NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
404274 |
1wyq   |
11126 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1wyq
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 2282
_Distance_constraint_stats_list.Viol_count 707
_Distance_constraint_stats_list.Viol_total 167.641
_Distance_constraint_stats_list.Viol_max 0.172
_Distance_constraint_stats_list.Viol_rms 0.0029
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0119
_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 8 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 LYS 0.118 0.028 17 0 "[ . 1 . 2]"
1 10 ASP 0.012 0.010 12 0 "[ . 1 . 2]"
1 11 ALA 0.042 0.034 17 0 "[ . 1 . 2]"
1 12 LEU 0.039 0.012 12 0 "[ . 1 . 2]"
1 13 LEU 0.011 0.010 17 0 "[ . 1 . 2]"
1 14 LEU 0.051 0.034 17 0 "[ . 1 . 2]"
1 15 TRP 0.020 0.004 20 0 "[ . 1 . 2]"
1 16 CYS 0.076 0.020 17 0 "[ . 1 . 2]"
1 17 GLN 0.020 0.013 13 0 "[ . 1 . 2]"
1 18 MET 0.005 0.004 19 0 "[ . 1 . 2]"
1 19 LYS 0.051 0.024 12 0 "[ . 1 . 2]"
1 20 THR 0.023 0.013 13 0 "[ . 1 . 2]"
1 21 ALA 0.091 0.038 20 0 "[ . 1 . 2]"
1 22 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 TYR 0.274 0.071 12 0 "[ . 1 . 2]"
1 24 PRO 0.244 0.081 12 0 "[ . 1 . 2]"
1 25 ASN 0.006 0.003 14 0 "[ . 1 . 2]"
1 26 VAL 0.319 0.081 12 0 "[ . 1 . 2]"
1 27 ASN 0.172 0.071 19 0 "[ . 1 . 2]"
1 28 VAL 0.196 0.071 19 0 "[ . 1 . 2]"
1 29 HIS 0.007 0.007 13 0 "[ . 1 . 2]"
1 30 ASN 0.066 0.023 19 0 "[ . 1 . 2]"
1 31 PHE 0.205 0.044 12 0 "[ . 1 . 2]"
1 32 THR 0.474 0.039 17 0 "[ . 1 . 2]"
1 33 THR 0.080 0.031 12 0 "[ . 1 . 2]"
1 34 SER 0.212 0.053 6 0 "[ . 1 . 2]"
1 35 TRP 0.100 0.020 17 0 "[ . 1 . 2]"
1 36 ARG 0.153 0.035 12 0 "[ . 1 . 2]"
1 37 ASP 0.080 0.021 19 0 "[ . 1 . 2]"
1 38 GLY 0.007 0.003 6 0 "[ . 1 . 2]"
1 39 LEU 0.004 0.003 19 0 "[ . 1 . 2]"
1 40 ALA 0.030 0.015 12 0 "[ . 1 . 2]"
1 41 PHE 0.046 0.010 19 0 "[ . 1 . 2]"
1 42 ASN 0.098 0.031 16 0 "[ . 1 . 2]"
1 43 ALA 0.162 0.032 16 0 "[ . 1 . 2]"
1 44 ILE 0.200 0.026 19 0 "[ . 1 . 2]"
1 45 VAL 0.458 0.124 16 0 "[ . 1 . 2]"
1 46 HIS 0.180 0.035 16 0 "[ . 1 . 2]"
1 47 LYS 0.219 0.056 18 0 "[ . 1 . 2]"
1 48 HIS 0.288 0.097 16 0 "[ . 1 . 2]"
1 49 ARG 0.463 0.124 16 0 "[ . 1 . 2]"
1 50 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 ASP 0.088 0.033 17 0 "[ . 1 . 2]"
1 52 LEU 0.098 0.046 16 0 "[ . 1 . 2]"
1 53 LEU 0.478 0.037 17 0 "[ . 1 . 2]"
1 54 ASP 0.260 0.037 17 0 "[ . 1 . 2]"
1 55 PHE 0.027 0.008 17 0 "[ . 1 . 2]"
1 56 GLU 0.065 0.021 13 0 "[ . 1 . 2]"
1 57 SER 0.070 0.021 13 0 "[ . 1 . 2]"
1 58 LEU 0.011 0.005 17 0 "[ . 1 . 2]"
1 59 LYS 0.031 0.022 8 0 "[ . 1 . 2]"
1 60 LYS 0.006 0.003 14 0 "[ . 1 . 2]"
1 61 CYS 0.027 0.022 8 0 "[ . 1 . 2]"
1 62 ASN 0.050 0.027 17 0 "[ . 1 . 2]"
1 63 ALA 0.172 0.032 17 0 "[ . 1 . 2]"
1 64 HIS 0.027 0.021 17 0 "[ . 1 . 2]"
1 65 TYR 0.038 0.014 17 0 "[ . 1 . 2]"
1 66 ASN 0.092 0.032 17 0 "[ . 1 . 2]"
1 67 LEU 0.035 0.008 14 0 "[ . 1 . 2]"
1 68 GLN 0.296 0.080 6 0 "[ . 1 . 2]"
1 69 ASN 0.238 0.108 20 0 "[ . 1 . 2]"
1 70 ALA 0.021 0.019 20 0 "[ . 1 . 2]"
1 71 PHE 0.036 0.009 17 0 "[ . 1 . 2]"
1 72 ASN 0.640 0.108 20 0 "[ . 1 . 2]"
1 73 LEU 0.258 0.093 20 0 "[ . 1 . 2]"
1 74 ALA 0.011 0.005 4 0 "[ . 1 . 2]"
1 75 GLU 0.002 0.001 4 0 "[ . 1 . 2]"
1 76 LYS 0.060 0.040 18 0 "[ . 1 . 2]"
1 77 GLU 0.027 0.007 6 0 "[ . 1 . 2]"
1 78 LEU 0.030 0.008 17 0 "[ . 1 . 2]"
1 79 GLY 0.004 0.004 6 0 "[ . 1 . 2]"
1 80 LEU 0.040 0.011 17 0 "[ . 1 . 2]"
1 81 THR 0.027 0.013 11 0 "[ . 1 . 2]"
1 82 LYS 0.048 0.018 10 0 "[ . 1 . 2]"
1 83 LEU 0.034 0.008 14 0 "[ . 1 . 2]"
1 84 LEU 0.037 0.009 17 0 "[ . 1 . 2]"
1 85 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 PRO 0.055 0.017 14 0 "[ . 1 . 2]"
1 87 GLU 0.043 0.017 14 0 "[ . 1 . 2]"
1 88 ASP 0.046 0.026 8 0 "[ . 1 . 2]"
1 89 VAL 0.165 0.036 17 0 "[ . 1 . 2]"
1 90 ASN 0.694 0.172 9 0 "[ . 1 . 2]"
1 91 VAL 0.815 0.067 8 0 "[ . 1 . 2]"
1 92 ASP 0.524 0.067 8 0 "[ . 1 . 2]"
1 93 GLN 0.210 0.038 14 0 "[ . 1 . 2]"
1 94 PRO 0.415 0.039 17 0 "[ . 1 . 2]"
1 95 ASP 0.108 0.060 11 0 "[ . 1 . 2]"
1 96 GLU 0.209 0.060 11 0 "[ . 1 . 2]"
1 97 LYS 0.234 0.041 9 0 "[ . 1 . 2]"
1 98 SER 0.364 0.063 14 0 "[ . 1 . 2]"
1 99 ILE 0.445 0.063 14 0 "[ . 1 . 2]"
1 100 ILE 0.338 0.055 14 0 "[ . 1 . 2]"
1 101 THR 0.058 0.018 13 0 "[ . 1 . 2]"
1 102 TYR 0.039 0.008 13 0 "[ . 1 . 2]"
1 103 VAL 0.044 0.009 14 0 "[ . 1 . 2]"
1 104 ALA 0.095 0.018 13 0 "[ . 1 . 2]"
1 105 THR 0.017 0.008 14 0 "[ . 1 . 2]"
1 106 TYR 0.032 0.012 17 0 "[ . 1 . 2]"
1 107 TYR 0.010 0.010 14 0 "[ . 1 . 2]"
1 108 HIS 0.025 0.011 17 0 "[ . 1 . 2]"
1 109 TYR 0.019 0.011 17 0 "[ . 1 . 2]"
1 110 PHE 0.031 0.010 12 0 "[ . 1 . 2]"
1 111 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 LYS 0.006 0.001 7 0 "[ . 1 . 2]"
1 113 MET 0.002 0.001 7 0 "[ . 1 . 2]"
1 114 LYS 0.012 0.012 10 0 "[ . 1 . 2]"
1 115 ALA 0.185 0.152 19 0 "[ . 1 . 2]"
1 116 LEU 0.420 0.152 19 0 "[ . 1 . 2]"
1 117 ALA 0.061 0.042 8 0 "[ . 1 . 2]"
1 118 VAL 0.446 0.110 12 0 "[ . 1 . 2]"
1 119 GLU 0.011 0.011 8 0 "[ . 1 . 2]"
1 121 LYS 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 8 ALA MB 1 9 LYS HA . . 4.150 3.941 3.571 4.150 . 0 0 "[ . 1 . 2]" 1
2 1 9 LYS H 1 9 LYS QB . . 3.870 2.618 2.155 3.327 . 0 0 "[ . 1 . 2]" 1
3 1 9 LYS HA 1 9 LYS QD . . 4.340 4.016 3.372 4.368 0.028 1 0 "[ . 1 . 2]" 1
4 1 9 LYS HA 1 9 LYS QG . . 3.410 2.816 2.265 3.407 . 0 0 "[ . 1 . 2]" 1
5 1 9 LYS HA 1 11 ALA H . . 4.910 4.514 3.789 4.911 0.001 19 0 "[ . 1 . 2]" 1
6 1 9 LYS HA 1 12 LEU H . . 3.970 3.769 3.457 3.968 . 0 0 "[ . 1 . 2]" 1
7 1 9 LYS HA 1 12 LEU HB2 . . 4.510 4.135 3.614 4.508 . 0 0 "[ . 1 . 2]" 1
8 1 9 LYS HA 1 12 LEU HB3 . . 4.510 3.597 3.017 4.084 . 0 0 "[ . 1 . 2]" 1
9 1 9 LYS HA 1 12 LEU MD2 . . 4.780 4.112 3.338 4.571 . 0 0 "[ . 1 . 2]" 1
10 1 9 LYS HA 1 100 ILE MD . . 5.250 4.557 3.809 5.160 . 0 0 "[ . 1 . 2]" 1
11 1 9 LYS QB 1 9 LYS QE . . 4.270 2.868 2.121 3.732 . 0 0 "[ . 1 . 2]" 1
12 1 9 LYS QB 1 10 ASP H . . 4.060 3.349 2.296 4.052 . 0 0 "[ . 1 . 2]" 1
13 1 9 LYS QB 1 100 ILE MD . . 4.040 3.269 2.025 4.042 0.002 20 0 "[ . 1 . 2]" 1
14 1 9 LYS QB 1 100 ILE MG . . 4.490 3.284 1.840 4.491 0.001 9 0 "[ . 1 . 2]" 1
15 1 9 LYS QD 1 100 ILE MD . . 3.540 2.542 1.811 3.410 . 0 0 "[ . 1 . 2]" 1
16 1 9 LYS QD 1 100 ILE MG . . 4.270 4.021 3.340 4.278 0.008 17 0 "[ . 1 . 2]" 1
17 1 9 LYS QE 1 9 LYS QG . . 3.020 2.203 2.020 2.557 . 0 0 "[ . 1 . 2]" 1
18 1 9 LYS QE 1 31 PHE QD . . 4.500 3.472 1.912 4.497 . 0 0 "[ . 1 . 2]" 1
19 1 9 LYS QE 1 100 ILE MD . . 3.990 3.190 1.802 3.993 0.003 15 0 "[ . 1 . 2]" 1
20 1 9 LYS QG 1 31 PHE QD . . 4.180 3.283 2.171 4.193 0.013 15 0 "[ . 1 . 2]" 1
21 1 9 LYS QG 1 31 PHE QE . . 4.130 2.638 1.991 4.102 . 0 0 "[ . 1 . 2]" 1
22 1 9 LYS QG 1 31 PHE HZ . . 5.070 4.339 3.586 5.086 0.016 17 0 "[ . 1 . 2]" 1
23 1 9 LYS QG 1 100 ILE MD . . 3.550 2.584 1.872 3.578 0.028 17 0 "[ . 1 . 2]" 1
24 1 10 ASP H 1 10 ASP QB . . 3.490 2.561 2.236 2.950 . 0 0 "[ . 1 . 2]" 1
25 1 10 ASP H 1 11 ALA H . . 3.460 2.569 1.967 2.993 . 0 0 "[ . 1 . 2]" 1
26 1 10 ASP H 1 11 ALA MB . . 4.410 4.082 3.515 4.411 0.001 4 0 "[ . 1 . 2]" 1
27 1 10 ASP H 1 12 LEU H . . 4.440 3.990 3.195 4.440 . 0 0 "[ . 1 . 2]" 1
28 1 10 ASP HA 1 12 LEU H . . 4.800 4.342 4.110 4.688 . 0 0 "[ . 1 . 2]" 1
29 1 10 ASP HA 1 13 LEU H . . 4.000 3.575 3.388 3.823 . 0 0 "[ . 1 . 2]" 1
30 1 10 ASP HA 1 13 LEU HB2 . . 4.460 3.504 3.011 4.155 . 0 0 "[ . 1 . 2]" 1
31 1 10 ASP HA 1 13 LEU HB3 . . 4.230 2.666 2.318 2.930 . 0 0 "[ . 1 . 2]" 1
32 1 10 ASP HA 1 13 LEU MD2 . . 4.130 3.193 2.799 3.512 . 0 0 "[ . 1 . 2]" 1
33 1 10 ASP HA 1 14 LEU H . . 4.450 3.986 3.559 4.341 . 0 0 "[ . 1 . 2]" 1
34 1 10 ASP QB 1 11 ALA H . . 3.350 2.445 2.154 2.971 . 0 0 "[ . 1 . 2]" 1
35 1 10 ASP QB 1 11 ALA MB . . 4.240 3.856 3.570 4.241 0.001 19 0 "[ . 1 . 2]" 1
