1 83 PRO QB 1 84 PRO HD3 . . 4.240 3.991 3.798 4.129 . 0 0 "[ . 1 . 2]" 1
1820 1 83 PRO HB2 1 84 PRO HD2 . . 3.880 3.334 2.990 3.593 . 0 0 "[ . 1 . 2]" 1
1821 1 83 PRO HB3 1 84 PRO HD2 . . 3.880 3.474 3.241 3.656 . 0 0 "[ . 1 . 2]" 1
1822 1 84 PRO HA 1 85 VAL H . . 3.130 2.210 2.159 2.297 . 0 0 "[ . 1 . 2]" 1
1823 1 84 PRO HA 1 85 VAL MG1 . . 4.540 3.736 3.477 3.929 . 0 0 "[ . 1 . 2]" 1
1824 1 84 PRO HA 1 85 VAL MG2 . . 4.550 3.837 3.671 4.044 . 0 0 "[ . 1 . 2]" 1
1825 1 84 PRO HA 1 86 THR H . . 4.460 3.945 3.754 4.202 . 0 0 "[ . 1 . 2]" 1
1826 1 84 PRO HA 1 105 TYR QE . . 3.550 2.226 2.012 2.481 . 0 0 "[ . 1 . 2]" 1
1827 1 84 PRO HA 1 105 TYR HH . . 4.530 3.178 2.018 4.314 . 0 0 "[ . 1 . 2]" 1
1828 1 84 PRO HB2 1 85 VAL H . . 3.530 3.224 2.899 3.479 . 0 0 "[ . 1 . 2]" 1
1829 1 84 PRO HB2 1 86 THR H . . 3.450 3.058 2.803 3.449 . 0 0 "[ . 1 . 2]" 1
1830 1 84 PRO HB2 1 86 THR MG . . 5.500 4.294 3.912 4.655 . 0 0 "[ . 1 . 2]" 1
1831 1 84 PRO HB2 1 105 TYR QE . . 5.380 4.747 4.538 5.035 . 0 0 "[ . 1 . 2]" 1
1832 1 84 PRO HB3 1 85 VAL H . . 4.000 3.803 3.607 3.964 . 0 0 "[ . 1 . 2]" 1
1833 1 84 PRO HB3 1 85 VAL MG2 . . 5.500 4.971 4.864 5.105 . 0 0 "[ . 1 . 2]" 1
1834 1 84 PRO HB3 1 86 THR H . . 4.810 4.354 4.186 4.692 . 0 0 "[ . 1 . 2]" 1
1835 1 84 PRO HB3 1 105 TYR QE . . 4.760 4.091 3.724 4.392 . 0 0 "[ . 1 . 2]" 1
1836 1 84 PRO QG 1 86 THR H . . 5.350 4.656 4.362 5.025 . 0 0 "[ . 1 . 2]" 1
1837 1 85 VAL H 1 85 VAL HB . . 4.060 3.644 3.612 3.700 . 0 0 "[ . 1 . 2]" 1
1838 1 85 VAL H 1 85 VAL MG1 . . 3.630 2.492 2.178 2.832 . 0 0 "[ . 1 . 2]" 1
1839 1 85 VAL H 1 85 VAL MG2 . . 3.470 2.049 1.878 2.216 . 0 0 "[ . 1 . 2]" 1
1840 1 85 VAL H 1 86 THR H . . 2.970 2.376 2.144 2.614 . 0 0 "[ . 1 . 2]" 1
1841 1 85 VAL H 1 86 THR MG . . 4.660 3.853 3.600 4.223 . 0 0 "[ . 1 . 2]" 1
1842 1 85 VAL HA 1 85 VAL MG1 . . 3.370 2.291 2.195 2.418 . 0 0 "[ . 1 . 2]" 1
1843 1 85 VAL HA 1 85 VAL MG2 . . 3.520 3.195 3.185 3.202 . 0 0 "[ . 1 . 2]" 1
1844 1 85 VAL HA 1 86 THR HA . . 4.570 4.528 4.518 4.543 . 0 0 "[ . 1 . 2]" 1
1845 1 85 VAL HB 1 105 TYR QD . . 5.000 4.790 4.582 4.924 . 0 0 "[ . 1 . 2]" 1
1846 1 85 VAL MG1 1 86 THR H . . 4.160 3.957 3.799 4.040 . 0 0 "[ . 1 . 2]" 1
1847 1 85 VAL MG1 1 86 THR MG . . 4.640 4.541 4.432 4.627 . 0 0 "[ . 1 . 2]" 1
1848 1 85 VAL MG1 1 104 MET ME . . 4.500 3.045 1.749 4.499 . 0 0 "[ . 1 . 2]" 1
1849 1 85 VAL MG1 1 105 TYR H . . 4.570 4.179 3.930 4.455 . 0 0 "[ . 1 . 2]" 1
1850 1 85 VAL MG1 1 105 TYR HA . . 4.630 3.570 3.247 3.865 . 0 0 "[ . 1 . 2]" 1
1851 1 85 VAL MG1 1 105 TYR HB2 . . 4.380 2.352 1.998 2.750 . 0 0 "[ . 1 . 2]" 1
1852 1 85 VAL MG1 1 105 TYR QB . . 3.750 2.331 1.987 2.712 . 0 0 "[ . 1 . 2]" 1
1853 1 85 VAL MG1 1 105 TYR HB3 . . 4.380 3.818 3.276 4.146 . 0 0 "[ . 1 . 2]" 1
1854 1 85 VAL MG1 1 105 TYR QD . . 3.650 2.004 1.923 2.222 . 0 0 "[ . 1 . 2]" 1
1855 1 85 VAL MG2 1 86 THR H . . 3.740 2.013 1.865 2.261 . 0 0 "[ . 1 . 2]" 1
1856 1 85 VAL MG2 1 86 THR HB . . 4.070 2.834 2.503 3.122 . 0 0 "[ . 1 . 2]" 1
1857 1 85 VAL MG2 1 86 THR MG . . 3.710 2.190 1.945 2.376 . 0 0 "[ . 1 . 2]" 1
1858 1 85 VAL MG2 1 101 SER HB2 . . 4.420 4.194 2.730 4.424 0.004 17 0 "[ . 1 . 2]" 1
1859 1 85 VAL MG2 1 101 SER QB . . 3.730 3.192 2.702 3.727 . 0 0 "[ . 1 . 2]" 1
1860 1 85 VAL MG2 1 101 SER HB3 . . 4.420 3.466 2.835 4.425 0.005 7 0 "[ . 1 . 2]" 1
1861 1 85 VAL MG2 1 104 MET ME . . 5.500 4.533 3.293 5.405 . 0 0 "[ . 1 . 2]" 1
1862 1 85 VAL MG2 1 105 TYR H . . 5.040 4.599 4.343 4.941 . 0 0 "[ . 1 . 2]" 1
1863 1 85 VAL MG2 1 105 TYR HB2 . . 4.220 2.704 2.307 3.132 . 0 0 "[ . 1 . 2]" 1
1864 1 85 VAL MG2 1 105 TYR QB . . 3.590 2.623 2.271 3.032 . 0 0 "[ . 1 . 2]" 1
1865 1 85 VAL MG2 1 105 TYR HB3 . . 4.220 3.564 3.189 4.067 . 0 0 "[ . 1 . 2]" 1
1866 1 85 VAL MG2 1 105 TYR QD . . 4.070 3.153 2.730 3.656 . 0 0 "[ . 1 . 2]" 1
1867 1 86 THR H 1 86 THR HB . . 4.100 3.230 3.129 3.295 . 0 0 "[ . 1 . 2]" 1
1868 1 86 THR H 1 86 THR MG . . 3.470 2.211 1.955 2.428 . 0 0 "[ . 1 . 2]" 1
1869 1 86 THR H 1 87 THR H . . 4.730 4.440 4.421 4.470 . 0 0 "[ . 1 . 2]" 1
1870 1 86 THR HA 1 87 THR H . . 3.210 2.364 2.293 2.444 . 0 0 "[ . 1 . 2]" 1
1871 1 86 THR HB 1 87 THR H . . 3.920 3.818 3.716 3.917 . 0 0 "[ . 1 . 2]" 1
1872 1 86 THR MG 1 87 THR H . . 3.640 3.476 3.130 3.634 . 0 0 "[ . 1 . 2]" 1
1873 1 86 THR MG 1 91 MET H . . 3.860 3.633 3.227 3.867 0.007 20 0 "[ . 1 . 2]" 1
1874 1 86 THR MG 1 91 MET HB2 . . 3.540 2.433 2.018 2.810 . 0 0 "[ . 1 . 2]" 1
1875 1 86 THR MG 1 91 MET ME . . 3.520 3.349 2.879 3.524 0.004 12 0 "[ . 1 . 2]" 1
1876 1 86 THR MG 1 91 MET HG2 . . 4.450 3.295 2.173 3.777 . 0 0 "[ . 1 . 2]" 1
1877 1 86 THR MG 1 91 MET HG3 . . 4.450 4.012 3.354 4.263 . 0 0 "[ . 1 . 2]" 1
1878 1 87 THR H 1 87 THR MG . . 3.450 2.653 2.483 2.952 . 0 0 "[ . 1 . 2]" 1
1879 1 87 THR H 1 88 GLY H . . 4.920 4.545 4.512 4.578 . 0 0 "[ . 1 . 2]" 1
1880 1 87 THR H 1 90 GLU H . . 4.200 4.003 3.853 4.205 0.005 17 0 "[ . 1 . 2]" 1
1881 1 87 THR H 1 90 GLU QB . . 3.180 2.752 2.439 3.183 0.003 20 0 "[ . 1 . 2]" 1
1882 1 87 THR H 1 91 MET H . . 4.530 4.026 3.804 4.329 . 0 0 "[ . 1 . 2]" 1
1883 1 87 THR HA 1 87 THR MG . . 3.350 2.304 2.159 2.425 . 0 0 "[ . 1 . 2]" 1
1884 1 87 THR HA 1 88 GLY H . . 3.230 2.205 2.173 2.331 . 0 0 "[ . 1 . 2]" 1
1885 1 87 THR HA 1 89 LYS H . . 4.460 4.297 4.069 4.462 0.002 12 0 "[ . 1 . 2]" 1
1886 1 87 THR HB 1 88 GLY H . . 3.410 3.004 2.579 3.144 . 0 0 "[ . 1 . 2]" 1
1887 1 87 THR HB 1 89 LYS H . . 3.600 3.036 2.688 3.174 . 0 0 "[ . 1 . 2]" 1
1888 1 87 THR HB 1 89 LYS QB . . 4.810 3.409 3.077 3.564 . 0 0 "[ . 1 . 2]" 1
1889 1 87 THR HB 1 90 GLU H . . 4.570 3.708 3.391 3.973 . 0 0 "[ . 1 . 2]" 1
1890 1 87 THR MG 1 88 GLY H . . 4.080 3.879 3.725 4.005 . 0 0 "[ . 1 . 2]" 1
1891 1 87 THR MG 1 89 LYS H . . 4.700 4.579 4.308 4.699 . 0 0 "[ . 1 . 2]" 1
1892 1 87 THR MG 1 90 GLU H . . 4.530 4.439 4.279 4.533 0.003 20 0 "[ . 1 . 2]" 1
1893 1 88 GLY H 1 89 LYS H . . 3.560 3.070 2.892 3.183 . 0 0 "[ . 1 . 2]" 1
1894 1 88 GLY H 1 90 GLU H . . 5.000 4.760 4.499 4.990 . 0 0 "[ . 1 . 2]" 1
1895 1 88 GLY H 1 91 MET HB2 . . 4.720 4.561 4.343 4.713 . 0 0 "[ . 1 . 2]" 1
1896 1 88 GLY QA 1 91 MET H . . 4.120 3.473 3.277 3.671 . 0 0 "[ . 1 . 2]" 1
1897 1 88 GLY QA 1 91 MET HB2 . . 4.310 2.870 2.630 3.153 . 0 0 "[ . 1 . 2]" 1
1898 1 88 GLY HA2 1 91 MET H . . 4.860 3.580 3.371 3.803 . 0 0 "[ . 1 . 2]" 1
1899 1 88 GLY HA2 1 91 MET HB2 . . 4.970 2.901 2.652 3.194 . 0 0 "[ . 1 . 2]" 1
1900 1 88 GLY HA2 1 91 MET HB3 . . 4.520 2.630 2.220 2.944 . 0 0 "[ . 1 . 2]" 1
1901 1 88 GLY HA3 1 91 MET H . . 4.860 4.689 4.464 4.838 . 0 0 "[ . 1 . 2]" 1
1902 1 88 GLY HA3 1 91 MET HB2 . . 4.970 4.571 4.359 4.849 . 0 0 "[ . 1 . 2]" 1
1903 1 88 GLY HA3 1 91 MET HB3 . . 4.520 4.186 3.857 4.446 . 0 0 "[ . 1 . 2]" 1
1904 1 89 LYS H 1 89 LYS QB . . 2.870 2.288 2.113 2.414 . 0 0 "[ . 1 . 2]" 1
1905 1 89 LYS H 1 89 LYS QG . . 3.730 2.645 2.257 3.744 0.014 12 0 "[ . 1 . 2]" 1
1906 1 89 LYS H 1 90 GLU H . . 3.490 2.964 2.762 3.144 . 0 0 "[ . 1 . 2]" 1
1907 1 89 LYS HA 1 89 LYS QD . . 4.230 3.523 2.174 4.095 . 0 0 "[ . 1 . 2]" 1
1908 1 89 LYS HA 1 89 LYS QE . . 4.670 3.744 1.929 4.489 . 0 0 "[ . 1 . 2]" 1
1909 1 89 LYS HA 1 89 LYS HG2 . . 3.880 2.401 2.167 2.742 . 0 0 "[ . 1 . 2]" 1
1910 1 89 LYS HA 1 89 LYS QG . . 3.290 2.323 2.146 2.648 . 0 0 "[ . 1 . 2]" 1
1911 1 89 LYS HA 1 89 LYS HG3 . . 3.880 3.259 2.429 3.743 . 0 0 "[ . 1 . 2]" 1
1912 1 89 LYS HA 1 92 ALA H . . 4.470 3.879 3.578 4.223 . 0 0 "[ . 1 . 2]" 1
1913 1 89 LYS HA 1 92 ALA MB . . 3.760 3.431 3.071 3.729 . 0 0 "[ . 1 . 2]" 1
1914 1 89 LYS QB 1 89 LYS QE . . 4.520 2.772 1.997 3.644 . 0 0 "[ . 1 . 2]" 1
1915 1 89 LYS QB 1 90 GLU H . . 3.320 2.310 2.029 2.492 . 0 0 "[ . 1 . 2]" 1
1916 1 89 LYS QB 1 91 MET H . . 4.780 4.478 4.286 4.647 . 0 0 "[ . 1 . 2]" 1
1917 1 90 GLU H 1 90 GLU HB2 . . 3.590 2.419 2.231 2.688 . 0 0 "[ . 1 . 2]" 1
1918 1 90 GLU H 1 90 GLU QB . . 2.840 2.259 2.157 2.402 . 0 0 "[ . 1 . 2]" 1
1919 1 90 GLU H 1 90 GLU HB3 . . 3.590 2.914 2.399 3.584 . 0 0 "[ . 1 . 2]" 1
1920 1 90 GLU H 1 90 GLU QG . . 4.080 3.522 2.251 4.061 . 0 0 "[ . 1 . 2]" 1
1921 1 90 GLU H 1 91 MET H . . 3.300 2.687 2.533 2.875 . 0 0 "[ . 1 . 2]" 1
1922 1 90 GLU HA 1 90 GLU QG . . 3.510 2.596 2.190 3.137 . 0 0 "[ . 1 . 2]" 1
1923 1 90 GLU HA 1 93 SER H . . 4.540 3.207 2.996 3.639 . 0 0 "[ . 1 . 2]" 1
1924 1 90 GLU QB 1 91 MET H . . 2.980 2.562 2.392 2.794 . 0 0 "[ . 1 . 2]" 1
1925 1 91 MET H 1 91 MET HB2 . . 3.120 2.306 2.203 2.407 . 0 0 "[ . 1 . 2]" 1
1926 1 91 MET H 1 91 MET HB3 . . 4.150 2.784 2.643 2.923 . 0 0 "[ . 1 . 2]" 1
1927 1 91 MET H 1 91 MET HG2 . . 4.690 4.530 4.142 4.626 . 0 0 "[ . 1 . 2]" 1
1928 1 91 MET H 1 91 MET HG3 . . 4.690 4.542 4.478 4.615 . 0 0 "[ . 1 . 2]" 1
1929 1 91 MET H 1 92 ALA H . . 3.420 2.871 2.585 3.051 . 0 0 "[ . 1 . 2]" 1
1930 1 91 MET H 1 92 ALA MB . . 4.620 4.518 4.216 4.625 0.005 20 0 "[ . 1 . 2]" 1
1931 1 91 MET H 1 93 SER H . . 4.690 4.071 3.744 4.188 . 0 0 "[ . 1 . 2]" 1
1932 1 91 MET HA 1 91 MET ME . . 3.760 2.830 2.079 3.273 . 0 0 "[ . 1 . 2]" 1
1933 1 91 MET HA 1 94 ALA MB . . 4.390 3.585 2.944 4.391 0.001 9 0 "[ . 1 . 2]" 1
1934 1 91 MET HB2 1 92 ALA H . . 3.800 3.686 3.435 3.801 0.001 15 0 "[ . 1 . 2]" 1
1935 1 91 MET HB3 1 92 ALA H . . 3.420 2.494 2.187 2.680 . 0 0 "[ . 1 . 2]" 1
1936 1 91 MET ME 1 91 MET HG2 . . 3.670 2.944 2.022 3.275 . 0 0 "[ . 1 . 2]" 1
1937 1 91 MET ME 1 91 MET QG . . 3.160 2.128 1.988 2.237 . 0 0 "[ . 1 . 2]" 1
1938 1 91 MET ME 1 91 MET HG3 . . 3.670 2.292 2.043 2.964 . 0 0 "[ . 1 . 2]" 1
1939 1 91 MET ME 1 97 PRO QB . . 4.180 2.343 1.891 2.724 . 0 0 "[ . 1 . 2]" 1
1940 1 91 MET ME 1 97 PRO HD2 . . 4.610 4.206 3.625 4.442 . 0 0 "[ . 1 . 2]" 1
1941 1 91 MET ME 1 97 PRO HD3 . . 4.470 3.429 2.373 3.791 . 0 0 "[ . 1 . 2]" 1
1942 1 91 MET QG 1 92 ALA H . . 4.560 3.861 3.499 4.245 . 0 0 "[ . 1 . 2]" 1
1943 1 92 ALA H 1 92 ALA MB . . 2.900 2.123 2.037 2.297 . 0 0 "[ . 1 . 2]" 1
1944 1 92 ALA H 1 93 SER H . . 3.060 2.445 2.333 2.664 . 0 0 "[ . 1 . 2]" 1
1945 1 92 ALA MB 1 93 SER H . . 3.440 2.770 2.589 3.196 . 0 0 "[ . 1 . 2]" 1
1946 1 92 ALA MB 1 93 SER HA . . 4.800 3.776 3.693 4.021 . 0 0 "[ . 1 . 2]" 1
1947 1 93 SER H 1 93 SER QB . . 3.000 2.237 2.149 2.494 . 0 0 "[ . 1 . 2]" 1
1948 1 93 SER H 1 94 ALA H . . 3.420 2.874 2.341 3.139 . 0 0 "[ . 1 . 2]" 1
1949 1 93 SER QB 1 94 ALA H . . 3.490 2.272 2.027 3.230 . 0 0 "[ . 1 . 2]" 1
1950 1 93 SER QB 1 95 GLN H . . 5.340 5.252 5.064 5.351 0.011 17 0 "[ . 1 . 2]" 1
1951 1 93 SER HB2 1 94 ALA H . . 4.060 2.792 2.170 3.546 . 0 0 "[ . 1 . 2]" 1
1952 1 93 SER HB3 1 94 ALA H . . 4.060 2.689 2.044 3.719 . 0 0 "[ . 1 . 2]" 1
1953 1 94 ALA H 1 94 ALA MB . . 3.030 2.109 2.025 2.210 . 0 0 "[ . 1 . 2]" 1
1954 1 94 ALA H 1 95 GLN H . . 4.560 4.443 4.362 4.541 . 0 0 "[ . 1 . 2]" 1
1955 1 94 ALA HA 1 95 GLN H . . 3.410 2.148 2.142 2.159 . 0 0 "[ . 1 . 2]" 1
1956 1 94 ALA HA 1 96 GLU H . . 4.460 4.112 3.801 4.392 . 0 0 "[ . 1 . 2]" 1
1957 1 94 ALA MB 1 95 GLN H . . 3.970 3.309 3.114 3.406 . 0 0 "[ . 1 . 2]" 1
1958 1 94 ALA MB 1 97 PRO HA . . 4.580 3.097 2.939 3.306 . 0 0 "[ . 1 . 2]" 1
1959 1 95 GLN H 1 95 GLN HB2 . . 3.900 2.978 2.344 3.601 . 0 0 "[ . 1 . 2]" 1