36 1 10 ASP QB 1 12 LEU H . . 4.920 4.681 4.335 4.918 . 0 0 "[ . 1 . 2]" 1
37 1 10 ASP QB 1 13 LEU H . . 5.150 5.049 4.709 5.148 . 0 0 "[ . 1 . 2]" 1
38 1 10 ASP QB 1 14 LEU H . . 4.980 4.712 4.484 4.990 0.010 12 0 "[ . 1 . 2]" 1
39 1 11 ALA H 1 11 ALA MB . . 2.890 2.108 2.023 2.222 . 0 0 "[ . 1 . 2]" 1
40 1 11 ALA H 1 13 LEU H . . 4.800 4.590 4.309 4.788 . 0 0 "[ . 1 . 2]" 1
41 1 11 ALA H 1 14 LEU HB3 . . 5.500 5.320 4.979 5.534 0.034 17 0 "[ . 1 . 2]" 1
42 1 11 ALA HA 1 14 LEU H . . 4.160 3.980 3.721 4.110 . 0 0 "[ . 1 . 2]" 1
43 1 11 ALA HA 1 14 LEU HB2 . . 4.550 4.236 3.983 4.534 . 0 0 "[ . 1 . 2]" 1
44 1 11 ALA HA 1 14 LEU HB3 . . 3.910 3.199 3.094 3.367 . 0 0 "[ . 1 . 2]" 1
45 1 11 ALA HA 1 14 LEU MD2 . . 3.950 3.504 3.304 3.733 . 0 0 "[ . 1 . 2]" 1
46 1 11 ALA MB 1 12 LEU H . . 3.060 2.579 2.424 2.807 . 0 0 "[ . 1 . 2]" 1
47 1 11 ALA MB 1 14 LEU H . . 5.460 4.898 4.716 5.041 . 0 0 "[ . 1 . 2]" 1
48 1 11 ALA MB 1 15 TRP H . . 5.000 4.941 4.815 5.004 0.004 13 0 "[ . 1 . 2]" 1
49 1 12 LEU H 1 12 LEU HB2 . . 3.300 2.460 2.395 2.528 . 0 0 "[ . 1 . 2]" 1
50 1 12 LEU H 1 12 LEU HB3 . . 3.300 2.576 2.505 2.667 . 0 0 "[ . 1 . 2]" 1
51 1 12 LEU H 1 12 LEU MD1 . . 4.070 4.016 3.944 4.071 0.001 8 0 "[ . 1 . 2]" 1
52 1 12 LEU H 1 12 LEU MD2 . . 4.250 4.213 4.176 4.251 0.001 14 0 "[ . 1 . 2]" 1
53 1 12 LEU H 1 12 LEU HG . . 4.730 4.512 4.482 4.545 . 0 0 "[ . 1 . 2]" 1
54 1 12 LEU H 1 13 LEU H . . 3.310 2.744 2.531 2.892 . 0 0 "[ . 1 . 2]" 1
55 1 12 LEU H 1 14 LEU H . . 4.400 4.140 3.802 4.365 . 0 0 "[ . 1 . 2]" 1
56 1 12 LEU H 1 31 PHE HZ . . 5.290 4.790 4.339 5.219 . 0 0 "[ . 1 . 2]" 1
57 1 12 LEU HA 1 12 LEU MD1 . . 3.170 2.052 1.970 2.228 . 0 0 "[ . 1 . 2]" 1
58 1 12 LEU HA 1 12 LEU MD2 . . 4.310 3.881 3.849 3.908 . 0 0 "[ . 1 . 2]" 1
59 1 12 LEU HA 1 12 LEU HG . . 4.250 3.014 2.903 3.122 . 0 0 "[ . 1 . 2]" 1
60 1 12 LEU HA 1 15 TRP H . . 3.760 3.312 3.169 3.459 . 0 0 "[ . 1 . 2]" 1
61 1 12 LEU HA 1 15 TRP HB2 . . 4.400 2.966 2.760 3.318 . 0 0 "[ . 1 . 2]" 1
62 1 12 LEU HA 1 15 TRP HB3 . . 3.970 3.014 2.867 3.152 . 0 0 "[ . 1 . 2]" 1
63 1 12 LEU HA 1 16 CYS H . . 4.390 4.272 4.110 4.401 0.011 12 0 "[ . 1 . 2]" 1
64 1 12 LEU QB 1 12 LEU MD1 . . 3.080 2.276 2.215 2.321 . 0 0 "[ . 1 . 2]" 1
65 1 12 LEU QB 1 12 LEU MD2 . . 3.010 2.053 2.006 2.097 . 0 0 "[ . 1 . 2]" 1
66 1 12 LEU QB 1 13 LEU H . . 3.530 2.202 2.050 2.506 . 0 0 "[ . 1 . 2]" 1
67 1 12 LEU QB 1 14 LEU H . . 5.340 4.603 4.487 4.815 . 0 0 "[ . 1 . 2]" 1
68 1 12 LEU QB 1 31 PHE HZ . . 4.100 2.812 2.451 3.185 . 0 0 "[ . 1 . 2]" 1
69 1 12 LEU QB 1 104 ALA MB . . 5.340 4.303 4.004 4.680 . 0 0 "[ . 1 . 2]" 1
70 1 12 LEU HB2 1 12 LEU MD1 . . 3.550 2.331 2.260 2.383 . 0 0 "[ . 1 . 2]" 1
71 1 12 LEU HB2 1 12 LEU MD2 . . 3.510 2.414 2.280 2.535 . 0 0 "[ . 1 . 2]" 1
72 1 12 LEU HB2 1 13 LEU H . . 4.390 3.621 3.529 3.826 . 0 0 "[ . 1 . 2]" 1
73 1 12 LEU HB2 1 31 PHE HZ . . 4.940 4.543 4.157 4.869 . 0 0 "[ . 1 . 2]" 1
74 1 12 LEU HB3 1 12 LEU MD1 . . 3.550 3.189 3.183 3.195 . 0 0 "[ . 1 . 2]" 1
75 1 12 LEU HB3 1 12 LEU MD2 . . 3.510 2.235 2.103 2.379 . 0 0 "[ . 1 . 2]" 1
76 1 12 LEU HB3 1 13 LEU H . . 4.390 2.221 2.063 2.540 . 0 0 "[ . 1 . 2]" 1
77 1 12 LEU HB3 1 31 PHE HZ . . 4.940 2.840 2.469 3.228 . 0 0 "[ . 1 . 2]" 1
78 1 12 LEU MD1 1 15 TRP H . . 4.630 4.493 4.167 4.627 . 0 0 "[ . 1 . 2]" 1
79 1 12 LEU MD1 1 15 TRP HB3 . . 3.650 2.977 2.565 3.212 . 0 0 "[ . 1 . 2]" 1
80 1 12 LEU MD1 1 15 TRP HE3 . . 3.980 3.102 2.629 3.509 . 0 0 "[ . 1 . 2]" 1
81 1 12 LEU MD1 1 16 CYS H . . 4.800 4.107 3.723 4.416 . 0 0 "[ . 1 . 2]" 1
82 1 12 LEU MD1 1 31 PHE QE . . 4.920 4.621 4.286 4.922 0.002 14 0 "[ . 1 . 2]" 1
83 1 12 LEU MD1 1 31 PHE HZ . . 5.360 4.668 4.368 4.994 . 0 0 "[ . 1 . 2]" 1
84 1 12 LEU MD1 1 44 ILE MD . . 5.500 5.111 4.918 5.341 . 0 0 "[ . 1 . 2]" 1
85 1 12 LEU MD1 1 103 VAL HA . . 5.500 5.183 4.971 5.425 . 0 0 "[ . 1 . 2]" 1
86 1 12 LEU MD1 1 103 VAL MG2 . . 3.230 2.967 2.522 3.217 . 0 0 "[ . 1 . 2]" 1
87 1 12 LEU MD1 1 104 ALA H . . 4.360 4.115 3.798 4.372 0.012 12 0 "[ . 1 . 2]" 1
88 1 12 LEU MD1 1 104 ALA HA . . 3.410 2.241 1.892 2.528 . 0 0 "[ . 1 . 2]" 1
89 1 12 LEU MD1 1 104 ALA MB . . 3.910 3.155 2.667 3.438 . 0 0 "[ . 1 . 2]" 1
90 1 12 LEU MD1 1 107 TYR H . . 3.990 3.715 3.445 3.975 . 0 0 "[ . 1 . 2]" 1
91 1 12 LEU MD1 1 107 TYR HA . . 4.870 4.543 4.199 4.865 . 0 0 "[ . 1 . 2]" 1
92 1 12 LEU MD1 1 107 TYR HB2 . . 3.720 2.678 2.321 2.980 . 0 0 "[ . 1 . 2]" 1
93 1 12 LEU MD1 1 107 TYR HB3 . . 3.640 2.633 2.319 2.942 . 0 0 "[ . 1 . 2]" 1
94 1 12 LEU MD1 1 107 TYR QD . . 3.850 3.166 2.649 3.519 . 0 0 "[ . 1 . 2]" 1
95 1 12 LEU MD1 1 108 HIS H . . 4.890 4.467 4.162 4.826 . 0 0 "[ . 1 . 2]" 1
96 1 12 LEU MD1 1 108 HIS HD2 . . 5.500 4.709 3.763 5.505 0.005 14 0 "[ . 1 . 2]" 1
97 1 12 LEU MD2 1 13 LEU H . . 4.360 3.949 3.750 4.270 . 0 0 "[ . 1 . 2]" 1
98 1 12 LEU MD2 1 31 PHE QE . . 4.290 3.026 2.380 3.461 . 0 0 "[ . 1 . 2]" 1
99 1 12 LEU MD2 1 31 PHE HZ . . 3.990 3.214 2.928 3.504 . 0 0 "[ . 1 . 2]" 1
100 1 12 LEU MD2 1 100 ILE HA . . 4.190 2.841 2.503 3.164 . 0 0 "[ . 1 . 2]" 1
101 1 12 LEU MD2 1 103 VAL HB . . 4.330 4.277 4.042 4.336 0.006 12 0 "[ . 1 . 2]" 1
102 1 12 LEU MD2 1 103 VAL MG2 . . 3.280 2.956 2.760 3.258 . 0 0 "[ . 1 . 2]" 1
103 1 12 LEU MD2 1 104 ALA H . . 3.670 3.135 2.879 3.472 . 0 0 "[ . 1 . 2]" 1
104 1 12 LEU MD2 1 104 ALA HA . . 3.850 2.479 2.116 2.975 . 0 0 "[ . 1 . 2]" 1
105 1 12 LEU MD2 1 104 ALA MB . . 3.370 2.556 2.321 2.974 . 0 0 "[ . 1 . 2]" 1
106 1 12 LEU MD2 1 105 THR H . . 5.500 5.029 4.704 5.422 . 0 0 "[ . 1 . 2]" 1
107 1 12 LEU HG 1 15 TRP HB3 . . 4.320 3.993 3.772 4.218 . 0 0 "[ . 1 . 2]" 1
108 1 12 LEU HG 1 16 CYS H . . 4.520 4.150 3.971 4.362 . 0 0 "[ . 1 . 2]" 1
109 1 12 LEU HG 1 31 PHE QE . . 4.410 3.393 2.897 3.691 . 0 0 "[ . 1 . 2]" 1
110 1 12 LEU HG 1 31 PHE HZ . . 3.910 3.214 2.804 3.639 . 0 0 "[ . 1 . 2]" 1
111 1 12 LEU HG 1 103 VAL MG2 . . 4.350 3.340 3.019 3.685 . 0 0 "[ . 1 . 2]" 1
112 1 13 LEU H 1 13 LEU HB2 . . 3.170 2.464 2.379 2.624 . 0 0 "[ . 1 . 2]" 1
113 1 13 LEU H 1 13 LEU HB3 . . 3.110 2.583 2.448 2.688 . 0 0 "[ . 1 . 2]" 1
114 1 13 LEU H 1 13 LEU MD1 . . 4.120 3.973 3.851 4.116 . 0 0 "[ . 1 . 2]" 1
115 1 13 LEU H 1 13 LEU MD2 . . 4.300 4.239 4.178 4.278 . 0 0 "[ . 1 . 2]" 1
116 1 13 LEU H 1 13 LEU HG . . 4.630 4.502 4.440 4.547 . 0 0 "[ . 1 . 2]" 1
117 1 13 LEU H 1 14 LEU H . . 3.410 2.944 2.816 3.045 . 0 0 "[ . 1 . 2]" 1
118 1 13 LEU H 1 15 TRP H . . 4.940 4.339 4.232 4.529 . 0 0 "[ . 1 . 2]" 1
119 1 13 LEU H 1 15 TRP HB3 . . 5.500 5.382 5.279 5.483 . 0 0 "[ . 1 . 2]" 1
120 1 13 LEU H 1 31 PHE QE . . 3.900 3.370 2.971 3.622 . 0 0 "[ . 1 . 2]" 1
121 1 13 LEU H 1 31 PHE HZ . . 3.680 2.419 2.120 2.811 . 0 0 "[ . 1 . 2]" 1
122 1 13 LEU HA 1 13 LEU MD1 . . 3.130 2.260 1.974 2.487 . 0 0 "[ . 1 . 2]" 1
123 1 13 LEU HA 1 13 LEU MD2 . . 4.140 3.935 3.887 3.978 . 0 0 "[ . 1 . 2]" 1
124 1 13 LEU HA 1 13 LEU HG . . 4.080 3.049 2.877 3.240 . 0 0 "[ . 1 . 2]" 1
125 1 13 LEU HA 1 16 CYS H . . 4.160 3.931 3.814 4.058 . 0 0 "[ . 1 . 2]" 1
126 1 13 LEU HA 1 16 CYS QB . . 4.060 3.448 3.187 3.643 . 0 0 "[ . 1 . 2]" 1
127 1 13 LEU HA 1 17 GLN H . . 4.670 4.363 4.189 4.582 . 0 0 "[ . 1 . 2]" 1
128 1 13 LEU HA 1 31 PHE QE . . 4.570 3.123 2.765 3.335 . 0 0 "[ . 1 . 2]" 1
129 1 13 LEU HA 1 31 PHE HZ . . 3.820 2.115 1.997 2.439 . 0 0 "[ . 1 . 2]" 1
130 1 13 LEU HB2 1 13 LEU MD1 . . 3.440 2.217 2.089 2.344 . 0 0 "[ . 1 . 2]" 1
131 1 13 LEU HB2 1 13 LEU MD2 . . 3.490 2.515 2.380 2.641 . 0 0 "[ . 1 . 2]" 1
132 1 13 LEU HB2 1 14 LEU H . . 4.010 3.853 3.735 4.002 . 0 0 "[ . 1 . 2]" 1
133 1 13 LEU HB2 1 31 PHE QD . . 4.280 4.115 3.863 4.268 . 0 0 "[ . 1 . 2]" 1
134 1 13 LEU HB2 1 31 PHE QE . . 3.930 2.102 1.993 2.431 . 0 0 "[ . 1 . 2]" 1
135 1 13 LEU HB2 1 31 PHE HZ . . 3.750 2.369 2.004 2.641 . 0 0 "[ . 1 . 2]" 1