1960 1 95 GLN H 1 95 GLN QB . . 3.330 2.456 2.213 2.581 . 0 0 "[ . 1 . 2]" 1
1961 1 95 GLN H 1 95 GLN HB3 . . 3.900 2.924 2.366 3.591 . 0 0 "[ . 1 . 2]" 1
1962 1 95 GLN H 1 95 GLN QG . . 4.140 2.575 1.894 4.056 . 0 0 "[ . 1 . 2]" 1
1963 1 95 GLN HA 1 95 GLN QG . . 3.690 2.934 2.240 3.458 . 0 0 "[ . 1 . 2]" 1
1964 1 95 GLN QB 1 96 GLU H . . 3.510 2.657 2.030 3.432 . 0 0 "[ . 1 . 2]" 1
1965 1 95 GLN QG 1 96 GLU H . . 3.820 2.979 1.776 3.818 . 0 0 "[ . 1 . 2]" 1
1966 1 96 GLU H 1 96 GLU HB2 . . 3.470 2.881 2.326 3.187 . 0 0 "[ . 1 . 2]" 1
1967 1 96 GLU H 1 96 GLU QB . . 3.020 2.552 2.295 2.648 . 0 0 "[ . 1 . 2]" 1
1968 1 96 GLU H 1 96 GLU HB3 . . 3.470 2.903 2.704 3.523 0.053 9 0 "[ . 1 . 2]" 1
1969 1 96 GLU H 1 97 PRO HD2 . . 4.630 4.494 4.397 4.681 0.051 9 0 "[ . 1 . 2]" 1
1970 1 96 GLU H 1 97 PRO HD3 . . 4.350 3.987 3.815 4.348 . 0 0 "[ . 1 . 2]" 1
1971 1 96 GLU HA 1 96 GLU QG . . 3.740 2.333 2.156 2.521 . 0 0 "[ . 1 . 2]" 1
1972 1 96 GLU HA 1 97 PRO HD2 . . 3.470 1.918 1.912 1.951 . 0 0 "[ . 1 . 2]" 1
1973 1 96 GLU HA 1 97 PRO HD3 . . 3.250 2.516 2.356 2.562 . 0 0 "[ . 1 . 2]" 1
1974 1 96 GLU QB 1 97 PRO HD2 . . 3.980 3.953 3.548 4.023 0.043 10 0 "[ . 1 . 2]" 1
1975 1 96 GLU QB 1 97 PRO HD3 . . 4.640 4.469 4.351 4.487 . 0 0 "[ . 1 . 2]" 1
1976 1 96 GLU HB2 1 97 PRO HD2 . . 4.570 4.415 4.044 4.620 0.050 9 0 "[ . 1 . 2]" 1
1977 1 96 GLU HB2 1 97 PRO HD3 . . 5.280 4.993 4.824 5.149 . 0 0 "[ . 1 . 2]" 1
1978 1 96 GLU HB3 1 97 PRO HD2 . . 4.570 4.488 3.687 4.609 0.039 16 0 "[ . 1 . 2]" 1
1979 1 96 GLU HB3 1 97 PRO HD3 . . 5.280 5.047 4.691 5.104 . 0 0 "[ . 1 . 2]" 1
1980 1 96 GLU QG 1 97 PRO HD2 . . 4.280 3.050 2.562 3.177 . 0 0 "[ . 1 . 2]" 1
1981 1 96 GLU HG2 1 97 PRO HD2 . . 4.910 3.557 3.044 4.791 . 0 0 "[ . 1 . 2]" 1
1982 1 96 GLU HG3 1 97 PRO HD2 . . 4.910 3.515 2.651 4.773 . 0 0 "[ . 1 . 2]" 1
1983 1 97 PRO HA 1 98 ASP H . . 2.930 2.498 2.373 2.666 . 0 0 "[ . 1 . 2]" 1
1984 1 97 PRO QB 1 98 ASP H . . 3.530 2.332 1.992 2.599 . 0 0 "[ . 1 . 2]" 1
1985 1 97 PRO QB 1 102 MET QG . . 3.710 2.814 2.494 3.053 . 0 0 "[ . 1 . 2]" 1
1986 1 97 PRO HB2 1 98 ASP H . . 4.090 2.382 2.013 2.681 . 0 0 "[ . 1 . 2]" 1
1987 1 97 PRO HB2 1 102 MET HG2 . . 4.940 3.134 2.621 3.603 . 0 0 "[ . 1 . 2]" 1
1988 1 97 PRO HB2 1 102 MET HG3 . . 4.940 3.425 3.019 3.812 . 0 0 "[ . 1 . 2]" 1
1989 1 97 PRO HB3 1 98 ASP H . . 4.090 3.343 3.185 3.488 . 0 0 "[ . 1 . 2]" 1
1990 1 97 PRO HB3 1 102 MET HG2 . . 4.940 4.521 3.974 4.941 0.001 10 0 "[ . 1 . 2]" 1
1991 1 97 PRO HB3 1 102 MET HG3 . . 4.940 4.767 4.281 4.955 0.015 20 0 "[ . 1 . 2]" 1
1992 1 97 PRO QG 1 102 MET QG . . 3.820 2.902 2.503 3.307 . 0 0 "[ . 1 . 2]" 1
1993 1 98 ASP H 1 98 ASP HB2 . . 3.670 2.465 2.209 3.522 . 0 0 "[ . 1 . 2]" 1
1994 1 98 ASP H 1 98 ASP QB . . 3.120 2.374 2.186 2.855 . 0 0 "[ . 1 . 2]" 1
1995 1 98 ASP H 1 98 ASP HB3 . . 3.670 3.357 2.684 3.640 . 0 0 "[ . 1 . 2]" 1
1996 1 98 ASP H 1 99 LYS HA . . 5.500 5.372 5.225 5.479 . 0 0 "[ . 1 . 2]" 1
1997 1 98 ASP H 1 101 SER QB . . 4.260 3.687 3.108 4.268 0.008 7 0 "[ . 1 . 2]" 1
1998 1 98 ASP H 1 102 MET QG . . 5.100 4.118 3.760 4.406 . 0 0 "[ . 1 . 2]" 1
1999 1 98 ASP HA 1 99 LYS H . . 3.160 2.167 2.138 2.224 . 0 0 "[ . 1 . 2]" 1
2000 1 98 ASP HA 1 99 LYS QB . . 4.310 4.188 4.055 4.320 0.010 8 0 "[ . 1 . 2]" 1
2001 1 98 ASP HA 1 100 LEU H . . 4.520 3.886 3.515 4.143 . 0 0 "[ . 1 . 2]" 1
2002 1 98 ASP HA 1 101 SER H . . 5.250 4.724 4.324 5.028 . 0 0 "[ . 1 . 2]" 1
2003 1 98 ASP QB 1 99 LYS H . . 4.130 3.466 2.893 3.931 . 0 0 "[ . 1 . 2]" 1
2004 1 98 ASP QB 1 101 SER H . . 3.670 2.443 2.256 2.644 . 0 0 "[ . 1 . 2]" 1
2005 1 98 ASP QB 1 101 SER QB . . 3.490 2.239 1.848 2.973 . 0 0 "[ . 1 . 2]" 1
2006 1 98 ASP QB 1 102 MET H . . 4.460 3.753 3.339 4.106 . 0 0 "[ . 1 . 2]" 1
2007 1 98 ASP HB2 1 99 LYS H . . 4.760 4.310 3.242 4.579 . 0 0 "[ . 1 . 2]" 1
2008 1 98 ASP HB2 1 100 LEU H . . 5.120 4.373 3.224 5.018 . 0 0 "[ . 1 . 2]" 1
2009 1 98 ASP HB2 1 101 SER HB2 . . 4.920 2.899 2.039 4.271 . 0 0 "[ . 1 . 2]" 1
2010 1 98 ASP HB2 1 101 SER HB3 . . 4.920 3.521 2.000 4.931 0.011 13 0 "[ . 1 . 2]" 1
2011 1 98 ASP HB3 1 99 LYS H . . 4.760 3.692 2.957 4.308 . 0 0 "[ . 1 . 2]" 1
2012 1 98 ASP HB3 1 100 LEU H . . 5.120 3.368 2.721 4.688 . 0 0 "[ . 1 . 2]" 1
2013 1 98 ASP HB3 1 101 SER HB2 . . 4.920 3.304 1.992 4.917 . 0 0 "[ . 1 . 2]" 1
2014 1 98 ASP HB3 1 101 SER HB3 . . 4.920 4.055 2.140 4.922 0.002 18 0 "[ . 1 . 2]" 1
2015 1 99 LYS H 1 99 LYS QB . . 3.340 2.359 2.188 2.603 . 0 0 "[ . 1 . 2]" 1
2016 1 99 LYS H 1 99 LYS QG . . 4.500 3.062 2.031 4.031 . 0 0 "[ . 1 . 2]" 1
2017 1 99 LYS H 1 100 LEU H . . 3.690 2.798 2.380 3.060 . 0 0 "[ . 1 . 2]" 1
2018 1 99 LYS HA 1 99 LYS QG . . 3.680 2.740 2.178 3.385 . 0 0 "[ . 1 . 2]" 1
2019 1 99 LYS HA 1 102 MET H . . 4.440 3.751 3.509 4.025 . 0 0 "[ . 1 . 2]" 1
2020 1 99 LYS HA 1 102 MET HB2 . . 4.500 2.703 2.371 3.042 . 0 0 "[ . 1 . 2]" 1
2021 1 99 LYS HA 1 102 MET QB . . 3.860 2.670 2.350 2.995 . 0 0 "[ . 1 . 2]" 1
2022 1 99 LYS HA 1 102 MET HB3 . . 4.500 4.149 3.833 4.475 . 0 0 "[ . 1 . 2]" 1
2023 1 99 LYS HA 1 102 MET QG . . 4.790 3.558 3.106 3.836 . 0 0 "[ . 1 . 2]" 1
2024 1 99 LYS HA 1 103 VAL H . . 4.340 4.092 3.739 4.320 . 0 0 "[ . 1 . 2]" 1
2025 1 99 LYS QB 1 100 LEU H . . 3.650 2.877 2.330 3.587 . 0 0 "[ . 1 . 2]" 1
2026 1 99 LYS QG 1 100 LEU H . . 4.310 3.286 1.944 4.312 0.002 17 0 "[ . 1 . 2]" 1
2027 1 100 LEU H 1 100 LEU HB2 . . 3.500 2.239 2.130 2.616 . 0 0 "[ . 1 . 2]" 1
2028 1 100 LEU H 1 100 LEU QB . . 2.920 2.161 2.086 2.241 . 0 0 "[ . 1 . 2]" 1
2029 1 100 LEU H 1 100 LEU HB3 . . 3.500 3.249 2.414 3.514 0.014 10 0 "[ . 1 . 2]" 1
2030 1 100 LEU H 1 100 LEU MD1 . . 4.210 3.732 2.142 4.259 0.049 13 0 "[ . 1 . 2]" 1
2031 1 100 LEU H 1 100 LEU MD2 . . 4.430 2.935 1.898 4.277 . 0 0 "[ . 1 . 2]" 1
2032 1 100 LEU H 1 100 LEU HG . . 4.450 4.088 3.671 4.492 0.042 13 0 "[ . 1 . 2]" 1
2033 1 100 LEU H 1 101 SER H . . 3.310 2.906 2.687 3.116 . 0 0 "[ . 1 . 2]" 1
2034 1 100 LEU H 1 103 VAL MG2 . . 5.470 4.477 4.151 4.772 . 0 0 "[ . 1 . 2]" 1
2035 1 100 LEU HA 1 100 LEU MD1 . . 3.620 2.292 1.957 2.990 . 0 0 "[ . 1 . 2]" 1
2036 1 100 LEU HA 1 100 LEU MD2 . . 3.580 2.743 1.946 3.599 0.019 3 0 "[ . 1 . 2]" 1
2037 1 100 LEU HA 1 100 LEU HG . . 4.110 3.441 2.262 3.694 . 0 0 "[ . 1 . 2]" 1
2038 1 100 LEU HA 1 102 MET H . . 4.880 4.171 3.751 4.511 . 0 0 "[ . 1 . 2]" 1
2039 1 100 LEU HA 1 103 VAL H . . 4.380 3.439 3.145 3.675 . 0 0 "[ . 1 . 2]" 1
2040 1 100 LEU HA 1 103 VAL HB . . 3.630 2.808 2.578 3.218 . 0 0 "[ . 1 . 2]" 1
2041 1 100 LEU HA 1 103 VAL MG2 . . 4.060 3.112 2.732 3.494 . 0 0 "[ . 1 . 2]" 1
2042 1 100 LEU QB 1 100 LEU MD2 . . 3.230 2.213 2.031 2.474 . 0 0 "[ . 1 . 2]" 1
2043 1 100 LEU QB 1 101 SER H . . 3.250 2.229 1.978 2.398 . 0 0 "[ . 1 . 2]" 1
2044 1 100 LEU HB2 1 101 SER H . . 4.000 2.743 2.329 3.621 . 0 0 "[ . 1 . 2]" 1
2045 1 100 LEU HB3 1 101 SER H . . 4.000 2.568 1.996 2.949 . 0 0 "[ . 1 . 2]" 1
2046 1 100 LEU MD1 1 103 VAL HB . . 5.110 3.664 2.793 5.113 0.003 9 0 "[ . 1 . 2]" 1
2047 1 101 SER H 1 101 SER HB2 . . 3.660 2.547 2.222 3.595 . 0 0 "[ . 1 . 2]" 1
2048 1 101 SER H 1 101 SER QB . . 3.020 2.341 2.159 2.617 . 0 0 "[ . 1 . 2]" 1
2049 1 101 SER H 1 101 SER HB3 . . 3.660 3.138 2.300 3.621 . 0 0 "[ . 1 . 2]" 1
2050 1 101 SER HA 1 104 MET H . . 4.160 3.976 3.761 4.163 0.003 18 0 "[ . 1 . 2]" 1
2051 1 101 SER HA 1 104 MET HB2 . . 4.640 4.635 4.566 4.664 0.024 13 0 "[ . 1 . 2]" 1
2052 1 101 SER HA 1 104 MET QB . . 3.920 3.739 3.500 3.846 . 0 0 "[ . 1 . 2]" 1
2053 1 101 SER HA 1 104 MET HB3 . . 4.640 3.947 3.635 4.105 . 0 0 "[ . 1 . 2]" 1
2054 1 101 SER HA 1 104 MET ME . . 4.410 3.040 1.945 3.936 . 0 0 "[ . 1 . 2]" 1
2055 1 101 SER HA 1 104 MET HG2 . . 4.690 2.010 1.986 2.069 . 0 0 "[ . 1 . 2]" 1
2056 1 101 SER HA 1 104 MET HG3 . . 4.690 3.185 2.987 3.472 . 0 0 "[ . 1 . 2]" 1
2057 1 101 SER HA 1 105 TYR H . . 4.620 4.219 3.873 4.549 . 0 0 "[ . 1 . 2]" 1
2058 1 101 SER QB 1 102 MET H . . 3.670 2.767 2.482 3.547 . 0 0 "[ . 1 . 2]" 1
2059 1 101 SER HB2 1 102 MET H . . 4.420 3.329 2.661 4.036 . 0 0 "[ . 1 . 2]" 1
2060 1 101 SER HB3 1 102 MET H . . 4.420 3.295 2.514 4.025 . 0 0 "[ . 1 . 2]" 1
2061 1 102 MET H 1 102 MET HB2 . . 3.840 2.212 2.164 2.285 . 0 0 "[ . 1 . 2]" 1
2062 1 102 MET H 1 102 MET QB . . 3.210 2.190 2.144 2.260 . 0 0 "[ . 1 . 2]" 1
2063 1 102 MET H 1 102 MET HB3 . . 3.840 3.509 3.477 3.558 . 0 0 "[ . 1 . 2]" 1
2064 1 102 MET H 1 102 MET ME . . 4.750 4.296 3.969 4.603 . 0 0 "[ . 1 . 2]" 1
2065 1 102 MET H 1 102 MET QG . . 3.460 2.834 2.675 2.982 . 0 0 "[ . 1 . 2]" 1
2066 1 102 MET H 1 103 VAL H . . 3.580 2.664 2.479 2.852 . 0 0 "[ . 1 . 2]" 1
2067 1 102 MET H 1 103 VAL MG2 . . 5.380 4.251 4.031 4.459 . 0 0 "[ . 1 . 2]" 1
2068 1 102 MET HA 1 102 MET ME . . 3.740 2.210 1.818 2.717 . 0 0 "[ . 1 . 2]" 1
2069 1 102 MET HA 1 105 TYR H . . 3.980 3.699 3.482 3.933 . 0 0 "[ . 1 . 2]" 1
2070 1 102 MET HA 1 105 TYR HB2 . . 4.310 3.728 3.391 3.998 . 0 0 "[ . 1 . 2]" 1
2071 1 102 MET HA 1 105 TYR QB . . 3.730 2.889 2.589 3.106 . 0 0 "[ . 1 . 2]" 1
2072 1 102 MET HA 1 105 TYR HB3 . . 4.310 3.020 2.636 3.282 . 0 0 "[ . 1 . 2]" 1
2073 1 102 MET HA 1 106 LEU H . . 4.420 3.953 3.754 4.316 . 0 0 "[ . 1 . 2]" 1
2074 1 102 MET QB 1 102 MET ME . . 3.220 2.316 1.931 3.115 . 0 0 "[ . 1 . 2]" 1
2075 1 102 MET QB 1 103 VAL H . . 3.130 2.469 2.353 2.598 . 0 0 "[ . 1 . 2]" 1
2076 1 102 MET QB 1 103 VAL HA . . 4.330 3.782 3.730 3.830 . 0 0 "[ . 1 . 2]" 1
2077 1 102 MET QB 1 106 LEU MD1 . . 3.970 2.623 2.093 2.961 . 0 0 "[ . 1 . 2]" 1
2078 1 102 MET HB2 1 102 MET ME . . 3.930 3.511 3.318 3.933 0.003 13 0 "[ . 1 . 2]" 1
2079 1 102 MET HB2 1 103 VAL H . . 3.940 2.592 2.469 2.732 . 0 0 "[ . 1 . 2]" 1
2080 1 102 MET HB3 1 102 MET ME . . 3.930 2.361 1.943 3.265 . 0 0 "[ . 1 . 2]" 1
2081 1 102 MET HB3 1 103 VAL H . . 3.940 3.110 2.908 3.282 . 0 0 "[ . 1 . 2]" 1
2082 1 102 MET ME 1 102 MET HG2 . . 3.940 2.900 2.137 3.393 . 0 0 "[ . 1 . 2]" 1
2083 1 102 MET ME 1 102 MET QG . . 3.340 2.430 2.112 2.599 . 0 0 "[ . 1 . 2]" 1
2084 1 102 MET ME 1 102 MET HG3 . . 3.940 2.974 2.512 3.401 . 0 0 "[ . 1 . 2]" 1
2085 1 102 MET ME 1 105 TYR H . . 4.920 4.648 4.184 4.916 . 0 0 "[ . 1 . 2]" 1
2086 1 102 MET ME 1 105 TYR QD . . 4.090 3.300 2.767 3.833 . 0 0 "[ . 1 . 2]" 1
2087 1 102 MET ME 1 105 TYR QE . . 5.500 4.642 3.947 5.331 . 0 0 "[ . 1 . 2]" 1
2088 1 102 MET ME 1 106 LEU MD1 . . 3.320 2.600 1.964 3.335 0.015 13 0 "[ . 1 . 2]" 1
2089 1 102 MET ME 1 106 LEU MD2 . . 3.800 2.710 2.109 3.439 . 0 0 "[ . 1 . 2]" 1
2090 1 102 MET ME 1 106 LEU HG . . 3.970 2.420 2.060 3.086 . 0 0 "[ . 1 . 2]" 1
2091 1 102 MET QG 1 103 VAL H . . 4.340 4.229 4.140 4.310 . 0 0 "[ . 1 . 2]" 1
2092 1 102 MET HG2 1 103 VAL H . . 4.970 4.649 4.497 4.767 . 0 0 "[ . 1 . 2]" 1
2093 1 102 MET HG3 1 103 VAL H . . 4.970 4.864 4.696 4.967 . 0 0 "[ . 1 . 2]" 1
2094 1 103 VAL H 1 103 VAL HB . . 3.530 2.517 2.423 2.590 . 0 0 "[ . 1 . 2]" 1
2095 1 103 VAL H 1 103 VAL MG2 . . 3.250 2.203 2.016 2.397 . 0 0 "[ . 1 . 2]" 1
2096 1 103 VAL H 1 104 MET H . . 3.540 2.851 2.688 3.064 . 0 0 "[ . 1 . 2]" 1
2097 1 103 VAL H 1 105 TYR H . . 5.250 4.093 3.986 4.231 . 0 0 "[ . 1 . 2]" 1
2098 1 103 VAL HA 1 103 VAL MG1 . . 3.390 2.429 2.287 2.493 . 0 0 "[ . 1 . 2]" 1