136 1 13 LEU HB3 1 13 LEU MD1 . . 3.650 3.167 3.150 3.188 . 0 0 "[ . 1 . 2]" 1
137 1 13 LEU HB3 1 13 LEU MD2 . . 3.380 2.174 2.012 2.329 . 0 0 "[ . 1 . 2]" 1
138 1 13 LEU HB3 1 14 LEU H . . 3.400 2.519 2.363 2.674 . 0 0 "[ . 1 . 2]" 1
139 1 13 LEU HB3 1 15 TRP H . . 5.140 5.005 4.887 5.132 . 0 0 "[ . 1 . 2]" 1
140 1 13 LEU HB3 1 31 PHE QE . . 4.360 3.649 3.328 3.884 . 0 0 "[ . 1 . 2]" 1
141 1 13 LEU HB3 1 31 PHE HZ . . 4.130 3.706 3.360 3.998 . 0 0 "[ . 1 . 2]" 1
142 1 13 LEU MD1 1 14 LEU H . . 4.860 4.566 4.421 4.709 . 0 0 "[ . 1 . 2]" 1
143 1 13 LEU MD1 1 16 CYS QB . . 4.310 3.903 3.601 4.155 . 0 0 "[ . 1 . 2]" 1
144 1 13 LEU MD1 1 17 GLN HE21 . . 4.300 3.126 2.447 3.795 . 0 0 "[ . 1 . 2]" 1
145 1 13 LEU MD1 1 17 GLN HE22 . . 4.370 3.914 3.527 4.300 . 0 0 "[ . 1 . 2]" 1
146 1 13 LEU MD1 1 17 GLN QG . . 3.890 3.119 2.552 3.646 . 0 0 "[ . 1 . 2]" 1
147 1 13 LEU MD1 1 28 VAL MG1 . . 2.920 2.053 1.814 2.342 . 0 0 "[ . 1 . 2]" 1
148 1 13 LEU MD1 1 29 HIS HA . . 4.070 3.495 3.206 3.908 . 0 0 "[ . 1 . 2]" 1
149 1 13 LEU MD1 1 30 ASN H . . 4.000 3.732 3.106 4.010 0.010 17 0 "[ . 1 . 2]" 1
150 1 13 LEU MD1 1 30 ASN HA . . 3.960 2.986 2.359 3.387 . 0 0 "[ . 1 . 2]" 1
151 1 13 LEU MD1 1 31 PHE QD . . 4.350 3.382 3.072 3.736 . 0 0 "[ . 1 . 2]" 1
152 1 13 LEU MD1 1 31 PHE QE . . 4.010 2.772 2.500 3.179 . 0 0 "[ . 1 . 2]" 1
153 1 13 LEU MD1 1 31 PHE HZ . . 4.530 2.837 2.391 3.247 . 0 0 "[ . 1 . 2]" 1
154 1 13 LEU MD1 1 34 SER HB2 . . 5.500 5.170 4.889 5.475 . 0 0 "[ . 1 . 2]" 1
155 1 13 LEU MD1 1 34 SER HB3 . . 5.500 5.182 4.757 5.444 . 0 0 "[ . 1 . 2]" 1
156 1 13 LEU MD1 1 35 TRP HE1 . . 4.910 4.283 4.034 4.551 . 0 0 "[ . 1 . 2]" 1
157 1 13 LEU MD2 1 14 LEU H . . 4.230 4.021 3.722 4.181 . 0 0 "[ . 1 . 2]" 1
158 1 13 LEU MD2 1 17 GLN HE21 . . 4.270 3.509 2.511 4.258 . 0 0 "[ . 1 . 2]" 1
159 1 13 LEU MD2 1 17 GLN HE22 . . 4.110 3.136 2.518 3.973 . 0 0 "[ . 1 . 2]" 1
160 1 13 LEU MD2 1 29 HIS HA . . 4.230 3.954 3.427 4.230 0.000 4 0 "[ . 1 . 2]" 1
161 1 13 LEU MD2 1 30 ASN HA . . 4.590 3.968 3.564 4.355 . 0 0 "[ . 1 . 2]" 1
162 1 13 LEU MD2 1 31 PHE QD . . 4.970 4.343 3.906 4.749 . 0 0 "[ . 1 . 2]" 1
163 1 13 LEU MD2 1 31 PHE QE . . 4.580 3.444 2.793 3.905 . 0 0 "[ . 1 . 2]" 1
164 1 13 LEU MD2 1 31 PHE HZ . . 5.370 4.420 4.070 4.746 . 0 0 "[ . 1 . 2]" 1
165 1 13 LEU HG 1 14 LEU H . . 4.340 3.707 3.421 3.962 . 0 0 "[ . 1 . 2]" 1
166 1 13 LEU HG 1 17 GLN H . . 5.060 4.654 4.267 4.937 . 0 0 "[ . 1 . 2]" 1
167 1 13 LEU HG 1 17 GLN HE21 . . 4.610 3.295 2.210 4.146 . 0 0 "[ . 1 . 2]" 1
168 1 13 LEU HG 1 17 GLN HE22 . . 4.680 3.520 2.867 4.380 . 0 0 "[ . 1 . 2]" 1
169 1 13 LEU HG 1 28 VAL MG1 . . 4.170 3.511 2.943 4.058 . 0 0 "[ . 1 . 2]" 1
170 1 14 LEU H 1 14 LEU HB2 . . 2.990 2.675 2.505 2.761 . 0 0 "[ . 1 . 2]" 1
171 1 14 LEU H 1 14 LEU HB3 . . 3.170 2.350 2.273 2.501 . 0 0 "[ . 1 . 2]" 1
172 1 14 LEU H 1 14 LEU MD1 . . 4.290 4.186 4.077 4.244 . 0 0 "[ . 1 . 2]" 1
173 1 14 LEU H 1 14 LEU MD2 . . 4.320 4.184 4.132 4.212 . 0 0 "[ . 1 . 2]" 1
174 1 14 LEU H 1 15 TRP H . . 3.310 2.692 2.575 2.879 . 0 0 "[ . 1 . 2]" 1
175 1 14 LEU H 1 15 TRP HB2 . . 5.160 4.881 4.766 5.115 . 0 0 "[ . 1 . 2]" 1
176 1 14 LEU H 1 15 TRP HB3 . . 5.290 5.020 4.903 5.126 . 0 0 "[ . 1 . 2]" 1
177 1 14 LEU H 1 16 CYS H . . 4.690 4.643 4.505 4.693 0.003 13 0 "[ . 1 . 2]" 1
178 1 14 LEU HA 1 14 LEU MD1 . . 3.140 2.259 2.136 2.361 . 0 0 "[ . 1 . 2]" 1
179 1 14 LEU HA 1 14 LEU MD2 . . 4.070 3.941 3.895 3.966 . 0 0 "[ . 1 . 2]" 1
180 1 14 LEU HA 1 14 LEU HG . . 4.130 3.253 3.165 3.344 . 0 0 "[ . 1 . 2]" 1
181 1 14 LEU HA 1 17 GLN H . . 3.710 3.526 3.391 3.697 . 0 0 "[ . 1 . 2]" 1
182 1 14 LEU HA 1 17 GLN HB2 . . 3.590 2.392 2.171 2.731 . 0 0 "[ . 1 . 2]" 1
183 1 14 LEU HA 1 17 GLN HB3 . . 4.350 3.882 3.597 4.250 . 0 0 "[ . 1 . 2]" 1
184 1 14 LEU HB2 1 14 LEU MD1 . . 3.200 2.299 2.204 2.378 . 0 0 "[ . 1 . 2]" 1
185 1 14 LEU HB2 1 14 LEU MD2 . . 3.200 2.412 2.313 2.507 . 0 0 "[ . 1 . 2]" 1
186 1 14 LEU HB2 1 15 TRP H . . 4.120 3.950 3.813 4.025 . 0 0 "[ . 1 . 2]" 1
187 1 14 LEU HB3 1 14 LEU MD2 . . 3.310 2.273 2.146 2.348 . 0 0 "[ . 1 . 2]" 1
188 1 14 LEU HB3 1 15 TRP H . . 3.410 2.606 2.444 2.731 . 0 0 "[ . 1 . 2]" 1
189 1 14 LEU HB3 1 16 CYS H . . 5.500 5.435 5.280 5.498 . 0 0 "[ . 1 . 2]" 1
190 1 14 LEU MD1 1 17 GLN H . . 4.660 4.555 4.420 4.648 . 0 0 "[ . 1 . 2]" 1
191 1 14 LEU MD1 1 18 MET H . . 4.520 3.804 3.547 4.192 . 0 0 "[ . 1 . 2]" 1
192 1 14 LEU MD1 1 18 MET ME . . 3.970 3.376 2.991 3.868 . 0 0 "[ . 1 . 2]" 1
193 1 14 LEU MD1 1 18 MET HG2 . . 3.840 3.002 2.615 3.658 . 0 0 "[ . 1 . 2]" 1
194 1 14 LEU MD1 1 18 MET HG3 . . 3.840 2.655 2.219 3.709 . 0 0 "[ . 1 . 2]" 1
195 1 14 LEU MD2 1 15 TRP H . . 4.180 4.111 3.898 4.181 0.001 20 0 "[ . 1 . 2]" 1
196 1 14 LEU MD2 1 18 MET ME . . 4.130 2.903 2.412 3.482 . 0 0 "[ . 1 . 2]" 1
197 1 14 LEU HG 1 15 TRP H . . 3.700 3.463 3.103 3.625 . 0 0 "[ . 1 . 2]" 1
198 1 14 LEU HG 1 15 TRP HA . . 4.520 3.411 3.154 3.630 . 0 0 "[ . 1 . 2]" 1
199 1 14 LEU HG 1 18 MET QG . . 4.090 2.561 2.313 2.814 . 0 0 "[ . 1 . 2]" 1
200 1 15 TRP H 1 15 TRP HB2 . . 3.070 2.368 2.307 2.405 . 0 0 "[ . 1 . 2]" 1
201 1 15 TRP H 1 15 TRP HB3 . . 3.050 2.709 2.662 2.783 . 0 0 "[ . 1 . 2]" 1
202 1 15 TRP H 1 15 TRP HD1 . . 4.710 4.666 4.565 4.714 0.004 12 0 "[ . 1 . 2]" 1
203 1 15 TRP H 1 16 CYS H . . 3.270 3.004 2.887 3.092 . 0 0 "[ . 1 . 2]" 1
204 1 15 TRP H 1 17 GLN H . . 5.010 4.108 3.938 4.267 . 0 0 "[ . 1 . 2]" 1
205 1 15 TRP H 1 18 MET QG . . 4.870 4.596 4.247 4.856 . 0 0 "[ . 1 . 2]" 1
206 1 15 TRP HA 1 15 TRP HD1 . . 4.060 2.759 2.603 2.928 . 0 0 "[ . 1 . 2]" 1
207 1 15 TRP HA 1 18 MET H . . 3.660 3.540 3.306 3.661 0.001 1 0 "[ . 1 . 2]" 1
208 1 15 TRP HA 1 18 MET HB2 . . 4.070 2.988 2.714 3.319 . 0 0 "[ . 1 . 2]" 1
209 1 15 TRP HA 1 18 MET ME . . 4.020 2.385 1.963 4.001 . 0 0 "[ . 1 . 2]" 1
210 1 15 TRP HA 1 18 MET QG . . 4.410 3.192 2.498 3.556 . 0 0 "[ . 1 . 2]" 1
211 1 15 TRP HA 1 19 LYS H . . 4.740 4.353 4.148 4.633 . 0 0 "[ . 1 . 2]" 1
212 1 15 TRP HB2 1 15 TRP HD1 . . 3.850 2.839 2.762 2.923 . 0 0 "[ . 1 . 2]" 1
213 1 15 TRP HB2 1 16 CYS H . . 3.770 3.562 3.505 3.632 . 0 0 "[ . 1 . 2]" 1
214 1 15 TRP HB2 1 107 TYR QE . . 4.870 4.537 3.886 4.870 . 0 0 "[ . 1 . 2]" 1
215 1 15 TRP HB3 1 15 TRP HE3 . . 3.600 2.428 2.401 2.469 . 0 0 "[ . 1 . 2]" 1
216 1 15 TRP HB3 1 16 CYS H . . 2.900 2.138 2.056 2.268 . 0 0 "[ . 1 . 2]" 1
217 1 15 TRP HD1 1 18 MET ME . . 4.510 3.035 2.299 4.490 . 0 0 "[ . 1 . 2]" 1
218 1 15 TRP HD1 1 19 LYS QE . . 4.870 3.646 3.113 4.280 . 0 0 "[ . 1 . 2]" 1
219 1 15 TRP HD1 1 107 TYR QE . . 3.960 3.541 3.018 3.892 . 0 0 "[ . 1 . 2]" 1
220 1 15 TRP HE1 1 19 LYS HE2 . . 4.510 2.740 2.091 3.928 . 0 0 "[ . 1 . 2]" 1
221 1 15 TRP HE1 1 19 LYS QE . . 3.950 2.468 2.052 2.915 . 0 0 "[ . 1 . 2]" 1
222 1 15 TRP HE1 1 19 LYS HE3 . . 4.510 3.225 2.170 4.179 . 0 0 "[ . 1 . 2]" 1
223 1 15 TRP HE3 1 16 CYS H . . 3.580 3.034 2.779 3.286 . 0 0 "[ . 1 . 2]" 1
224 1 15 TRP HE3 1 16 CYS HA . . 4.000 3.296 2.920 3.766 . 0 0 "[ . 1 . 2]" 1
225 1 15 TRP HE3 1 44 ILE MD . . 4.650 4.189 3.877 4.356 . 0 0 "[ . 1 . 2]" 1
226 1 15 TRP HE3 1 44 ILE MG . . 4.930 4.382 4.043 4.687 . 0 0 "[ . 1 . 2]" 1
227 1 15 TRP HE3 1 103 VAL MG2 . . 4.730 3.753 3.587 3.999 . 0 0 "[ . 1 . 2]" 1
228 1 15 TRP HH2 1 44 ILE MG . . 3.770 2.704 2.307 3.015 . 0 0 "[ . 1 . 2]" 1
229 1 15 TRP HH2 1 48 HIS HE1 . . 4.170 3.961 3.403 4.174 0.004 20 0 "[ . 1 . 2]" 1
230 1 15 TRP HH2 1 107 TYR H . . 4.640 4.432 4.177 4.637 . 0 0 "[ . 1 . 2]" 1
231 1 15 TRP HH2 1 107 TYR HA . . 4.530 2.918 2.507 3.131 . 0 0 "[ . 1 . 2]" 1
232 1 15 TRP HH2 1 110 PHE HB2 . . 4.520 3.599 3.277 3.871 . 0 0 "[ . 1 . 2]" 1
233 1 15 TRP HH2 1 110 PHE HB3 . . 4.830 4.588 4.279 4.828 . 0 0 "[ . 1 . 2]" 1
234 1 15 TRP HH2 1 110 PHE QD . . 3.980 3.144 2.812 3.788 . 0 0 "[ . 1 . 2]" 1
235 1 15 TRP HZ2 1 19 LYS HE2 . . 4.620 3.569 2.841 4.619 . 0 0 "[ . 1 . 2]" 1
236 1 15 TRP HZ2 1 19 LYS QE . . 4.040 2.792 2.135 3.679 . 0 0 "[ . 1 . 2]" 1
237 1 15 TRP HZ2 1 19 LYS HE3 . . 4.620 3.035 2.170 4.248 . 0 0 "[ . 1 . 2]" 1
238 1 15 TRP HZ2 1 44 ILE MG . . 4.530 4.334 3.920 4.532 0.002 20 0 "[ . 1 . 2]" 1
239 1 15 TRP HZ2 1 48 HIS HE1 . . 4.230 3.418 2.862 3.997 . 0 0 "[ . 1 . 2]" 1
240 1 15 TRP HZ2 1 107 TYR HA . . 4.510 3.210 2.877 3.509 . 0 0 "[ . 1 . 2]" 1
241 1 15 TRP HZ2 1 110 PHE HB2 . . 4.180 3.535 3.199 4.103 . 0 0 "[ . 1 . 2]" 1
242 1 15 TRP HZ2 1 110 PHE HB3 . . 4.540 3.702 3.314 4.300 . 0 0 "[ . 1 . 2]" 1
243 1 15 TRP HZ3 1 16 CYS H . . 5.500 5.285 5.050 5.495 . 0 0 "[ . 1 . 2]" 1
244 1 15 TRP HZ3 1 44 ILE MD . . 3.390 2.929 2.491 3.305 . 0 0 "[ . 1 . 2]" 1
245 1 15 TRP HZ3 1 44 ILE MG . . 3.750 2.580 2.143 2.920 . 0 0 "[ . 1 . 2]" 1
246 1 15 TRP HZ3 1 103 VAL MG2 . . 3.980 3.477 3.218 3.697 . 0 0 "[ . 1 . 2]" 1
247 1 16 CYS H 1 16 CYS HB2 . . 3.600 2.537 2.171 2.871 . 0 0 "[ . 1 . 2]" 1
248 1 16 CYS H 1 16 CYS QB . . 3.080 2.471 2.121 2.756 . 0 0 "[ . 1 . 2]" 1
249 1 16 CYS H 1 16 CYS HB3 . . 3.600 3.422 2.919 3.593 . 0 0 "[ . 1 . 2]" 1
250 1 16 CYS H 1 17 GLN HB2 . . 5.010 4.755 4.621 4.920 . 0 0 "[ . 1 . 2]" 1
251 1 16 CYS H 1 19 LYS H . . 5.210 4.944 4.805 5.061 . 0 0 "[ . 1 . 2]" 1
252 1 16 CYS H 1 28 VAL MG1 . . 5.200 4.374 4.040 4.586 . 0 0 "[ . 1 . 2]" 1
253 1 16 CYS H 1 28 VAL MG2 . . 5.140 4.878 4.678 5.134 . 0 0 "[ . 1 . 2]" 1
254 1 16 CYS H 1 35 TRP HZ2 . . 5.500 5.485 5.337 5.520 0.020 17 0 "[ . 1 . 2]" 1
255 1 16 CYS H 1 44 ILE MD . . 5.500 5.423 5.326 5.507 0.007 13 0 "[ . 1 . 2]" 1
256 1 16 CYS H 1 103 VAL MG2 . . 4.990 4.840 4.586 4.991 0.001 15 0 "[ . 1 . 2]" 1
257 1 16 CYS HA 1 18 MET H . . 4.640 4.330 4.110 4.525 . 0 0 "[ . 1 . 2]" 1
258 1 16 CYS HA 1 19 LYS H . . 4.370 3.518 3.382 3.675 . 0 0 "[ . 1 . 2]" 1
259 1 16 CYS HA 1 19 LYS HB2 . . 3.670 3.035 2.715 3.401 . 0 0 "[ . 1 . 2]" 1
260 1 16 CYS HA 1 20 THR H . . 4.260 3.577 3.370 3.841 . 0 0 "[ . 1 . 2]" 1
261 1 16 CYS HA 1 20 THR MG . . 4.140 3.333 3.054 3.555 . 0 0 "[ . 1 . 2]" 1
262 1 16 CYS HA 1 28 VAL MG1 . . 4.970 4.740 4.334 4.968 . 0 0 "[ . 1 . 2]" 1
263 1 16 CYS HA 1 28 VAL MG2 . . 4.440 3.919 3.643 4.225 . 0 0 "[ . 1 . 2]" 1
264 1 16 CYS HA 1 44 ILE MD . . 4.230 3.998 3.757 4.177 . 0 0 "[ . 1 . 2]" 1
265 1 16 CYS QB 1 17 GLN H . . 3.400 2.595 2.430 2.788 . 0 0 "[ . 1 . 2]" 1
266 1 16 CYS QB 1 35 TRP HH2 . . 4.530 2.910 2.414 3.295 . 0 0 "[ . 1 . 2]" 1
267 1 16 CYS QB 1 35 TRP HZ2 . . 4.480 3.151 2.764 3.306 . 0 0 "[ . 1 . 2]" 1
268 1 16 CYS QB 1 44 ILE MD . . 3.960 3.447 2.916 3.968 0.008 13 0 "[ . 1 . 2]" 1
269 1 16 CYS HB2 1 28 VAL MG1 . . 3.520 2.542 1.986 3.488 . 0 0 "[ . 1 . 2]" 1
270 1 16 CYS HB2 1 28 VAL MG2 . . 4.030 3.021 2.434 3.891 . 0 0 "[ . 1 . 2]" 1
271 1 16 CYS HB3 1 28 VAL MG1 . . 3.520 2.789 2.116 3.246 . 0 0 "[ . 1 . 2]" 1
272 1 16 CYS HB3 1 28 VAL MG2 . . 4.030 2.298 1.970 2.753 . 0 0 "[ . 1 . 2]" 1
273 1 17 GLN H 1 17 GLN HB2 . . 2.950 2.272 2.193 2.381 . 0 0 "[ . 1 . 2]" 1
274 1 17 GLN H 1 17 GLN HB3 . . 3.770 3.536 3.498 3.572 . 0 0 "[ . 1 . 2]" 1
275 1 17 GLN H 1 17 GLN HE21 . . 5.480 5.257 4.710 5.476 . 0 0 "[ . 1 . 2]" 1
276 1 17 GLN H 1 17 GLN HG2 . . 4.080 3.749 3.256 3.972 . 0 0 "[ . 1 . 2]" 1
277 1 17 GLN H 1 17 GLN HG3 . . 4.080 2.686 2.425 2.915 . 0 0 "[ . 1 . 2]" 1
278 1 17 GLN H 1 18 MET HB2 . . 5.020 4.782 4.606 4.934 . 0 0 "[ . 1 . 2]" 1
279 1 17 GLN H 1 19 LYS H . . 4.590 4.311 4.129 4.461 . 0 0 "[ . 1 . 2]" 1
280 1 17 GLN H 1 20 THR HG1 . . 4.840 4.125 3.780 4.359 . 0 0 "[ . 1 . 2]" 1
281 1 17 GLN H 1 28 VAL HB . . 4.750 3.585 3.255 3.975 . 0 0 "[ . 1 . 2]" 1
282 1 17 GLN H 1 28 VAL MG1 . . 4.320 3.578 3.216 3.986 . 0 0 "[ . 1 . 2]" 1
283 1 17 GLN H 1 28 VAL MG2 . . 4.250 3.800 3.457 4.104 . 0 0 "[ . 1 . 2]" 1
284 1 17 GLN HA 1 17 GLN QG . . 3.280 2.277 2.167 2.377 . 0 0 "[ . 1 . 2]" 1
285 1 17 GLN HA 1 19 LYS H . . 4.790 4.620 4.288 4.791 0.001 11 0 "[ . 1 . 2]" 1
286 1 17 GLN HA 1 20 THR H . . 4.110 3.948 3.622 4.123 0.013 13 0 "[ . 1 . 2]" 1
287 1 17 GLN HA 1 20 THR HG1 . . 3.610 2.220 1.999 2.428 . 0 0 "[ . 1 . 2]" 1
288 1 17 GLN HA 1 20 THR MG . . 4.200 3.778 3.455 4.029 . 0 0 "[ . 1 . 2]" 1
289 1 17 GLN HA 1 21 ALA H . . 4.580 3.955 3.477 4.282 . 0 0 "[ . 1 . 2]" 1
290 1 17 GLN HA 1 21 ALA MB . . 5.100 4.475 4.169 4.844 . 0 0 "[ . 1 . 2]" 1
291 1 17 GLN HA 1 28 VAL H . . 4.670 3.520 3.015 4.160 . 0 0 "[ . 1 . 2]" 1
292 1 17 GLN HA 1 28 VAL HB . . 4.240 2.719 2.323 3.410 . 0 0 "[ . 1 . 2]" 1
293 1 17 GLN HA 1 28 VAL MG2 . . 4.360 2.989 2.610 3.333 . 0 0 "[ . 1 . 2]" 1
294 1 17 GLN HB2 1 18 MET H . . 3.330 2.772 2.558 2.914 . 0 0 "[ . 1 . 2]" 1
295 1 17 GLN HB3 1 17 GLN HE21 . . 4.790 4.263 3.736 4.463 . 0 0 "[ . 1 . 2]" 1
296 1 17 GLN HB3 1 17 GLN HE22 . . 4.760 4.559 4.267 4.726 . 0 0 "[ . 1 . 2]" 1
297 1 17 GLN HB3 1 18 MET H . . 3.780 3.424 3.234 3.633 . 0 0 "[ . 1 . 2]" 1
298 1 17 GLN HE21 1 29 HIS HA . . 3.650 2.501 1.967 3.017 . 0 0 "[ . 1 . 2]" 1
299 1 17 GLN HE21 1 29 HIS QB . . 4.950 4.283 3.600 4.895 . 0 0 "[ . 1 . 2]" 1
300 1 17 GLN HE22 1 17 GLN QG . . 3.530 3.217 3.216 3.224 . 0 0 "[ . 1 . 2]" 1
301 1 17 GLN HE22 1 29 HIS HA . . 3.690 3.279 2.822 3.689 . 0 0 "[ . 1 . 2]" 1
302 1 17 GLN HE22 1 29 HIS QB . . 5.320 4.892 4.211 5.327 0.007 13 0 "[ . 1 . 2]" 1
303 1 17 GLN QG 1 28 VAL HB . . 4.100 2.066 1.818 2.325 . 0 0 "[ . 1 . 2]" 1
304 1 18 MET H 1 18 MET HB2 . . 3.170 2.390 2.305 2.524 . 0 0 "[ . 1 . 2]" 1
305 1 18 MET H 1 18 MET HB3 . . 3.630 3.574 3.558 3.590 . 0 0 "[ . 1 . 2]" 1
306 1 18 MET H 1 18 MET HG2 . . 3.590 3.234 2.142 3.557 . 0 0 "[ . 1 . 2]" 1
307 1 18 MET H 1 18 MET QG . . 3.140 2.437 2.117 2.693 . 0 0 "[ . 1 . 2]" 1
308 1 18 MET H 1 18 MET HG3 . . 3.590 2.619 2.269 3.303 . 0 0 "[ . 1 . 2]" 1
309 1 18 MET H 1 19 LYS H . . 3.320 2.692 2.540 2.823 . 0 0 "[ . 1 . 2]" 1
310 1 18 MET H 1 19 LYS HD3 . . 5.500 5.234 4.497 5.500 0.000 7 0 "[ . 1 . 2]" 1
311 1 18 MET H 1 19 LYS HG2 . . 4.710 4.155 3.894 4.293 . 0 0 "[ . 1 . 2]" 1
312 1 18 MET H 1 20 THR H . . 4.520 4.423 4.173 4.524 0.004 19 0 "[ . 1 . 2]" 1
313 1 18 MET H 1 21 ALA H . . 4.750 4.622 4.434 4.743 . 0 0 "[ . 1 . 2]" 1
314 1 18 MET HA 1 18 MET ME . . 4.710 4.543 4.401 4.688 . 0 0 "[ . 1 . 2]" 1
315 1 18 MET HA 1 18 MET HG2 . . 3.950 2.372 2.250 2.785 . 0 0 "[ . 1 . 2]" 1
316 1 18 MET HA 1 18 MET QG . . 3.400 2.319 2.213 2.718 . 0 0 "[ . 1 . 2]" 1
317 1 18 MET HA 1 18 MET HG3 . . 3.950 3.278 3.133 3.795 . 0 0 "[ . 1 . 2]" 1
318 1 18 MET HA 1 21 ALA H . . 4.250 3.805 3.563 3.993 . 0 0 "[ . 1 . 2]" 1
319 1 18 MET HA 1 21 ALA MB . . 3.640 2.613 2.257 2.846 . 0 0 "[ . 1 . 2]" 1
320 1 18 MET HB2 1 19 LYS H . . 3.580 2.529 2.411 2.766 . 0 0 "[ . 1 . 2]" 1
321 1 18 MET HB3 1 19 LYS H . . 3.620 3.429 3.221 3.619 . 0 0 "[ . 1 . 2]" 1
322 1 18 MET HB3 1 19 LYS HA . . 4.560 4.264 4.125 4.426 . 0 0 "[ . 1 . 2]" 1
323 1 18 MET QG 1 19 LYS H . . 4.370 4.086 3.964 4.230 . 0 0 "[ . 1 . 2]" 1
324 1 18 MET HG2 1 19 LYS H . . 5.010 4.806 4.297 4.978 . 0 0 "[ . 1 . 2]" 1
325 1 18 MET HG3 1 19 LYS H . . 5.010 4.441 4.210 4.673 . 0 0 "[ . 1 . 2]" 1
326 1 19 LYS H 1 19 LYS HB2 . . 3.220 2.630 2.564 2.727 . 0 0 "[ . 1 . 2]" 1
327 1 19 LYS H 1 19 LYS HD2 . . 4.240 4.082 3.835 4.228 . 0 0 "[ . 1 . 2]" 1
328 1 19 LYS H 1 19 LYS HD3 . . 3.260 3.069 2.727 3.256 . 0 0 "[ . 1 . 2]" 1
329 1 19 LYS H 1 19 LYS QE . . 4.430 4.199 3.756 4.410 . 0 0 "[ . 1 . 2]" 1
330 1 19 LYS H 1 19 LYS HG2 . . 3.260 2.021 1.893 2.103 . 0 0 "[ . 1 . 2]" 1
331 1 19 LYS H 1 19 LYS HG3 . . 3.600 3.554 3.442 3.599 . 0 0 "[ . 1 . 2]" 1
332 1 19 LYS H 1 20 THR H . . 3.250 2.785 2.550 2.893 . 0 0 "[ . 1 . 2]" 1