2099 1 103 VAL HA 1 103 VAL MG2 . . 3.250 2.342 2.189 2.415 . 0 0 "[ . 1 . 2]" 1
2100 1 103 VAL HA 1 106 LEU H . . 4.510 3.593 3.028 3.866 . 0 0 "[ . 1 . 2]" 1
2101 1 103 VAL HA 1 106 LEU QB . . 4.050 2.727 2.272 2.990 . 0 0 "[ . 1 . 2]" 1
2102 1 103 VAL HA 1 106 LEU MD1 . . 4.510 2.488 1.987 3.105 . 0 0 "[ . 1 . 2]" 1
2103 1 103 VAL HA 1 107 SER H . . 4.580 3.789 3.418 4.279 . 0 0 "[ . 1 . 2]" 1
2104 1 103 VAL HB 1 104 MET H . . 3.040 2.351 2.118 2.666 . 0 0 "[ . 1 . 2]" 1
2105 1 103 VAL MG1 1 104 MET H . . 3.790 3.140 2.852 3.397 . 0 0 "[ . 1 . 2]" 1
2106 1 103 VAL MG2 1 104 MET H . . 4.080 3.778 3.662 3.939 . 0 0 "[ . 1 . 2]" 1
2107 1 104 MET H 1 104 MET HB2 . . 3.610 3.587 3.550 3.611 0.001 10 0 "[ . 1 . 2]" 1
2108 1 104 MET H 1 104 MET QB . . 3.030 2.407 2.272 2.503 . 0 0 "[ . 1 . 2]" 1
2109 1 104 MET H 1 104 MET HB3 . . 3.610 2.446 2.300 2.555 . 0 0 "[ . 1 . 2]" 1
2110 1 104 MET H 1 104 MET HG2 . . 3.860 2.360 2.173 2.583 . 0 0 "[ . 1 . 2]" 1
2111 1 104 MET H 1 104 MET QG . . 3.360 2.315 2.132 2.536 . 0 0 "[ . 1 . 2]" 1
2112 1 104 MET H 1 104 MET HG3 . . 3.860 3.365 3.042 3.701 . 0 0 "[ . 1 . 2]" 1
2113 1 104 MET HA 1 104 MET HG2 . . 3.900 3.817 3.769 3.869 . 0 0 "[ . 1 . 2]" 1
2114 1 104 MET HA 1 104 MET QG . . 3.400 3.334 3.308 3.338 . 0 0 "[ . 1 . 2]" 1
2115 1 104 MET HA 1 104 MET HG3 . . 3.900 3.678 3.626 3.720 . 0 0 "[ . 1 . 2]" 1
2116 1 104 MET QB 1 104 MET ME . . 3.390 2.499 1.934 3.369 . 0 0 "[ . 1 . 2]" 1
2117 1 104 MET QB 1 105 TYR H . . 3.570 3.442 3.351 3.568 . 0 0 "[ . 1 . 2]" 1
2118 1 104 MET HB2 1 105 TYR H . . 4.060 3.826 3.704 4.061 0.001 3 0 "[ . 1 . 2]" 1
2119 1 104 MET HB3 1 105 TYR H . . 4.060 3.909 3.776 4.027 . 0 0 "[ . 1 . 2]" 1
2120 1 104 MET QG 1 105 TYR H . . 4.430 2.078 1.931 2.308 . 0 0 "[ . 1 . 2]" 1
2121 1 104 MET QG 1 105 TYR HA . . 4.610 3.241 3.045 3.455 . 0 0 "[ . 1 . 2]" 1
2122 1 104 MET QG 1 105 TYR QB . . 4.290 2.846 2.748 2.950 . 0 0 "[ . 1 . 2]" 1
2123 1 104 MET HG2 1 105 TYR H . . 5.080 2.664 2.275 2.989 . 0 0 "[ . 1 . 2]" 1
2124 1 104 MET HG3 1 105 TYR H . . 5.080 2.202 1.972 2.721 . 0 0 "[ . 1 . 2]" 1
2125 1 105 TYR H 1 105 TYR HB2 . . 3.230 2.534 2.434 2.676 . 0 0 "[ . 1 . 2]" 1
2126 1 105 TYR H 1 105 TYR HB3 . . 3.230 2.575 2.411 2.703 . 0 0 "[ . 1 . 2]" 1
2127 1 105 TYR H 1 105 TYR QD . . 4.370 4.195 4.166 4.227 . 0 0 "[ . 1 . 2]" 1
2128 1 105 TYR H 1 106 LEU H . . 3.530 2.689 2.396 2.901 . 0 0 "[ . 1 . 2]" 1
2129 1 105 TYR H 1 106 LEU HG . . 4.660 4.470 4.242 4.660 . 0 0 "[ . 1 . 2]" 1
2130 1 105 TYR H 1 107 SER H . . 4.520 4.046 3.834 4.352 . 0 0 "[ . 1 . 2]" 1
2131 1 105 TYR HA 1 105 TYR QD . . 3.340 2.630 2.323 2.857 . 0 0 "[ . 1 . 2]" 1
2132 1 105 TYR HA 1 108 LYS H . . 4.500 3.755 3.588 3.888 . 0 0 "[ . 1 . 2]" 1
2133 1 105 TYR HA 1 108 LYS QD . . 4.280 3.427 2.090 4.274 . 0 0 "[ . 1 . 2]" 1
2134 1 105 TYR HA 1 108 LYS HG2 . . 4.870 4.063 2.639 4.870 . 0 0 "[ . 1 . 2]" 1
2135 1 105 TYR HA 1 108 LYS QG . . 4.150 2.754 2.114 3.813 . 0 0 "[ . 1 . 2]" 1
2136 1 105 TYR HA 1 108 LYS HG3 . . 4.870 2.895 2.130 4.873 0.003 17 0 "[ . 1 . 2]" 1
2137 1 105 TYR QB 1 106 LEU H . . 3.330 2.240 1.969 2.559 . 0 0 "[ . 1 . 2]" 1
2138 1 105 TYR QB 1 108 LYS H . . 5.340 5.149 5.005 5.342 0.002 18 0 "[ . 1 . 2]" 1
2139 1 105 TYR HB2 1 106 LEU H . . 3.950 3.647 3.471 3.906 . 0 0 "[ . 1 . 2]" 1
2140 1 105 TYR HB3 1 106 LEU H . . 3.950 2.263 1.980 2.603 . 0 0 "[ . 1 . 2]" 1
2141 1 105 TYR QD 1 105 TYR HH . . 4.630 4.297 4.242 4.353 . 0 0 "[ . 1 . 2]" 1
2142 1 105 TYR QD 1 106 LEU H . . 4.110 3.333 2.677 4.051 . 0 0 "[ . 1 . 2]" 1
2143 1 105 TYR QD 1 106 LEU HA . . 4.920 3.445 3.026 4.080 . 0 0 "[ . 1 . 2]" 1
2144 1 105 TYR QD 1 106 LEU MD2 . . 3.900 3.228 2.798 3.838 . 0 0 "[ . 1 . 2]" 1
2145 1 105 TYR QD 1 106 LEU HG . . 4.210 3.405 2.688 3.980 . 0 0 "[ . 1 . 2]" 1
2146 1 105 TYR QE 1 108 LYS QD . . 5.500 4.259 3.284 5.501 0.001 10 0 "[ . 1 . 2]" 1
2147 1 105 TYR QE 1 109 PHE QE . . 4.040 2.205 1.996 2.547 . 0 0 "[ . 1 . 2]" 1
2148 1 105 TYR QE 1 109 PHE HZ . . 4.230 3.501 2.979 3.986 . 0 0 "[ . 1 . 2]" 1
2149 1 106 LEU H 1 106 LEU HB2 . . 3.820 2.534 2.381 2.701 . 0 0 "[ . 1 . 2]" 1
2150 1 106 LEU H 1 106 LEU QB . . 3.260 2.483 2.348 2.627 . 0 0 "[ . 1 . 2]" 1
2151 1 106 LEU H 1 106 LEU HB3 . . 3.820 3.586 3.570 3.607 . 0 0 "[ . 1 . 2]" 1
2152 1 106 LEU H 1 106 LEU MD1 . . 4.020 3.380 3.220 3.501 . 0 0 "[ . 1 . 2]" 1
2153 1 106 LEU H 1 106 LEU MD2 . . 4.020 3.483 3.134 3.759 . 0 0 "[ . 1 . 2]" 1
2154 1 106 LEU H 1 106 LEU HG . . 3.320 2.180 1.899 2.432 . 0 0 "[ . 1 . 2]" 1
2155 1 106 LEU H 1 107 SER H . . 3.540 2.861 2.614 3.011 . 0 0 "[ . 1 . 2]" 1
2156 1 106 LEU H 1 108 LYS H . . 5.080 4.447 4.259 4.582 . 0 0 "[ . 1 . 2]" 1
2157 1 106 LEU HA 1 106 LEU MD1 . . 4.410 3.909 3.880 3.958 . 0 0 "[ . 1 . 2]" 1
2158 1 106 LEU HA 1 106 LEU MD2 . . 3.270 2.257 2.009 2.492 . 0 0 "[ . 1 . 2]" 1
2159 1 106 LEU HA 1 106 LEU HG . . 4.150 2.932 2.765 3.117 . 0 0 "[ . 1 . 2]" 1
2160 1 106 LEU HA 1 108 LYS H . . 4.590 4.185 3.925 4.521 . 0 0 "[ . 1 . 2]" 1
2161 1 106 LEU HA 1 109 PHE H . . 4.100 3.473 3.303 3.664 . 0 0 "[ . 1 . 2]" 1
2162 1 106 LEU HA 1 109 PHE HB2 . . 4.590 3.443 2.986 4.026 . 0 0 "[ . 1 . 2]" 1
2163 1 106 LEU HA 1 109 PHE QD . . 3.420 2.440 2.027 3.148 . 0 0 "[ . 1 . 2]" 1
2164 1 106 LEU HA 1 109 PHE QE . . 4.510 3.999 3.689 4.474 . 0 0 "[ . 1 . 2]" 1
2165 1 106 LEU HA 1 110 TYR H . . 5.110 4.326 3.956 4.660 . 0 0 "[ . 1 . 2]" 1
2166 1 106 LEU QB 1 106 LEU MD2 . . 3.220 2.175 2.072 2.312 . 0 0 "[ . 1 . 2]" 1
2167 1 106 LEU QB 1 107 SER H . . 3.570 2.466 2.334 2.860 . 0 0 "[ . 1 . 2]" 1