333 1 19 LYS H 1 20 THR HG1 . . 4.220 3.970 3.763 4.152 . 0 0 "[ . 1 . 2]" 1
334 1 19 LYS H 1 20 THR MG . . 4.490 4.348 4.132 4.483 . 0 0 "[ . 1 . 2]" 1
335 1 19 LYS H 1 21 ALA H . . 4.240 3.791 3.575 3.917 . 0 0 "[ . 1 . 2]" 1
336 1 19 LYS H 1 47 LYS QE . . 5.500 5.336 5.035 5.524 0.024 12 0 "[ . 1 . 2]" 1
337 1 19 LYS HA 1 19 LYS HD2 . . 3.970 2.589 2.427 2.880 . 0 0 "[ . 1 . 2]" 1
338 1 19 LYS HA 1 19 LYS HD3 . . 3.670 2.435 2.243 2.647 . 0 0 "[ . 1 . 2]" 1
339 1 19 LYS HA 1 19 LYS HE2 . . 5.060 4.704 4.449 4.864 . 0 0 "[ . 1 . 2]" 1
340 1 19 LYS HA 1 19 LYS HE3 . . 5.060 4.754 4.635 4.921 . 0 0 "[ . 1 . 2]" 1
341 1 19 LYS HA 1 21 ALA H . . 4.360 3.975 3.703 4.234 . 0 0 "[ . 1 . 2]" 1
342 1 19 LYS HA 1 47 LYS QE . . 3.790 2.782 2.445 3.080 . 0 0 "[ . 1 . 2]" 1
343 1 19 LYS HA 1 47 LYS QG . . 4.700 3.594 2.881 4.146 . 0 0 "[ . 1 . 2]" 1
344 1 19 LYS HB2 1 20 THR H . . 5.150 2.182 2.086 2.349 . 0 0 "[ . 1 . 2]" 1
345 1 19 LYS HB2 1 20 THR MG . . 4.590 3.095 2.949 3.277 . 0 0 "[ . 1 . 2]" 1
346 1 19 LYS HB2 1 48 HIS HE1 . . 5.500 5.392 4.041 5.504 0.004 19 0 "[ . 1 . 2]" 1
347 1 19 LYS HB3 1 20 THR H . . 3.950 3.434 3.311 3.690 . 0 0 "[ . 1 . 2]" 1
348 1 19 LYS HB3 1 21 ALA H . . 5.390 5.190 4.971 5.394 0.004 12 0 "[ . 1 . 2]" 1
349 1 19 LYS HD2 1 47 LYS QE . . 4.550 3.619 2.800 4.363 . 0 0 "[ . 1 . 2]" 1
350 1 19 LYS HD2 1 48 HIS HE1 . . 4.150 3.341 2.410 4.043 . 0 0 "[ . 1 . 2]" 1
351 1 19 LYS QE 1 19 LYS HG2 . . 3.540 2.616 2.402 2.758 . 0 0 "[ . 1 . 2]" 1
352 1 19 LYS HE2 1 19 LYS HG2 . . 4.040 2.971 2.497 3.802 . 0 0 "[ . 1 . 2]" 1
353 1 19 LYS HE2 1 19 LYS HG3 . . 3.990 2.957 2.261 3.727 . 0 0 "[ . 1 . 2]" 1
354 1 19 LYS HE3 1 19 LYS HG2 . . 4.040 3.185 2.439 3.821 . 0 0 "[ . 1 . 2]" 1
355 1 19 LYS HE3 1 19 LYS HG3 . . 3.990 2.525 2.127 3.509 . 0 0 "[ . 1 . 2]" 1
356 1 19 LYS HG2 1 20 THR H . . 4.350 3.910 3.705 4.013 . 0 0 "[ . 1 . 2]" 1
357 1 19 LYS HG3 1 44 ILE MG . . 4.430 3.394 2.377 3.831 . 0 0 "[ . 1 . 2]" 1
358 1 19 LYS HG3 1 48 HIS HE1 . . 4.110 3.518 2.621 3.738 . 0 0 "[ . 1 . 2]" 1
359 1 20 THR H 1 20 THR HG1 . . 2.900 2.129 1.957 2.318 . 0 0 "[ . 1 . 2]" 1
360 1 20 THR H 1 20 THR MG . . 3.260 2.172 2.030 2.293 . 0 0 "[ . 1 . 2]" 1
361 1 20 THR H 1 21 ALA MB . . 4.630 4.339 4.121 4.417 . 0 0 "[ . 1 . 2]" 1
362 1 20 THR H 1 28 VAL MG2 . . 4.590 3.963 3.578 4.334 . 0 0 "[ . 1 . 2]" 1
363 1 20 THR HA 1 20 THR MG . . 3.140 2.320 2.215 2.420 . 0 0 "[ . 1 . 2]" 1
364 1 20 THR HA 1 23 TYR QD . . 3.630 2.484 2.021 3.053 . 0 0 "[ . 1 . 2]" 1
365 1 20 THR HA 1 23 TYR QE . . 4.000 3.285 2.460 3.930 . 0 0 "[ . 1 . 2]" 1
366 1 20 THR HA 1 26 VAL MG1 . . 4.590 3.257 2.754 3.721 . 0 0 "[ . 1 . 2]" 1
367 1 20 THR HA 1 26 VAL MG2 . . 4.870 4.410 4.098 4.836 . 0 0 "[ . 1 . 2]" 1
368 1 20 THR HA 1 43 ALA MB . . 3.920 3.022 2.627 3.301 . 0 0 "[ . 1 . 2]" 1
369 1 20 THR HB 1 23 TYR HB2 . . 5.190 4.045 3.250 4.735 . 0 0 "[ . 1 . 2]" 1
370 1 20 THR HB 1 23 TYR QD . . 4.630 3.769 2.941 4.571 . 0 0 "[ . 1 . 2]" 1
371 1 20 THR HB 1 26 VAL HB . . 4.520 2.944 2.548 3.450 . 0 0 "[ . 1 . 2]" 1
372 1 20 THR HB 1 26 VAL MG1 . . 3.250 1.902 1.776 2.273 . 0 0 "[ . 1 . 2]" 1
373 1 20 THR HB 1 26 VAL MG2 . . 5.070 3.902 3.564 4.404 . 0 0 "[ . 1 . 2]" 1
374 1 20 THR HB 1 28 VAL MG2 . . 4.240 3.153 2.580 3.571 . 0 0 "[ . 1 . 2]" 1
375 1 20 THR HB 1 43 ALA MB . . 4.460 3.610 3.191 4.072 . 0 0 "[ . 1 . 2]" 1
376 1 20 THR HG1 1 20 THR MG . . 3.150 2.398 2.092 2.639 . 0 0 "[ . 1 . 2]" 1
377 1 20 THR HG1 1 21 ALA H . . 3.750 2.641 2.268 3.368 . 0 0 "[ . 1 . 2]" 1
378 1 20 THR HG1 1 26 VAL MG1 . . 4.710 4.050 3.630 4.537 . 0 0 "[ . 1 . 2]" 1
379 1 20 THR HG1 1 28 VAL HB . . 4.480 3.989 3.453 4.470 . 0 0 "[ . 1 . 2]" 1
380 1 20 THR HG1 1 28 VAL MG2 . . 3.820 2.826 2.139 3.411 . 0 0 "[ . 1 . 2]" 1
381 1 20 THR MG 1 21 ALA H . . 4.310 4.016 3.893 4.115 . 0 0 "[ . 1 . 2]" 1
382 1 20 THR MG 1 23 TYR QD . . 4.750 4.055 3.461 4.639 . 0 0 "[ . 1 . 2]" 1
383 1 20 THR MG 1 28 VAL MG2 . . 3.500 1.968 1.727 2.231 . 0 0 "[ . 1 . 2]" 1
384 1 20 THR MG 1 40 ALA HA . . 4.350 3.146 2.798 3.309 . 0 0 "[ . 1 . 2]" 1
385 1 20 THR MG 1 40 ALA MB . . 3.750 3.381 2.928 3.735 . 0 0 "[ . 1 . 2]" 1
386 1 20 THR MG 1 43 ALA H . . 4.910 4.562 4.294 4.862 . 0 0 "[ . 1 . 2]" 1
387 1 20 THR MG 1 43 ALA MB . . 3.170 2.251 1.880 2.645 . 0 0 "[ . 1 . 2]" 1
388 1 20 THR MG 1 44 ILE H . . 4.190 3.993 3.693 4.189 . 0 0 "[ . 1 . 2]" 1
389 1 20 THR MG 1 44 ILE HA . . 4.160 3.940 3.688 4.130 . 0 0 "[ . 1 . 2]" 1
390 1 20 THR MG 1 44 ILE HG12 . . 3.650 3.321 3.059 3.654 0.004 12 0 "[ . 1 . 2]" 1
391 1 21 ALA H 1 21 ALA MB . . 2.650 2.146 2.040 2.239 . 0 0 "[ . 1 . 2]" 1
392 1 21 ALA H 1 22 GLY H . . 4.890 3.620 2.816 4.589 . 0 0 "[ . 1 . 2]" 1
393 1 21 ALA H 1 23 TYR H . . 5.070 4.691 4.322 5.058 . 0 0 "[ . 1 . 2]" 1
394 1 21 ALA H 1 23 TYR QD . . 4.890 4.816 4.504 4.908 0.018 19 0 "[ . 1 . 2]" 1
395 1 21 ALA HA 1 23 TYR H . . 4.590 4.061 3.750 4.412 . 0 0 "[ . 1 . 2]" 1
396 1 21 ALA MB 1 22 GLY QA . . 5.240 3.563 3.334 3.742 . 0 0 "[ . 1 . 2]" 1
397 1 21 ALA MB 1 23 TYR H . . 4.660 4.544 4.324 4.698 0.038 20 0 "[ . 1 . 2]" 1
398 1 22 GLY H 1 23 TYR H . . 4.390 2.990 2.810 3.224 . 0 0 "[ . 1 . 2]" 1
399 1 23 TYR H 1 23 TYR HB2 . . 3.200 2.603 2.273 2.863 . 0 0 "[ . 1 . 2]" 1
400 1 23 TYR H 1 23 TYR HB3 . . 3.790 3.632 3.543 3.708 . 0 0 "[ . 1 . 2]" 1
401 1 23 TYR H 1 23 TYR QD . . 3.320 2.217 1.904 2.867 . 0 0 "[ . 1 . 2]" 1
402 1 23 TYR H 1 23 TYR QE . . 4.360 4.106 3.739 4.414 0.054 12 0 "[ . 1 . 2]" 1
403 1 23 TYR H 1 24 PRO HD2 . . 4.840 4.793 4.709 4.841 0.001 1 0 "[ . 1 . 2]" 1
404 1 23 TYR H 1 26 VAL HB . . 4.240 3.938 3.658 4.229 . 0 0 "[ . 1 . 2]" 1
405 1 23 TYR H 1 26 VAL MG1 . . 5.240 4.780 4.337 5.155 . 0 0 "[ . 1 . 2]" 1
406 1 23 TYR H 1 26 VAL MG2 . . 4.850 4.382 4.011 4.921 0.071 12 0 "[ . 1 . 2]" 1
407 1 23 TYR H 1 43 ALA MB . . 5.430 4.998 4.515 5.435 0.005 12 0 "[ . 1 . 2]" 1
408 1 23 TYR HA 1 23 TYR QD . . 4.350 3.005 2.531 3.264 . 0 0 "[ . 1 . 2]" 1
409 1 23 TYR HA 1 24 PRO HD2 . . 3.470 2.076 1.945 2.502 . 0 0 "[ . 1 . 2]" 1
410 1 23 TYR HA 1 24 PRO HD3 . . 3.390 2.289 2.251 2.361 . 0 0 "[ . 1 . 2]" 1
411 1 23 TYR HA 1 24 PRO HG2 . . 4.710 4.254 4.148 4.596 . 0 0 "[ . 1 . 2]" 1
412 1 23 TYR HA 1 26 VAL MG2 . . 4.860 4.291 3.888 4.696 . 0 0 "[ . 1 . 2]" 1
413 1 23 TYR HB2 1 26 VAL H . . 4.200 3.316 2.477 4.163 . 0 0 "[ . 1 . 2]" 1
414 1 23 TYR HB2 1 26 VAL HB . . 3.980 2.082 1.948 2.484 . 0 0 "[ . 1 . 2]" 1
415 1 23 TYR HB2 1 26 VAL MG1 . . 4.500 3.414 2.499 3.948 . 0 0 "[ . 1 . 2]" 1
416 1 23 TYR HB2 1 26 VAL MG2 . . 3.810 2.225 1.929 3.166 . 0 0 "[ . 1 . 2]" 1
417 1 23 TYR HB2 1 43 ALA MB . . 4.510 3.866 3.549 4.131 . 0 0 "[ . 1 . 2]" 1
418 1 23 TYR HB3 1 26 VAL H . . 4.500 3.475 2.946 3.965 . 0 0 "[ . 1 . 2]" 1
419 1 23 TYR HB3 1 26 VAL MG1 . . 5.260 4.430 2.979 5.207 . 0 0 "[ . 1 . 2]" 1
420 1 23 TYR HB3 1 26 VAL MG2 . . 3.420 2.344 1.866 2.897 . 0 0 "[ . 1 . 2]" 1
421 1 23 TYR HB3 1 43 ALA MB . . 4.960 4.471 3.685 4.921 . 0 0 "[ . 1 . 2]" 1
422 1 23 TYR HB3 1 55 PHE QE . . 4.180 3.140 2.720 3.910 . 0 0 "[ . 1 . 2]" 1
423 1 23 TYR HB3 1 55 PHE HZ . . 4.880 4.336 3.650 4.883 0.003 7 0 "[ . 1 . 2]" 1
424 1 23 TYR QD 1 43 ALA MB . . 4.050 3.061 2.618 3.544 . 0 0 "[ . 1 . 2]" 1
425 1 23 TYR QE 1 43 ALA HA . . 4.130 3.695 2.590 4.130 . 20 0 "[ . 1 . 2]" 1
426 1 23 TYR QE 1 43 ALA MB . . 4.190 3.135 2.612 3.665 . 0 0 "[ . 1 . 2]" 1
427 1 23 TYR QE 1 46 HIS QB . . 4.110 3.708 2.524 4.109 . 0 0 "[ . 1 . 2]" 1
428 1 23 TYR QE 1 46 HIS HE1 . . 4.460 3.788 2.768 4.468 0.008 14 0 "[ . 1 . 2]" 1
429 1 23 TYR QE 1 47 LYS H . . 4.410 4.296 3.560 4.411 0.001 16 0 "[ . 1 . 2]" 1
430 1 23 TYR QE 1 47 LYS HA . . 4.520 4.328 3.937 4.488 . 0 0 "[ . 1 . 2]" 1
431 1 23 TYR QE 1 47 LYS QB . . 3.930 3.073 2.703 3.555 . 0 0 "[ . 1 . 2]" 1
432 1 23 TYR QE 1 47 LYS HD2 . . 4.300 3.885 2.252 4.298 . 0 0 "[ . 1 . 2]" 1
433 1 23 TYR QE 1 47 LYS QD . . 3.570 2.591 2.101 2.986 . 0 0 "[ . 1 . 2]" 1
434 1 23 TYR QE 1 47 LYS HD3 . . 4.300 2.649 2.324 3.046 . 0 0 "[ . 1 . 2]" 1
435 1 23 TYR QE 1 47 LYS QE . . 4.500 3.989 1.992 4.503 0.003 4 0 "[ . 1 . 2]" 1
436 1 23 TYR QE 1 55 PHE QB . . 4.280 3.261 2.282 4.224 . 0 0 "[ . 1 . 2]" 1
437 1 23 TYR QE 1 55 PHE QD . . 4.300 3.173 2.137 4.255 . 0 0 "[ . 1 . 2]" 1
438 1 24 PRO HA 1 26 VAL H . . 4.640 4.042 3.520 4.627 . 0 0 "[ . 1 . 2]" 1
439 1 24 PRO QB 1 25 ASN H . . 3.820 2.996 2.797 3.380 . 0 0 "[ . 1 . 2]" 1
440 1 24 PRO HB2 1 25 ASN H . . 4.350 3.100 2.869 3.617 . 0 0 "[ . 1 . 2]" 1
441 1 24 PRO HB3 1 25 ASN H . . 4.350 3.994 3.872 4.228 . 0 0 "[ . 1 . 2]" 1
442 1 24 PRO HD2 1 26 VAL H . . 5.100 4.524 4.202 4.803 . 0 0 "[ . 1 . 2]" 1
443 1 24 PRO HD2 1 55 PHE QE . . 5.100 4.678 2.498 5.107 0.007 17 0 "[ . 1 . 2]" 1
444 1 24 PRO HD3 1 26 VAL H . . 5.500 5.474 5.367 5.581 0.081 12 0 "[ . 1 . 2]" 1
445 1 24 PRO HG2 1 26 VAL H . . 5.100 4.765 4.564 5.004 . 0 0 "[ . 1 . 2]" 1
446 1 25 ASN H 1 26 VAL H . . 3.470 2.810 2.586 3.034 . 0 0 "[ . 1 . 2]" 1
447 1 25 ASN H 1 26 VAL MG2 . . 4.880 3.764 3.193 4.410 . 0 0 "[ . 1 . 2]" 1
448 1 25 ASN HA 1 26 VAL H . . 3.550 3.237 2.895 3.552 0.002 9 0 "[ . 1 . 2]" 1
449 1 25 ASN HA 1 26 VAL MG2 . . 5.290 4.478 4.034 4.912 . 0 0 "[ . 1 . 2]" 1
450 1 25 ASN QB 1 39 LEU MD1 . . 3.630 3.025 2.388 3.450 . 0 0 "[ . 1 . 2]" 1
451 1 25 ASN QB 1 60 LYS QD . . 4.620 3.942 1.969 4.623 0.003 14 0 "[ . 1 . 2]" 1
452 1 25 ASN HB2 1 39 LEU MD1 . . 4.410 3.630 2.813 4.349 . 0 0 "[ . 1 . 2]" 1
453 1 25 ASN HB3 1 39 LEU MD1 . . 4.410 3.517 2.416 4.397 . 0 0 "[ . 1 . 2]" 1
454 1 26 VAL H 1 26 VAL HB . . 3.110 2.720 2.547 2.954 . 0 0 "[ . 1 . 2]" 1
455 1 26 VAL H 1 26 VAL MG1 . . 4.120 3.853 3.765 3.979 . 0 0 "[ . 1 . 2]" 1
456 1 26 VAL H 1 26 VAL MG2 . . 3.300 2.496 1.879 2.909 . 0 0 "[ . 1 . 2]" 1
457 1 26 VAL H 1 27 ASN H . . 4.640 4.401 4.071 4.634 . 0 0 "[ . 1 . 2]" 1
458 1 26 VAL HA 1 26 VAL MG1 . . 3.470 2.357 2.160 2.457 . 0 0 "[ . 1 . 2]" 1
459 1 26 VAL HA 1 26 VAL MG2 . . 3.430 2.432 2.292 2.539 . 0 0 "[ . 1 . 2]" 1
460 1 26 VAL HA 1 27 ASN H . . 2.810 2.190 2.140 2.311 . 0 0 "[ . 1 . 2]" 1
461 1 26 VAL HB 1 27 ASN H . . 4.530 4.044 3.665 4.443 . 0 0 "[ . 1 . 2]" 1
462 1 26 VAL MG1 1 27 ASN H . . 3.310 2.480 2.012 3.082 . 0 0 "[ . 1 . 2]" 1
463 1 26 VAL MG1 1 27 ASN HA . . 4.870 3.385 3.138 3.642 . 0 0 "[ . 1 . 2]" 1
464 1 26 VAL MG1 1 28 VAL H . . 4.180 3.829 3.444 4.154 . 0 0 "[ . 1 . 2]" 1
465 1 26 VAL MG1 1 28 VAL MG2 . . 3.310 2.831 2.454 3.043 . 0 0 "[ . 1 . 2]" 1
466 1 26 VAL MG1 1 39 LEU HB2 . . 5.500 4.128 3.586 4.691 . 0 0 "[ . 1 . 2]" 1
467 1 26 VAL MG1 1 40 ALA H . . 4.420 3.756 3.254 4.230 . 0 0 "[ . 1 . 2]" 1
468 1 26 VAL MG1 1 40 ALA HA . . 3.560 2.409 1.931 2.841 . 0 0 "[ . 1 . 2]" 1
469 1 26 VAL MG1 1 40 ALA MB . . 3.350 3.094 2.588 3.365 0.015 12 0 "[ . 1 . 2]" 1
470 1 26 VAL MG2 1 27 ASN H . . 4.390 4.055 3.897 4.213 . 0 0 "[ . 1 . 2]" 1
471 1 26 VAL MG2 1 39 LEU HB3 . . 3.710 2.647 2.335 2.918 . 0 0 "[ . 1 . 2]" 1
472 1 26 VAL MG2 1 40 ALA H . . 4.660 4.255 3.982 4.580 . 0 0 "[ . 1 . 2]" 1
473 1 26 VAL MG2 1 40 ALA HA . . 3.790 3.605 3.305 3.792 0.002 12 0 "[ . 1 . 2]" 1
474 1 26 VAL MG2 1 55 PHE QE . . 4.030 2.614 2.224 2.949 . 0 0 "[ . 1 . 2]" 1
475 1 26 VAL MG2 1 55 PHE HZ . . 3.490 2.009 1.826 2.310 . 0 0 "[ . 1 . 2]" 1
476 1 27 ASN H 1 27 ASN QB . . 3.420 2.851 2.608 3.270 . 0 0 "[ . 1 . 2]" 1
477 1 27 ASN H 1 28 VAL H . . 4.170 3.970 3.652 4.175 0.005 9 0 "[ . 1 . 2]" 1
478 1 27 ASN H 1 28 VAL HA . . 4.890 4.511 4.299 4.646 . 0 0 "[ . 1 . 2]" 1
479 1 27 ASN H 1 28 VAL MG2 . . 4.290 3.889 3.501 4.294 0.004 17 0 "[ . 1 . 2]" 1
480 1 27 ASN H 1 40 ALA MB . . 5.460 4.586 4.076 5.262 . 0 0 "[ . 1 . 2]" 1
481 1 27 ASN HA 1 28 VAL H . . 2.870 2.148 2.140 2.166 . 0 0 "[ . 1 . 2]" 1
482 1 27 ASN QB 1 27 ASN HD22 . . 3.730 3.261 3.213 3.380 . 0 0 "[ . 1 . 2]" 1
483 1 27 ASN QB 1 28 VAL H . . 3.810 3.594 3.257 3.881 0.071 19 0 "[ . 1 . 2]" 1
484 1 28 VAL H 1 28 VAL HB . . 3.280 2.594 2.509 2.765 . 0 0 "[ . 1 . 2]" 1
485 1 28 VAL H 1 28 VAL MG1 . . 3.970 3.813 3.779 3.856 . 0 0 "[ . 1 . 2]" 1
486 1 28 VAL H 1 28 VAL MG2 . . 3.340 2.326 2.103 2.700 . 0 0 "[ . 1 . 2]" 1
487 1 28 VAL HA 1 28 VAL MG1 . . 3.480 2.330 2.196 2.400 . 0 0 "[ . 1 . 2]" 1
488 1 28 VAL HA 1 28 VAL MG2 . . 3.450 2.459 2.289 2.596 . 0 0 "[ . 1 . 2]" 1
489 1 28 VAL HA 1 30 ASN H . . 4.320 3.444 2.948 3.838 . 0 0 "[ . 1 . 2]" 1
490 1 28 VAL HA 1 35 TRP HE1 . . 5.230 5.009 4.596 5.232 0.002 9 0 "[ . 1 . 2]" 1
491 1 28 VAL MG1 1 29 HIS HA . . 4.660 4.120 3.931 4.605 . 0 0 "[ . 1 . 2]" 1
492 1 28 VAL MG1 1 30 ASN H . . 3.690 3.409 2.608 3.697 0.007 12 0 "[ . 1 . 2]" 1
493 1 28 VAL MG1 1 34 SER HB2 . . 4.640 3.855 3.397 4.219 . 0 0 "[ . 1 . 2]" 1
494 1 28 VAL MG1 1 34 SER HB3 . . 4.640 3.662 3.302 4.343 . 0 0 "[ . 1 . 2]" 1
495 1 28 VAL MG1 1 35 TRP HE1 . . 3.550 3.185 2.560 3.543 . 0 0 "[ . 1 . 2]" 1
496 1 28 VAL MG1 1 35 TRP HH2 . . 4.610 3.924 3.591 4.511 . 0 0 "[ . 1 . 2]" 1
497 1 28 VAL MG1 1 35 TRP HZ2 . . 3.410 2.507 2.033 2.997 . 0 0 "[ . 1 . 2]" 1
498 1 28 VAL MG1 1 40 ALA MB . . 4.200 4.105 3.714 4.212 0.012 19 0 "[ . 1 . 2]" 1
499 1 28 VAL MG1 1 44 ILE MD . . 5.500 4.917 4.711 5.236 . 0 0 "[ . 1 . 2]" 1
500 1 28 VAL MG2 1 34 SER HB2 . . 5.500 4.713 3.990 5.225 . 0 0 "[ . 1 . 2]" 1
501 1 28 VAL MG2 1 34 SER HB3 . . 5.500 4.442 3.588 4.947 . 0 0 "[ . 1 . 2]" 1
502 1 28 VAL MG2 1 35 TRP HE1 . . 5.470 4.608 4.022 5.083 . 0 0 "[ . 1 . 2]" 1
503 1 28 VAL MG2 1 35 TRP HH2 . . 5.130 3.963 3.339 4.702 . 0 0 "[ . 1 . 2]" 1
504 1 28 VAL MG2 1 35 TRP HZ2 . . 4.300 3.639 3.010 4.130 . 0 0 "[ . 1 . 2]" 1
505 1 28 VAL MG2 1 40 ALA MB . . 3.360 2.949 2.681 3.118 . 0 0 "[ . 1 . 2]" 1
506 1 28 VAL MG2 1 44 ILE MD . . 4.680 4.285 3.905 4.649 . 0 0 "[ . 1 . 2]" 1
507 1 29 HIS QB 1 30 ASN H . . 4.070 2.937 2.550 3.867 . 0 0 "[ . 1 . 2]" 1
508 1 29 HIS HB2 1 30 ASN H . . 4.790 3.806 2.689 4.325 . 0 0 "[ . 1 . 2]" 1
509 1 29 HIS HB3 1 30 ASN H . . 4.790 3.234 2.582 4.434 . 0 0 "[ . 1 . 2]" 1
510 1 30 ASN H 1 30 ASN HD21 . . 4.850 2.847 1.978 4.061 . 0 0 "[ . 1 . 2]" 1
511 1 30 ASN H 1 30 ASN QD . . 4.200 2.669 1.957 3.564 . 0 0 "[ . 1 . 2]" 1
512 1 30 ASN H 1 30 ASN HD22 . . 4.850 3.304 3.045 3.946 . 0 0 "[ . 1 . 2]" 1
513 1 30 ASN H 1 31 PHE H . . 4.540 4.405 4.360 4.453 . 0 0 "[ . 1 . 2]" 1
514 1 30 ASN H 1 32 THR H . . 5.210 4.527 4.235 4.792 . 0 0 "[ . 1 . 2]" 1
515 1 30 ASN H 1 34 SER H . . 5.220 5.078 4.759 5.215 . 0 0 "[ . 1 . 2]" 1
516 1 30 ASN H 1 34 SER HB2 . . 4.460 2.741 2.406 3.665 . 0 0 "[ . 1 . 2]" 1
517 1 30 ASN H 1 34 SER QB . . 3.750 2.607 2.366 3.221 . 0 0 "[ . 1 . 2]" 1
518 1 30 ASN H 1 34 SER HB3 . . 4.460 3.587 2.552 4.082 . 0 0 "[ . 1 . 2]" 1
519 1 30 ASN H 1 35 TRP HE1 . . 5.500 5.084 4.591 5.348 . 0 0 "[ . 1 . 2]" 1
520 1 30 ASN HA 1 31 PHE H . . 3.270 2.563 2.448 2.641 . 0 0 "[ . 1 . 2]" 1
521 1 30 ASN HA 1 32 THR H . . 4.340 4.253 4.092 4.363 0.023 19 0 "[ . 1 . 2]" 1
522 1 30 ASN QB 1 31 PHE H . . 2.920 2.103 1.941 2.345 . 0 0 "[ . 1 . 2]" 1
523 1 30 ASN QB 1 32 THR H . . 3.430 2.369 2.217 2.503 . 0 0 "[ . 1 . 2]" 1
524 1 30 ASN HB2 1 31 PHE H . . 3.410 2.128 1.956 2.390 . 0 0 "[ . 1 . 2]" 1
525 1 30 ASN HB2 1 32 THR H . . 4.180 2.384 2.229 2.523 . 0 0 "[ . 1 . 2]" 1
526 1 30 ASN HB3 1 31 PHE H . . 3.410 3.295 3.199 3.411 0.001 13 0 "[ . 1 . 2]" 1
527 1 30 ASN HB3 1 32 THR H . . 4.180 4.100 3.954 4.184 0.004 15 0 "[ . 1 . 2]" 1
528 1 30 ASN QD 1 31 PHE H . . 4.410 3.577 3.431 3.815 . 0 0 "[ . 1 . 2]" 1
529 1 30 ASN QD 1 32 THR H . . 4.490 2.244 1.810 2.832 . 0 0 "[ . 1 . 2]" 1
530 1 30 ASN QD 1 33 THR H . . 3.560 2.497 1.947 3.154 . 0 0 "[ . 1 . 2]" 1