2168 1 106 LEU QB 1 107 SER HA . . 5.290 3.810 3.774 3.924 . 0 0 "[ . 1 . 2]" 1
2169 1 106 LEU QB 1 109 PHE H . . 5.340 4.628 4.520 4.759 . 0 0 "[ . 1 . 2]" 1
2170 1 106 LEU QB 1 109 PHE HB2 . . 5.340 4.226 3.906 4.651 . 0 0 "[ . 1 . 2]" 1
2171 1 106 LEU HB2 1 106 LEU MD1 . . 3.530 2.153 2.034 2.254 . 0 0 "[ . 1 . 2]" 1
2172 1 106 LEU HB2 1 107 SER H . . 4.180 2.518 2.368 2.948 . 0 0 "[ . 1 . 2]" 1
2173 1 106 LEU HB3 1 106 LEU MD1 . . 3.530 2.532 2.420 2.624 . 0 0 "[ . 1 . 2]" 1
2174 1 106 LEU HB3 1 107 SER H . . 4.180 3.539 3.285 3.856 . 0 0 "[ . 1 . 2]" 1
2175 1 106 LEU MD1 1 107 SER H . . 4.950 4.261 4.049 4.617 . 0 0 "[ . 1 . 2]" 1
2176 1 106 LEU MD2 1 107 SER H . . 5.090 4.727 4.617 4.877 . 0 0 "[ . 1 . 2]" 1
2177 1 106 LEU MD2 1 109 PHE QD . . 4.150 3.227 2.659 4.012 . 0 0 "[ . 1 . 2]" 1
2178 1 106 LEU HG 1 107 SER H . . 4.550 4.357 4.155 4.535 . 0 0 "[ . 1 . 2]" 1
2179 1 107 SER H 1 107 SER HB2 . . 3.690 2.606 2.209 3.613 . 0 0 "[ . 1 . 2]" 1
2180 1 107 SER H 1 107 SER QB . . 3.220 2.309 2.153 2.498 . 0 0 "[ . 1 . 2]" 1
2181 1 107 SER H 1 107 SER HB3 . . 3.690 3.092 2.284 3.606 . 0 0 "[ . 1 . 2]" 1
2182 1 107 SER H 1 108 LYS H . . 3.630 2.950 2.715 3.053 . 0 0 "[ . 1 . 2]" 1
2183 1 107 SER H 1 109 PHE H . . 4.850 4.529 4.245 4.678 . 0 0 "[ . 1 . 2]" 1
2184 1 107 SER HA 1 109 PHE H . . 4.660 4.364 4.140 4.551 . 0 0 "[ . 1 . 2]" 1
2185 1 107 SER HA 1 110 TYR H . . 3.920 3.376 3.148 3.647 . 0 0 "[ . 1 . 2]" 1
2186 1 107 SER HA 1 110 TYR HB2 . . 4.180 3.266 2.892 3.674 . 0 0 "[ . 1 . 2]" 1
2187 1 107 SER HA 1 110 TYR HB3 . . 4.180 2.244 2.004 2.458 . 0 0 "[ . 1 . 2]" 1
2188 1 107 SER HA 1 110 TYR QD . . 4.550 3.556 3.000 4.266 . 0 0 "[ . 1 . 2]" 1
2189 1 107 SER HA 1 111 GLU H . . 4.170 3.763 3.326 4.127 . 0 0 "[ . 1 . 2]" 1
2190 1 107 SER QB 1 108 LYS H . . 3.460 2.698 2.418 3.415 . 0 0 "[ . 1 . 2]" 1
2191 1 107 SER HB2 1 108 LYS H . . 4.270 3.231 2.471 3.927 . 0 0 "[ . 1 . 2]" 1
2192 1 107 SER HB3 1 108 LYS H . . 4.270 3.178 2.470 3.815 . 0 0 "[ . 1 . 2]" 1
2193 1 108 LYS H 1 108 LYS HB2 . . 3.640 2.602 2.451 2.982 . 0 0 "[ . 1 . 2]" 1
2194 1 108 LYS H 1 108 LYS QB . . 3.100 2.542 2.412 2.830 . 0 0 "[ . 1 . 2]" 1
2195 1 108 LYS H 1 108 LYS HB3 . . 3.640 3.591 3.523 3.614 . 0 0 "[ . 1 . 2]" 1
2196 1 108 LYS H 1 108 LYS QD . . 4.220 3.766 1.727 4.121 . 0 0 "[ . 1 . 2]" 1
2197 1 108 LYS H 1 108 LYS HE2 . . 5.500 4.818 3.792 5.512 0.012 9 0 "[ . 1 . 2]" 1
2198 1 108 LYS H 1 108 LYS QE . . 4.720 4.218 3.626 4.658 . 0 0 "[ . 1 . 2]" 1
2199 1 108 LYS H 1 108 LYS HE3 . . 5.500 4.823 3.944 5.491 . 0 0 "[ . 1 . 2]" 1
2200 1 108 LYS H 1 108 LYS HG2 . . 3.580 2.838 1.901 3.742 0.162 17 0 "[ . 1 . 2]" 1
2201 1 108 LYS H 1 108 LYS QG . . 3.130 2.135 1.873 3.144 0.014 17 0 "[ . 1 . 2]" 1
2202 1 108 LYS H 1 108 LYS HG3 . . 3.580 2.480 1.971 3.387 . 0 0 "[ . 1 . 2]" 1
2203 1 108 LYS H 1 109 PHE H . . 3.360 2.921 2.776 3.061 . 0 0 "[ . 1 . 2]" 1
2204 1 108 LYS HA 1 108 LYS QD . . 4.010 3.559 2.117 4.060 0.050 19 0 "[ . 1 . 2]" 1
2205 1 108 LYS HA 1 108 LYS HG2 . . 4.000 2.625 2.348 3.675 . 0 0 "[ . 1 . 2]" 1
2206 1 108 LYS HA 1 108 LYS HG3 . . 4.000 3.327 2.443 3.834 . 0 0 "[ . 1 . 2]" 1
2207 1 108 LYS HA 1 111 GLU H . . 4.550 4.205 3.755 4.534 . 0 0 "[ . 1 . 2]" 1
2208 1 108 LYS HA 1 112 LEU H . . 4.760 4.190 3.774 4.575 . 0 0 "[ . 1 . 2]" 1
2209 1 108 LYS QB 1 108 LYS QE . . 4.350 3.245 2.240 3.763 . 0 0 "[ . 1 . 2]" 1
2210 1 108 LYS QB 1 109 PHE H . . 3.650 2.426 2.298 2.601 . 0 0 "[ . 1 . 2]" 1
2211 1 108 LYS HB2 1 109 PHE H . . 4.310 2.471 2.335 2.669 . 0 0 "[ . 1 . 2]" 1
2212 1 108 LYS HB3 1 109 PHE H . . 4.310 3.538 3.320 3.862 . 0 0 "[ . 1 . 2]" 1
2213 1 108 LYS QD 1 109 PHE H . . 5.190 4.695 3.776 5.006 . 0 0 "[ . 1 . 2]" 1
2214 1 108 LYS QE 1 108 LYS QG . . 2.860 2.171 2.073 2.668 . 0 0 "[ . 1 . 2]" 1
2215 1 108 LYS HE2 1 108 LYS HG2 . . 3.940 2.857 2.279 3.745 . 0 0 "[ . 1 . 2]" 1
2216 1 108 LYS HE2 1 108 LYS HG3 . . 3.940 3.182 2.207 4.140 0.200 18 0 "[ . 1 . 2]" 1
2217 1 108 LYS HE3 1 108 LYS HG2 . . 3.940 2.986 2.143 3.934 . 0 0 "[ . 1 . 2]" 1
2218 1 108 LYS HE3 1 108 LYS HG3 . . 3.940 2.997 2.473 3.870 . 0 0 "[ . 1 . 2]" 1
2219 1 108 LYS QG 1 109 PHE H . . 4.700 3.971 3.521 4.478 . 0 0 "[ . 1 . 2]" 1
2220 1 109 PHE H 1 109 PHE HB2 . . 3.480 2.435 2.339 2.585 . 0 0 "[ . 1 . 2]" 1
2221 1 109 PHE H 1 109 PHE HB3 . . 3.780 3.595 3.572 3.625 . 0 0 "[ . 1 . 2]" 1
2222 1 109 PHE H 1 109 PHE QE . . 4.680 4.503 4.266 4.682 0.002 15 0 "[ . 1 . 2]" 1
2223 1 109 PHE H 1 110 TYR H . . 3.280 2.606 2.464 2.745 . 0 0 "[ . 1 . 2]" 1
2224 1 109 PHE H 1 110 TYR QB . . 4.420 4.253 4.123 4.379 . 0 0 "[ . 1 . 2]" 1
2225 1 109 PHE H 1 111 GLU H . . 4.750 4.413 4.143 4.680 . 0 0 "[ . 1 . 2]" 1
2226 1 109 PHE H 1 112 LEU QB . . 5.340 4.494 4.250 4.764 . 0 0 "[ . 1 . 2]" 1
2227 1 109 PHE HA 1 109 PHE QD . . 4.110 2.434 2.003 2.948 . 0 0 "[ . 1 . 2]" 1
2228 1 109 PHE HA 1 112 LEU H . . 3.950 3.518 3.183 3.889 . 0 0 "[ . 1 . 2]" 1
2229 1 109 PHE HA 1 112 LEU HB2 . . 4.110 3.316 2.787 3.882 . 0 0 "[ . 1 . 2]" 1
2230 1 109 PHE HA 1 112 LEU QB . . 3.530 2.286 2.017 2.532 . 0 0 "[ . 1 . 2]" 1
2231 1 109 PHE HA 1 112 LEU HB3 . . 4.110 2.339 2.057 2.567 . 0 0 "[ . 1 . 2]" 1
2232 1 109 PHE HA 1 112 LEU MD1 . . 5.500 4.683 4.268 5.110 . 0 0 "[ . 1 . 2]" 1
2233 1 109 PHE HA 1 112 LEU MD2 . . 4.230 2.786 2.414 3.142 . 0 0 "[ . 1 . 2]" 1
2234 1 109 PHE HA 1 112 LEU HG . . 5.170 4.570 4.235 4.959 . 0 0 "[ . 1 . 2]" 1
2235 1 109 PHE HA 1 113 PHE H . . 4.470 3.678 3.424 3.963 . 0 0 "[ . 1 . 2]" 1
2236 1 109 PHE HB2 1 110 TYR H . . 3.710 2.483 2.294 2.983 . 0 0 "[ . 1 . 2]" 1
2237 1 109 PHE HB3 1 110 TYR H . . 3.940 3.484 3.293 3.795 . 0 0 "[ . 1 . 2]" 1
2238 1 109 PHE HB3 1 113 PHE QD . . 4.800 2.766 2.109 3.944 . 0 0 "[ . 1 . 2]" 1
2239 1 109 PHE HB3 1 113 PHE QE . . 5.180 2.753 2.041 3.858 . 0 0 "[ . 1 . 2]" 1
2240 1 109 PHE QD 1 113 PHE H . . 5.500 5.169 4.798 5.489 . 0 0 "[ . 1 . 2]" 1
2241 1 110 TYR H 1 110 TYR HB2 . . 3.330 2.646 2.500 2.868 . 0 0 "[ . 1 . 2]" 1
2242 1 110 TYR H 1 110 TYR HB3 . . 3.330 2.456 2.264 2.617 . 0 0 "[ . 1 . 2]" 1
2243 1 110 TYR H 1 110 TYR QD . . 4.450 4.179 4.021 4.211 . 0 0 "[ . 1 . 2]" 1
2244 1 110 TYR H 1 111 GLU H . . 3.630 3.023 2.640 3.137 . 0 0 "[ . 1 . 2]" 1
2245 1 110 TYR H 1 111 GLU QB . . 5.040 4.927 4.625 5.041 0.001 15 0 "[ . 1 . 2]" 1
2246 1 110 TYR H 1 112 LEU H . . 4.830 4.373 3.907 4.662 . 0 0 "[ . 1 . 2]" 1
2247 1 110 TYR HA 1 110 TYR QD . . 3.800 2.782 2.296 3.175 . 0 0 "[ . 1 . 2]" 1
2248 1 110 TYR HA 1 113 PHE H . . 4.660 4.109 3.844 4.313 . 0 0 "[ . 1 . 2]" 1
2249 1 110 TYR HA 1 114 ARG H . . 4.600 3.837 3.623 4.182 . 0 0 "[ . 1 . 2]" 1
2250 1 110 TYR QB 1 111 GLU H . . 3.320 2.373 2.180 2.515 . 0 0 "[ . 1 . 2]" 1
2251 1 110 TYR HB2 1 111 GLU H . . 3.920 3.815 3.684 3.921 0.001 1 0 "[ . 1 . 2]" 1
2252 1 110 TYR HB3 1 111 GLU H . . 3.920 2.397 2.196 2.545 . 0 0 "[ . 1 . 2]" 1
2253 1 110 TYR QD 1 111 GLU H . . 4.010 2.858 2.275 3.643 . 0 0 "[ . 1 . 2]" 1
2254 1 110 TYR QD 1 111 GLU HA . . 4.450 3.362 2.446 4.188 . 0 0 "[ . 1 . 2]" 1
2255 1 110 TYR QD 1 111 GLU HG2 . . 4.620 2.751 2.002 3.617 . 0 0 "[ . 1 . 2]" 1
2256 1 110 TYR QD 1 111 GLU HG3 . . 4.620 3.111 2.014 4.615 . 0 0 "[ . 1 . 2]" 1
2257 1 110 TYR QE 1 114 ARG HB2 . . 4.900 3.901 3.197 4.182 . 0 0 "[ . 1 . 2]" 1
2258 1 110 TYR QE 1 114 ARG HB3 . . 4.900 4.316 3.317 4.875 . 0 0 "[ . 1 . 2]" 1
2259 1 110 TYR QE 1 114 ARG HD2 . . 4.460 3.242 2.012 4.457 . 0 0 "[ . 1 . 2]" 1
2260 1 110 TYR QE 1 114 ARG HD3 . . 4.460 3.137 2.439 4.443 . 0 0 "[ . 1 . 2]" 1
2261 1 110 TYR QE 1 114 ARG HG2 . . 5.500 4.707 3.734 5.269 . 0 0 "[ . 1 . 2]" 1
2262 1 110 TYR QE 1 114 ARG QG . . 4.770 3.917 2.014 4.602 . 0 0 "[ . 1 . 2]" 1
2263 1 110 TYR QE 1 114 ARG HG3 . . 5.500 4.395 2.022 5.216 . 0 0 "[ . 1 . 2]" 1
2264 1 111 GLU H 1 111 GLU QB . . 3.090 2.361 2.189 2.699 . 0 0 "[ . 1 . 2]" 1
2265 1 111 GLU H 1 111 GLU HG2 . . 3.710 3.032 1.979 3.607 . 0 0 "[ . 1 . 2]" 1
2266 1 111 GLU H 1 111 GLU QG . . 3.250 2.423 1.927 2.801 . 0 0 "[ . 1 . 2]" 1
2267 1 111 GLU H 1 111 GLU HG3 . . 3.710 2.892 2.201 3.656 . 0 0 "[ . 1 . 2]" 1
2268 1 111 GLU H 1 112 LEU H . . 3.550 2.723 2.559 2.925 . 0 0 "[ . 1 . 2]" 1
2269 1 111 GLU HA 1 111 GLU HG2 . . 4.000 2.570 2.173 3.750 . 0 0 "[ . 1 . 2]" 1
2270 1 111 GLU HA 1 111 GLU HG3 . . 4.000 3.368 2.837 3.794 . 0 0 "[ . 1 . 2]" 1
2271 1 111 GLU HA 1 113 PHE H . . 5.100 4.643 4.181 4.973 . 0 0 "[ . 1 . 2]" 1
2272 1 111 GLU HA 1 114 ARG H . . 4.470 3.608 3.350 3.852 . 0 0 "[ . 1 . 2]" 1
2273 1 111 GLU HA 1 114 ARG HB2 . . 4.680 3.523 2.598 4.620 . 0 0 "[ . 1 . 2]" 1
2274 1 111 GLU HA 1 114 ARG QB . . 3.990 2.557 2.209 3.254 . 0 0 "[ . 1 . 2]" 1
2275 1 111 GLU HA 1 114 ARG HB3 . . 4.680 2.657 2.247 3.328 . 0 0 "[ . 1 . 2]" 1
2276 1 111 GLU HA 1 114 ARG QD . . 4.530 3.889 3.204 4.519 . 0 0 "[ . 1 . 2]" 1
2277 1 111 GLU QB 1 112 LEU H . . 3.420 2.456 2.230 3.316 . 0 0 "[ . 1 . 2]" 1
2278 1 111 GLU QB 1 112 LEU HA . . 4.770 3.815 3.741 4.154 . 0 0 "[ . 1 . 2]" 1
2279 1 111 GLU QB 1 113 PHE H . . 4.970 4.839 4.681 4.970 . 0 0 "[ . 1 . 2]" 1
2280 1 111 GLU QG 1 112 LEU H . . 4.310 3.978 1.883 4.274 . 0 0 "[ . 1 . 2]" 1
2281 1 111 GLU HG2 1 112 LEU H . . 4.920 4.621 3.055 4.918 . 0 0 "[ . 1 . 2]" 1
2282 1 111 GLU HG3 1 112 LEU H . . 4.920 4.410 1.901 4.910 . 0 0 "[ . 1 . 2]" 1
2283 1 112 LEU H 1 112 LEU HB2 . . 3.230 2.525 2.292 2.656 . 0 0 "[ . 1 . 2]" 1
2284 1 112 LEU H 1 112 LEU HB3 . . 3.230 2.508 2.380 2.737 . 0 0 "[ . 1 . 2]" 1
2285 1 112 LEU H 1 112 LEU MD1 . . 4.340 4.075 3.791 4.218 . 0 0 "[ . 1 . 2]" 1
2286 1 112 LEU H 1 112 LEU MD2 . . 4.320 4.205 4.107 4.280 . 0 0 "[ . 1 . 2]" 1
2287 1 112 LEU H 1 112 LEU HG . . 4.610 4.463 4.399 4.554 . 0 0 "[ . 1 . 2]" 1
2288 1 112 LEU H 1 113 PHE H . . 3.350 2.997 2.722 3.151 . 0 0 "[ . 1 . 2]" 1
2289 1 112 LEU H 1 114 ARG H . . 4.560 4.355 4.202 4.450 . 0 0 "[ . 1 . 2]" 1
2290 1 112 LEU HA 1 112 LEU MD1 . . 3.160 2.289 1.971 2.638 . 0 0 "[ . 1 . 2]" 1
2291 1 112 LEU HA 1 112 LEU MD2 . . 4.210 3.944 3.870 4.003 . 0 0 "[ . 1 . 2]" 1
2292 1 112 LEU QB 1 112 LEU MD1 . . 3.250 2.202 2.043 2.301 . 0 0 "[ . 1 . 2]" 1
2293 1 112 LEU QB 1 113 PHE H . . 3.300 2.326 2.135 2.622 . 0 0 "[ . 1 . 2]" 1
2294 1 112 LEU HB2 1 113 PHE H . . 3.920 3.758 3.556 3.886 . 0 0 "[ . 1 . 2]" 1
2295 1 112 LEU HB3 1 113 PHE H . . 3.920 2.349 2.152 2.669 . 0 0 "[ . 1 . 2]" 1
2296 1 112 LEU MD2 1 113 PHE H . . 4.580 3.744 3.442 4.391 . 0 0 "[ . 1 . 2]" 1
2297 1 112 LEU MD2 1 113 PHE QD . . 4.570 3.584 2.764 4.285 . 0 0 "[ . 1 . 2]" 1
2298 1 112 LEU MD2 1 113 PHE QE . . 4.480 3.291 2.195 3.957 . 0 0 "[ . 1 . 2]" 1
2299 1 112 LEU HG 1 113 PHE H . . 4.190 3.356 2.848 4.129 . 0 0 "[ . 1 . 2]" 1
2300 1 112 LEU HG 1 113 PHE QD . . 4.490 3.993 2.926 4.465 . 0 0 "[ . 1 . 2]" 1
2301 1 113 PHE H 1 113 PHE HB2 . . 3.760 2.328 2.196 2.560 . 0 0 "[ . 1 . 2]" 1
2302 1 113 PHE H 1 113 PHE QB . . 3.200 2.299 2.175 2.511 . 0 0 "[ . 1 . 2]" 1
2303 1 113 PHE H 1 113 PHE HB3 . . 3.760 3.562 3.502 3.656 . 0 0 "[ . 1 . 2]" 1
2304 1 113 PHE H 1 113 PHE QD . . 3.700 2.745 1.897 3.294 . 0 0 "[ . 1 . 2]" 1
2305 1 113 PHE H 1 114 ARG H . . 3.370 2.664 2.397 2.848 . 0 0 "[ . 1 . 2]" 1
2306 1 113 PHE H 1 114 ARG HB2 . . 5.300 4.847 4.522 5.176 . 0 0 "[ . 1 . 2]" 1