531 1 30 ASN QD 1 33 THR MG . . 4.430 3.790 3.256 4.307 . 0 0 "[ . 1 . 2]" 1
532 1 30 ASN QD 1 34 SER H . . 3.490 2.590 2.023 3.059 . 0 0 "[ . 1 . 2]" 1
533 1 30 ASN HD21 1 33 THR H . . 4.320 2.716 2.042 3.747 . 0 0 "[ . 1 . 2]" 1
534 1 30 ASN HD21 1 34 SER H . . 4.190 2.747 2.081 3.261 . 0 0 "[ . 1 . 2]" 1
535 1 30 ASN HD22 1 33 THR H . . 4.320 3.007 2.293 3.507 . 0 0 "[ . 1 . 2]" 1
536 1 30 ASN HD22 1 34 SER H . . 4.190 3.212 2.639 3.727 . 0 0 "[ . 1 . 2]" 1
537 1 31 PHE H 1 31 PHE HB2 . . 3.600 2.439 2.366 2.544 . 0 0 "[ . 1 . 2]" 1
538 1 31 PHE H 1 31 PHE HB3 . . 3.940 3.643 3.605 3.685 . 0 0 "[ . 1 . 2]" 1
539 1 31 PHE H 1 31 PHE QD . . 3.940 3.454 2.822 3.854 . 0 0 "[ . 1 . 2]" 1
540 1 31 PHE H 1 32 THR H . . 3.080 2.545 2.312 2.806 . 0 0 "[ . 1 . 2]" 1
541 1 31 PHE H 1 32 THR MG . . 4.150 3.552 3.013 4.161 0.011 14 0 "[ . 1 . 2]" 1
542 1 31 PHE H 1 35 TRP HE1 . . 4.740 4.725 4.623 4.759 0.019 17 0 "[ . 1 . 2]" 1
543 1 31 PHE H 1 96 GLU QG . . 5.340 5.307 5.179 5.384 0.044 12 0 "[ . 1 . 2]" 1
544 1 31 PHE HA 1 31 PHE QD . . 3.680 2.361 2.083 2.844 . 0 0 "[ . 1 . 2]" 1
545 1 31 PHE HA 1 31 PHE QE . . 4.610 4.336 4.195 4.553 . 0 0 "[ . 1 . 2]" 1
546 1 31 PHE HA 1 32 THR H . . 3.530 2.982 2.913 3.119 . 0 0 "[ . 1 . 2]" 1
547 1 31 PHE HA 1 35 TRP H . . 4.850 4.753 4.621 4.859 0.009 14 0 "[ . 1 . 2]" 1
548 1 31 PHE HA 1 35 TRP HD1 . . 3.670 2.742 2.571 2.938 . 0 0 "[ . 1 . 2]" 1
549 1 31 PHE HA 1 35 TRP HE1 . . 2.940 1.960 1.901 2.107 . 0 0 "[ . 1 . 2]" 1
550 1 31 PHE HA 1 99 ILE MG . . 4.310 3.833 3.651 4.054 . 0 0 "[ . 1 . 2]" 1
551 1 31 PHE HB2 1 32 THR H . . 4.520 4.055 3.847 4.147 . 0 0 "[ . 1 . 2]" 1
552 1 31 PHE HB2 1 32 THR MG . . 4.520 3.769 3.378 4.132 . 0 0 "[ . 1 . 2]" 1
553 1 31 PHE HB2 1 96 GLU QG . . 4.560 3.964 3.604 4.269 . 0 0 "[ . 1 . 2]" 1
554 1 31 PHE HB2 1 100 ILE MD . . 4.460 2.893 2.545 3.466 . 0 0 "[ . 1 . 2]" 1
555 1 31 PHE HB2 1 100 ILE HG13 . . 5.130 3.414 3.101 3.970 . 0 0 "[ . 1 . 2]" 1
556 1 31 PHE HB3 1 32 THR H . . 4.520 4.352 4.292 4.434 . 0 0 "[ . 1 . 2]" 1
557 1 31 PHE HB3 1 32 THR MG . . 4.550 4.102 3.834 4.429 . 0 0 "[ . 1 . 2]" 1
558 1 31 PHE HB3 1 96 GLU QG . . 5.100 4.426 3.963 4.939 . 0 0 "[ . 1 . 2]" 1
559 1 31 PHE HB3 1 99 ILE HB . . 4.050 3.216 3.016 3.454 . 0 0 "[ . 1 . 2]" 1
560 1 31 PHE HB3 1 99 ILE MG . . 4.370 3.589 3.258 3.866 . 0 0 "[ . 1 . 2]" 1
561 1 31 PHE HB3 1 100 ILE MD . . 4.110 3.117 2.843 3.553 . 0 0 "[ . 1 . 2]" 1
562 1 31 PHE HB3 1 100 ILE HG13 . . 4.220 2.412 2.141 2.936 . 0 0 "[ . 1 . 2]" 1
563 1 31 PHE QD 1 35 TRP HE1 . . 4.310 2.144 1.897 2.748 . 0 0 "[ . 1 . 2]" 1
564 1 31 PHE QD 1 97 LYS QE . . 5.500 5.417 4.813 5.516 0.016 12 0 "[ . 1 . 2]" 1
565 1 31 PHE QD 1 99 ILE MD . . 5.160 4.622 4.349 4.913 . 0 0 "[ . 1 . 2]" 1
566 1 31 PHE QD 1 99 ILE MG . . 3.540 3.188 2.822 3.515 . 0 0 "[ . 1 . 2]" 1
567 1 31 PHE QD 1 100 ILE HA . . 4.690 3.778 3.036 4.195 . 0 0 "[ . 1 . 2]" 1
568 1 31 PHE QD 1 100 ILE MD . . 3.860 2.646 2.186 3.041 . 0 0 "[ . 1 . 2]" 1
569 1 31 PHE QD 1 100 ILE MG . . 4.670 4.163 3.861 4.484 . 0 0 "[ . 1 . 2]" 1
570 1 31 PHE QD 1 103 VAL MG2 . . 5.500 4.548 4.221 4.708 . 0 0 "[ . 1 . 2]" 1
571 1 31 PHE QE 1 35 TRP HE1 . . 5.140 3.640 3.341 4.126 . 0 0 "[ . 1 . 2]" 1
572 1 31 PHE QE 1 100 ILE MD . . 4.640 3.752 3.474 4.016 . 0 0 "[ . 1 . 2]" 1
573 1 31 PHE QE 1 103 VAL MG2 . . 3.840 3.429 2.941 3.841 0.001 14 0 "[ . 1 . 2]" 1
574 1 32 THR H 1 32 THR HB . . 4.160 3.765 3.618 3.869 . 0 0 "[ . 1 . 2]" 1
575 1 32 THR H 1 32 THR MG . . 3.550 3.138 2.791 3.471 . 0 0 "[ . 1 . 2]" 1
576 1 32 THR H 1 33 THR H . . 3.530 2.511 2.290 2.655 . 0 0 "[ . 1 . 2]" 1
577 1 32 THR H 1 33 THR HA . . 5.340 4.793 4.723 4.951 . 0 0 "[ . 1 . 2]" 1
578 1 32 THR H 1 33 THR MG . . 4.890 4.540 4.421 4.682 . 0 0 "[ . 1 . 2]" 1
579 1 32 THR H 1 34 SER H . . 3.690 3.018 2.560 3.439 . 0 0 "[ . 1 . 2]" 1
580 1 32 THR H 1 34 SER QB . . 4.390 3.319 3.022 4.000 . 0 0 "[ . 1 . 2]" 1
581 1 32 THR H 1 35 TRP H . . 5.020 4.381 4.061 4.759 . 0 0 "[ . 1 . 2]" 1
582 1 32 THR H 1 35 TRP HD1 . . 4.170 3.625 3.347 3.971 . 0 0 "[ . 1 . 2]" 1
583 1 32 THR H 1 35 TRP HE1 . . 5.200 4.511 4.373 4.702 . 0 0 "[ . 1 . 2]" 1
584 1 32 THR H 1 94 PRO HD2 . . 5.500 5.489 5.347 5.523 0.023 12 0 "[ . 1 . 2]" 1
585 1 32 THR H 1 99 ILE MD . . 4.850 4.464 4.373 4.631 . 0 0 "[ . 1 . 2]" 1
586 1 32 THR H 1 99 ILE MG . . 5.500 5.477 5.294 5.528 0.028 12 0 "[ . 1 . 2]" 1
587 1 32 THR HA 1 32 THR MG . . 3.200 2.200 1.992 2.450 . 0 0 "[ . 1 . 2]" 1
588 1 32 THR HA 1 34 SER H . . 4.110 3.879 3.826 3.956 . 0 0 "[ . 1 . 2]" 1
589 1 32 THR HA 1 35 TRP H . . 4.500 4.369 4.034 4.500 0.000 4 0 "[ . 1 . 2]" 1
590 1 32 THR HA 1 36 ARG H . . 5.500 5.320 4.780 5.520 0.020 12 0 "[ . 1 . 2]" 1
591 1 32 THR HA 1 94 PRO HB2 . . 4.080 3.863 3.562 3.975 . 0 0 "[ . 1 . 2]" 1
592 1 32 THR HA 1 94 PRO HB3 . . 4.910 4.887 4.584 4.949 0.039 17 0 "[ . 1 . 2]" 1
593 1 32 THR HA 1 94 PRO HG2 . . 4.270 1.993 1.968 2.011 . 0 0 "[ . 1 . 2]" 1
594 1 32 THR HA 1 94 PRO HG3 . . 4.600 3.339 2.991 3.510 . 0 0 "[ . 1 . 2]" 1
595 1 32 THR HA 1 96 GLU HA . . 4.550 3.584 3.411 3.706 . 0 0 "[ . 1 . 2]" 1
596 1 32 THR HA 1 96 GLU QB . . 4.720 3.693 3.318 4.015 . 0 0 "[ . 1 . 2]" 1
597 1 32 THR HA 1 99 ILE MD . . 3.550 2.641 2.365 2.797 . 0 0 "[ . 1 . 2]" 1
598 1 32 THR HB 1 33 THR H . . 3.310 2.872 2.637 3.163 . 0 0 "[ . 1 . 2]" 1
599 1 32 THR HB 1 33 THR MG . . 3.810 2.978 2.661 3.287 . 0 0 "[ . 1 . 2]" 1
600 1 32 THR HB 1 94 PRO HD2 . . 4.100 2.191 1.997 2.423 . 0 0 "[ . 1 . 2]" 1
601 1 32 THR HB 1 94 PRO HD3 . . 4.200 3.925 3.600 4.182 . 0 0 "[ . 1 . 2]" 1
602 1 32 THR HB 1 94 PRO HG2 . . 4.160 2.807 2.114 3.350 . 0 0 "[ . 1 . 2]" 1
603 1 32 THR MG 1 33 THR H . . 3.920 3.729 3.572 3.935 0.015 14 0 "[ . 1 . 2]" 1
604 1 32 THR MG 1 33 THR MG . . 4.370 4.126 4.037 4.292 . 0 0 "[ . 1 . 2]" 1
605 1 32 THR MG 1 91 VAL MG1 . . 5.500 5.126 4.654 5.461 . 0 0 "[ . 1 . 2]" 1
606 1 32 THR MG 1 94 PRO HB2 . . 4.450 4.115 3.453 4.448 . 0 0 "[ . 1 . 2]" 1
607 1 32 THR MG 1 94 PRO HD2 . . 4.460 3.362 2.765 3.810 . 0 0 "[ . 1 . 2]" 1
608 1 32 THR MG 1 94 PRO HG2 . . 3.750 2.909 2.372 3.307 . 0 0 "[ . 1 . 2]" 1
609 1 32 THR MG 1 94 PRO HG3 . . 5.110 4.403 3.842 4.808 . 0 0 "[ . 1 . 2]" 1
610 1 32 THR MG 1 96 GLU H . . 3.590 2.443 2.163 2.593 . 0 0 "[ . 1 . 2]" 1
611 1 32 THR MG 1 96 GLU HA . . 3.570 2.823 2.456 3.110 . 0 0 "[ . 1 . 2]" 1
612 1 32 THR MG 1 96 GLU QB . . 3.150 1.834 1.758 1.992 . 0 0 "[ . 1 . 2]" 1
613 1 32 THR MG 1 96 GLU HG2 . . 4.270 3.511 2.445 4.262 . 0 0 "[ . 1 . 2]" 1
614 1 32 THR MG 1 96 GLU QG . . 3.660 3.197 2.411 3.589 . 0 0 "[ . 1 . 2]" 1
615 1 32 THR MG 1 96 GLU HG3 . . 4.270 3.933 3.613 4.218 . 0 0 "[ . 1 . 2]" 1
616 1 32 THR MG 1 97 LYS H . . 4.650 4.581 4.345 4.657 0.007 7 0 "[ . 1 . 2]" 1
617 1 32 THR MG 1 100 ILE MD . . 5.500 4.813 4.492 5.248 . 0 0 "[ . 1 . 2]" 1
618 1 33 THR H 1 33 THR HB . . 4.210 3.659 3.630 3.693 . 0 0 "[ . 1 . 2]" 1
619 1 33 THR H 1 33 THR MG . . 2.930 2.411 2.269 2.566 . 0 0 "[ . 1 . 2]" 1
620 1 33 THR H 1 34 SER H . . 3.410 2.901 2.607 3.118 . 0 0 "[ . 1 . 2]" 1
621 1 33 THR H 1 35 TRP H . . 5.070 4.654 4.353 4.823 . 0 0 "[ . 1 . 2]" 1
622 1 33 THR H 1 94 PRO HD2 . . 4.400 4.255 4.030 4.417 0.017 14 0 "[ . 1 . 2]" 1
623 1 33 THR H 1 94 PRO HG2 . . 4.940 4.645 4.206 4.854 . 0 0 "[ . 1 . 2]" 1
624 1 33 THR HA 1 33 THR MG . . 3.180 2.372 2.247 2.468 . 0 0 "[ . 1 . 2]" 1
625 1 33 THR HA 1 35 TRP H . . 4.140 3.945 3.797 4.077 . 0 0 "[ . 1 . 2]" 1
626 1 33 THR HA 1 36 ARG H . . 4.570 3.419 3.143 3.595 . 0 0 "[ . 1 . 2]" 1
627 1 33 THR HA 1 36 ARG QB . . 4.540 2.564 2.313 2.755 . 0 0 "[ . 1 . 2]" 1
628 1 33 THR HA 1 36 ARG QG . . 4.410 4.276 4.120 4.413 0.003 12 0 "[ . 1 . 2]" 1
629 1 33 THR HA 1 94 PRO HD2 . . 4.350 4.046 3.917 4.161 . 0 0 "[ . 1 . 2]" 1