2307 1 113 PHE H 1 114 ARG QB . . 4.610 4.385 4.097 4.587 . 0 0 "[ . 1 . 2]" 1
2308 1 113 PHE H 1 114 ARG HB3 . . 5.300 5.031 4.579 5.293 . 0 0 "[ . 1 . 2]" 1
2309 1 113 PHE HA 1 113 PHE QD . . 3.510 2.566 2.139 3.091 . 0 0 "[ . 1 . 2]" 1
2310 1 113 PHE QB 1 114 ARG H . . 3.930 2.440 2.315 2.619 . 0 0 "[ . 1 . 2]" 1
2311 1 113 PHE HB2 1 114 ARG H . . 4.510 2.521 2.350 2.751 . 0 0 "[ . 1 . 2]" 1
2312 1 113 PHE HB3 1 114 ARG H . . 4.510 3.291 3.071 3.579 . 0 0 "[ . 1 . 2]" 1
2313 1 114 ARG H 1 114 ARG HB2 . . 3.220 2.356 2.168 2.626 . 0 0 "[ . 1 . 2]" 1
2314 1 114 ARG H 1 114 ARG HB3 . . 3.220 2.758 2.468 3.013 . 0 0 "[ . 1 . 2]" 1
2315 1 114 ARG H 1 114 ARG QD . . 5.030 4.297 3.818 4.673 . 0 0 "[ . 1 . 2]" 1
2316 1 114 ARG H 1 114 ARG HG2 . . 4.780 4.534 4.351 4.645 . 0 0 "[ . 1 . 2]" 1
2317 1 114 ARG H 1 114 ARG QG . . 4.170 3.949 3.810 4.082 . 0 0 "[ . 1 . 2]" 1
2318 1 114 ARG H 1 114 ARG HG3 . . 4.780 4.363 4.057 4.605 . 0 0 "[ . 1 . 2]" 1
2319 1 114 ARG H 1 115 GLY H . . 4.450 3.747 2.949 4.451 0.001 7 0 "[ . 1 . 2]" 1
2320 1 114 ARG HA 1 114 ARG QD . . 4.740 3.615 2.155 4.168 . 0 0 "[ . 1 . 2]" 1
2321 1 114 ARG HA 1 114 ARG QG . . 3.580 2.338 2.177 2.739 . 0 0 "[ . 1 . 2]" 1
2322 1 114 ARG QB 1 114 ARG QD . . 3.040 2.146 2.012 2.369 . 0 0 "[ . 1 . 2]" 1
2323 1 114 ARG QB 1 115 GLY H . . 4.220 3.164 1.967 4.009 . 0 0 "[ . 1 . 2]" 1
2324 1 114 ARG HB2 1 114 ARG HD2 . . 3.970 2.992 2.111 3.806 . 0 0 "[ . 1 . 2]" 1
2325 1 114 ARG HB2 1 114 ARG HD3 . . 3.970 2.807 2.156 3.686 . 0 0 "[ . 1 . 2]" 1
2326 1 114 ARG HB2 1 115 GLY H . . 4.950 4.093 3.389 4.594 . 0 0 "[ . 1 . 2]" 1
2327 1 114 ARG HB3 1 114 ARG HD2 . . 3.970 3.324 2.442 3.895 . 0 0 "[ . 1 . 2]" 1
2328 1 114 ARG HB3 1 114 ARG HD3 . . 3.970 2.815 2.203 3.581 . 0 0 "[ . 1 . 2]" 1
2329 1 114 ARG HB3 1 115 GLY H . . 4.950 3.384 1.978 4.475 . 0 0 "[ . 1 . 2]" 1
2330 1 114 ARG QG 1 115 GLY H . . 4.600 3.484 2.988 3.981 . 0 0 "[ . 1 . 2]" 1
2331 1 114 ARG HG2 1 115 GLY H . . 5.320 3.847 3.076 4.542 . 0 0 "[ . 1 . 2]" 1
2332 1 114 ARG HG3 1 115 GLY H . . 5.320 4.211 3.175 5.156 . 0 0 "[ . 1 . 2]" 1
2333 1 115 GLY H 1 116 THR H . . 4.090 3.473 2.631 4.090 . 0 0 "[ . 1 . 2]" 1
2334 1 116 THR H 1 116 THR HB . . 3.680 3.148 2.356 3.641 . 0 0 "[ . 1 . 2]" 1
2335 1 116 THR H 1 116 THR MG . . 4.130 2.628 2.178 4.022 . 0 0 "[ . 1 . 2]" 1
2336 1 116 THR HA 1 116 THR MG . . 3.380 2.710 2.098 3.195 . 0 0 "[ . 1 . 2]" 1
2337 1 116 THR HA 1 117 PRO HD2 . . 3.330 2.235 2.171 2.411 . 0 0 "[ . 1 . 2]" 1
2338 1 116 THR HA 1 117 PRO QD . . 2.910 2.002 1.969 2.097 . 0 0 "[ . 1 . 2]" 1
2339 1 116 THR HA 1 117 PRO HD3 . . 3.330 2.261 2.254 2.304 . 0 0 "[ . 1 . 2]" 1
2340 1 116 THR HB 1 117 PRO HD2 . . 4.570 3.156 2.015 3.698 . 0 0 "[ . 1 . 2]" 1
2341 1 116 THR HB 1 117 PRO QD . . 3.740 3.062 2.002 3.557 . 0 0 "[ . 1 . 2]" 1
2342 1 116 THR HB 1 117 PRO HD3 . . 4.570 4.273 3.465 4.645 0.075 14 0 "[ . 1 . 2]" 1
2343 1 116 THR MG 1 117 PRO HD2 . . 4.450 3.175 1.799 3.656 . 0 0 "[ . 1 . 2]" 1
2344 1 116 THR MG 1 117 PRO QD . . 3.670 3.056 1.787 3.502 . 0 0 "[ . 1 . 2]" 1
2345 1 116 THR MG 1 117 PRO HD3 . . 4.450 4.055 3.064 4.500 0.050 17 0 "[ . 1 . 2]" 1
2346 1 117 PRO HA 1 118 LEU H . . 2.960 2.342 2.157 2.621 . 0 0 "[ . 1 . 2]" 1
2347 1 117 PRO HB2 1 118 LEU H . . 4.250 2.901 2.109 3.856 . 0 0 "[ . 1 . 2]" 1
2348 1 117 PRO HB3 1 118 LEU H . . 4.250 3.636 3.224 4.229 . 0 0 "[ . 1 . 2]" 1
2349 1 118 LEU H 1 118 LEU QB . . 3.190 2.549 2.169 3.191 0.001 1 0 "[ . 1 . 2]" 1
2350 1 118 LEU H 1 118 LEU MD1 . . 5.170 3.346 1.824 4.199 . 0 0 "[ . 1 . 2]" 1
2351 1 118 LEU H 1 118 LEU QD . . 4.410 2.855 1.821 3.580 . 0 0 "[ . 1 . 2]" 1
2352 1 118 LEU H 1 118 LEU MD2 . . 5.170 3.543 1.830 4.131 . 0 0 "[ . 1 . 2]" 1
2353 1 118 LEU H 1 118 LEU HG . . 3.250 2.631 1.930 3.234 . 0 0 "[ . 1 . 2]" 1
2354 1 118 LEU HA 1 118 LEU QD . . 4.240 2.876 2.191 3.423 . 0 0 "[ . 1 . 2]" 1
2355 1 118 LEU HA 1 118 LEU HG . . 3.900 3.110 2.427 3.727 . 0 0 "[ . 1 . 2]" 1
2356 1 118 LEU HA 1 119 ARG H . . 3.200 2.314 2.144 2.776 . 0 0 "[ . 1 . 2]" 1
2357 1 118 LEU QB 1 119 ARG H . . 3.900 2.987 2.199 3.874 . 0 0 "[ . 1 . 2]" 1
2358 1 118 LEU MD1 1 119 ARG H . . 5.500 4.401 2.726 5.509 0.009 4 0 "[ . 1 . 2]" 1
2359 1 118 LEU MD2 1 119 ARG H . . 5.500 4.325 2.631 5.438 . 0 0 "[ . 1 . 2]" 1
2360 1 119 ARG H 1 119 ARG HB2 . . 3.980 2.989 2.227 3.904 . 0 0 "[ . 1 . 2]" 1
2361 1 119 ARG H 1 119 ARG QB . . 3.370 2.524 2.155 3.110 . 0 0 "[ . 1 . 2]" 1
2362 1 119 ARG H 1 119 ARG HB3 . . 3.980 3.038 2.324 3.814 . 0 0 "[ . 1 . 2]" 1
2363 1 119 ARG HA 1 120 PRO HD2 . . 3.350 2.166 1.925 2.413 . 0 0 "[ . 1 . 2]" 1
2364 1 119 ARG HA 1 120 PRO HD3 . . 3.350 2.293 2.253 2.592 . 0 0 "[ . 1 . 2]" 1
2365 1 119 ARG QB 1 120 PRO QD . . 3.650 2.767 2.097 3.703 0.053 14 0 "[ . 1 . 2]" 1
2366 1 119 ARG HB2 1 119 ARG QD . . 3.770 2.700 2.148 3.467 . 0 0 "[ . 1 . 2]" 1
2367 1 119 ARG HB3 1 119 ARG QD . . 3.770 2.583 2.092 3.408 . 0 0 "[ . 1 . 2]" 1
2368 1 119 ARG QG 1 120 PRO QD . . 5.210 3.091 1.822 4.094 . 0 0 "[ . 1 . 2]" 1
2369 1 120 PRO HA 1 121 VAL H . . 3.060 2.246 2.151 2.535 . 0 0 "[ . 1 . 2]" 1
2370 1 120 PRO QB 1 121 VAL H . . 4.070 3.232 2.255 3.846 . 0 0 "[ . 1 . 2]" 1
2371 1 121 VAL H 1 121 VAL HB . . 4.070 2.985 2.356 3.738 . 0 0 "[ . 1 . 2]" 1
2372 1 121 VAL H 1 121 VAL MG1 . . 4.600 2.921 1.886 3.845 . 0 0 "[ . 1 . 2]" 1
2373 1 121 VAL H 1 121 VAL QG . . 4.050 2.215 1.882 2.673 . 0 0 "[ . 1 . 2]" 1
2374 1 121 VAL H 1 121 VAL MG2 . . 4.600 2.771 1.934 4.013 . 0 0 "[ . 1 . 2]" 1
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