630 1 33 THR HA 1 94 PRO HG2 . . 4.830 4.707 4.512 4.861 0.031 12 0 "[ . 1 . 2]" 1
631 1 33 THR HB 1 36 ARG H . . 5.500 5.345 5.149 5.502 0.002 17 0 "[ . 1 . 2]" 1
632 1 33 THR MG 1 34 SER H . . 4.550 4.290 4.179 4.341 . 0 0 "[ . 1 . 2]" 1
633 1 33 THR MG 1 94 PRO HD2 . . 3.920 3.220 2.922 3.458 . 0 0 "[ . 1 . 2]" 1
634 1 33 THR MG 1 94 PRO HD3 . . 4.420 4.008 3.669 4.237 . 0 0 "[ . 1 . 2]" 1
635 1 33 THR MG 1 94 PRO HG2 . . 4.940 4.639 4.366 4.837 . 0 0 "[ . 1 . 2]" 1
636 1 34 SER H 1 34 SER HB2 . . 3.460 2.980 2.237 3.503 0.043 19 0 "[ . 1 . 2]" 1
637 1 34 SER H 1 34 SER QB . . 3.020 2.443 2.212 2.978 . 0 0 "[ . 1 . 2]" 1
638 1 34 SER H 1 34 SER HB3 . . 3.460 2.804 2.362 3.513 0.053 6 0 "[ . 1 . 2]" 1
639 1 34 SER H 1 35 TRP H . . 3.460 1.938 1.789 2.197 . 0 0 "[ . 1 . 2]" 1
640 1 34 SER H 1 35 TRP HA . . 4.960 4.699 4.572 4.923 . 0 0 "[ . 1 . 2]" 1
641 1 34 SER H 1 35 TRP HD1 . . 3.900 2.930 2.806 3.134 . 0 0 "[ . 1 . 2]" 1
642 1 34 SER H 1 35 TRP HE1 . . 5.020 4.798 4.621 4.933 . 0 0 "[ . 1 . 2]" 1
643 1 34 SER H 1 36 ARG H . . 4.550 3.192 2.917 3.798 . 0 0 "[ . 1 . 2]" 1
644 1 34 SER HA 1 36 ARG H . . 4.960 4.106 3.961 4.471 . 0 0 "[ . 1 . 2]" 1
645 1 34 SER QB 1 35 TRP H . . 4.040 2.976 2.803 3.327 . 0 0 "[ . 1 . 2]" 1
646 1 34 SER QB 1 35 TRP HD1 . . 4.020 2.610 2.292 3.508 . 0 0 "[ . 1 . 2]" 1
647 1 34 SER QB 1 35 TRP HE1 . . 3.920 2.902 2.598 3.592 . 0 0 "[ . 1 . 2]" 1
648 1 34 SER HB2 1 35 TRP HD1 . . 4.580 3.894 2.700 4.445 . 0 0 "[ . 1 . 2]" 1
649 1 34 SER HB3 1 35 TRP HD1 . . 4.580 2.846 2.306 4.558 . 0 0 "[ . 1 . 2]" 1
650 1 35 TRP H 1 35 TRP HB2 . . 3.290 2.788 2.712 2.882 . 0 0 "[ . 1 . 2]" 1
651 1 35 TRP H 1 35 TRP HB3 . . 3.870 3.780 3.727 3.823 . 0 0 "[ . 1 . 2]" 1
652 1 35 TRP H 1 35 TRP HD1 . . 3.210 2.270 2.123 2.421 . 0 0 "[ . 1 . 2]" 1
653 1 35 TRP H 1 35 TRP HE1 . . 4.690 4.557 4.430 4.683 . 0 0 "[ . 1 . 2]" 1
654 1 35 TRP H 1 36 ARG H . . 2.990 2.117 1.935 2.306 . 0 0 "[ . 1 . 2]" 1
655 1 35 TRP H 1 36 ARG HB2 . . 4.750 4.144 3.908 4.461 . 0 0 "[ . 1 . 2]" 1
656 1 35 TRP H 1 36 ARG QB . . 3.990 3.805 3.727 3.887 . 0 0 "[ . 1 . 2]" 1
657 1 35 TRP H 1 36 ARG HB3 . . 4.750 4.473 4.092 4.751 0.001 7 0 "[ . 1 . 2]" 1
658 1 35 TRP H 1 89 VAL MG1 . . 4.890 4.593 4.337 4.866 . 0 0 "[ . 1 . 2]" 1
659 1 35 TRP H 1 99 ILE MD . . 4.700 3.935 3.688 4.089 . 0 0 "[ . 1 . 2]" 1
660 1 35 TRP H 1 99 ILE MG . . 4.840 4.659 4.461 4.815 . 0 0 "[ . 1 . 2]" 1
661 1 35 TRP HA 1 37 ASP H . . 5.500 4.034 3.655 4.328 . 0 0 "[ . 1 . 2]" 1
662 1 35 TRP HA 1 38 GLY H . . 4.270 3.363 2.876 3.613 . 0 0 "[ . 1 . 2]" 1
663 1 35 TRP HA 1 40 ALA MB . . 4.120 2.400 2.057 2.737 . 0 0 "[ . 1 . 2]" 1
664 1 35 TRP HB2 1 36 ARG H . . 4.050 3.626 3.116 3.958 . 0 0 "[ . 1 . 2]" 1
665 1 35 TRP HB2 1 89 VAL MG1 . . 4.440 3.001 2.767 3.225 . 0 0 "[ . 1 . 2]" 1
666 1 35 TRP HB2 1 99 ILE MD . . 3.850 2.527 2.128 2.705 . 0 0 "[ . 1 . 2]" 1
667 1 35 TRP HB2 1 99 ILE MG . . 4.380 2.977 2.717 3.202 . 0 0 "[ . 1 . 2]" 1
668 1 35 TRP HB3 1 41 PHE QE . . 4.670 2.229 2.024 2.464 . 0 0 "[ . 1 . 2]" 1
669 1 35 TRP HB3 1 89 VAL MG1 . . 3.970 3.551 3.341 3.825 . 0 0 "[ . 1 . 2]" 1
670 1 35 TRP HB3 1 99 ILE MD . . 4.100 3.933 3.541 4.100 0.000 16 0 "[ . 1 . 2]" 1
671 1 35 TRP HD1 1 36 ARG H . . 4.660 4.293 3.974 4.627 . 0 0 "[ . 1 . 2]" 1
672 1 35 TRP HD1 1 99 ILE MG . . 4.490 3.150 2.929 3.319 . 0 0 "[ . 1 . 2]" 1
673 1 35 TRP HE1 1 99 ILE MG . . 4.250 3.596 3.336 3.890 . 0 0 "[ . 1 . 2]" 1
674 1 35 TRP HE3 1 40 ALA MB . . 4.160 2.571 2.153 2.993 . 0 0 "[ . 1 . 2]" 1
675 1 35 TRP HE3 1 41 PHE H . . 3.960 3.156 2.899 3.333 . 0 0 "[ . 1 . 2]" 1
676 1 35 TRP HH2 1 40 ALA MB . . 4.650 4.139 3.929 4.301 . 0 0 "[ . 1 . 2]" 1
677 1 35 TRP HH2 1 44 ILE MD . . 3.060 2.090 1.968 2.337 . 0 0 "[ . 1 . 2]" 1
678 1 35 TRP HH2 1 103 VAL MG1 . . 4.170 3.934 3.671 4.153 . 0 0 "[ . 1 . 2]" 1
679 1 35 TRP HH2 1 103 VAL MG2 . . 3.640 2.023 1.914 2.202 . 0 0 "[ . 1 . 2]" 1
680 1 35 TRP HZ2 1 44 ILE MD . . 4.530 4.261 4.004 4.478 . 0 0 "[ . 1 . 2]" 1
681 1 35 TRP HZ2 1 103 VAL MG1 . . 4.640 3.579 3.382 3.755 . 0 0 "[ . 1 . 2]" 1
682 1 35 TRP HZ2 1 103 VAL MG2 . . 4.190 3.079 2.705 3.242 . 0 0 "[ . 1 . 2]" 1
683 1 35 TRP HZ3 1 40 ALA MB . . 4.210 3.171 2.831 3.417 . 0 0 "[ . 1 . 2]" 1
684 1 35 TRP HZ3 1 41 PHE H . . 4.260 4.145 3.946 4.256 . 0 0 "[ . 1 . 2]" 1
685 1 35 TRP HZ3 1 41 PHE HA . . 4.370 2.829 2.613 3.019 . 0 0 "[ . 1 . 2]" 1
686 1 35 TRP HZ3 1 44 ILE MD . . 3.610 1.954 1.795 2.088 . 0 0 "[ . 1 . 2]" 1
687 1 35 TRP HZ3 1 103 VAL MG1 . . 5.070 4.930 4.729 5.074 0.004 19 0 "[ . 1 . 2]" 1
688 1 36 ARG H 1 36 ARG HB2 . . 3.250 2.540 2.360 2.777 . 0 0 "[ . 1 . 2]" 1
689 1 36 ARG H 1 36 ARG QB . . 2.810 2.240 2.219 2.257 . 0 0 "[ . 1 . 2]" 1
690 1 36 ARG H 1 36 ARG HB3 . . 3.250 2.520 2.358 2.702 . 0 0 "[ . 1 . 2]" 1
691 1 36 ARG H 1 36 ARG QD . . 4.730 4.397 4.083 4.727 . 0 0 "[ . 1 . 2]" 1
692 1 36 ARG H 1 36 ARG HG2 . . 4.770 4.428 4.323 4.477 . 0 0 "[ . 1 . 2]" 1
693 1 36 ARG H 1 36 ARG QG . . 4.130 3.982 3.928 4.040 . 0 0 "[ . 1 . 2]" 1
694 1 36 ARG H 1 36 ARG HG3 . . 4.770 4.518 4.368 4.633 . 0 0 "[ . 1 . 2]" 1
695 1 36 ARG H 1 37 ASP H . . 3.430 2.785 2.482 2.979 . 0 0 "[ . 1 . 2]" 1
696 1 36 ARG H 1 37 ASP HA . . 5.500 5.368 5.134 5.521 0.021 19 0 "[ . 1 . 2]" 1
697 1 36 ARG H 1 37 ASP QB . . 5.080 4.716 4.379 5.082 0.002 15 0 "[ . 1 . 2]" 1
698 1 36 ARG H 1 90 ASN HA . . 5.500 5.463 5.138 5.535 0.035 12 0 "[ . 1 . 2]" 1
699 1 36 ARG HA 1 36 ARG QG . . 3.670 2.503 2.397 2.664 . 0 0 "[ . 1 . 2]" 1
700 1 36 ARG HA 1 67 LEU MD2 . . 4.160 3.970 3.488 4.168 0.008 14 0 "[ . 1 . 2]" 1
701 1 36 ARG HA 1 89 VAL MG1 . . 3.070 2.495 2.231 2.854 . 0 0 "[ . 1 . 2]" 1
702 1 36 ARG HA 1 90 ASN HA . . 4.560 2.801 2.484 2.989 . 0 0 "[ . 1 . 2]" 1
703 1 36 ARG HA 1 91 VAL H . . 4.630 3.477 3.257 3.827 . 0 0 "[ . 1 . 2]" 1
704 1 36 ARG QB 1 37 ASP H . . 3.940 2.442 2.209 2.746 . 0 0 "[ . 1 . 2]" 1
705 1 36 ARG QB 1 91 VAL H . . 4.720 3.500 3.005 3.808 . 0 0 "[ . 1 . 2]" 1
706 1 36 ARG HB2 1 37 ASP H . . 4.600 3.816 3.600 4.048 . 0 0 "[ . 1 . 2]" 1
707 1 36 ARG HB3 1 37 ASP H . . 4.600 2.472 2.227 2.794 . 0 0 "[ . 1 . 2]" 1
708 1 36 ARG QD 1 91 VAL H . . 4.020 3.611 3.262 3.939 . 0 0 "[ . 1 . 2]" 1
709 1 36 ARG HD2 1 91 VAL H . . 4.820 3.982 3.386 4.636 . 0 0 "[ . 1 . 2]" 1
710 1 36 ARG HD3 1 91 VAL H . . 4.820 4.361 3.736 4.822 0.002 6 0 "[ . 1 . 2]" 1
711 1 36 ARG QG 1 90 ASN HA . . 3.520 2.199 1.987 2.470 . 0 0 "[ . 1 . 2]" 1
712 1 36 ARG QG 1 91 VAL H . . 3.440 1.924 1.836 2.183 . 0 0 "[ . 1 . 2]" 1
713 1 36 ARG HG2 1 90 ASN HA . . 4.070 2.428 1.995 3.514 . 0 0 "[ . 1 . 2]" 1
714 1 36 ARG HG3 1 90 ASN HA . . 4.070 2.988 2.352 3.795 . 0 0 "[ . 1 . 2]" 1
715 1 37 ASP HA 1 63 ALA H . . 5.500 5.351 4.881 5.515 0.015 12 0 "[ . 1 . 2]" 1
716 1 37 ASP HA 1 63 ALA HA . . 4.250 3.711 3.110 4.220 . 0 0 "[ . 1 . 2]" 1
717 1 37 ASP HA 1 63 ALA MB . . 3.220 2.056 1.954 2.340 . 0 0 "[ . 1 . 2]" 1
718 1 37 ASP QB 1 39 LEU H . . 4.560 2.929 2.639 3.509 . 0 0 "[ . 1 . 2]" 1
719 1 37 ASP QB 1 63 ALA MB . . 3.820 3.390 2.416 3.834 0.014 19 0 "[ . 1 . 2]" 1
720 1 37 ASP HB2 1 38 GLY H . . 4.860 3.154 2.212 3.795 . 0 0 "[ . 1 . 2]" 1
721 1 37 ASP HB2 1 63 ALA MB . . 4.590 3.967 3.242 4.562 . 0 0 "[ . 1 . 2]" 1
722 1 37 ASP HB3 1 38 GLY H . . 4.860 2.950 2.033 3.825 . 0 0 "[ . 1 . 2]" 1
723 1 37 ASP HB3 1 63 ALA MB . . 4.590 3.892 2.445 4.542 . 0 0 "[ . 1 . 2]" 1
724 1 38 GLY H 1 39 LEU H . . 3.780 2.578 2.444 2.921 . 0 0 "[ . 1 . 2]" 1
725 1 38 GLY H 1 39 LEU HB2 . . 4.820 4.031 3.903 4.444 . 0 0 "[ . 1 . 2]" 1
726 1 38 GLY QA 1 41 PHE H . . 4.300 3.440 3.285 3.554 . 0 0 "[ . 1 . 2]" 1
727 1 38 GLY QA 1 41 PHE QD . . 4.120 2.553 2.165 2.867 . 0 0 "[ . 1 . 2]" 1
728 1 38 GLY QA 1 42 ASN HD21 . . 4.450 3.274 3.103 3.474 . 0 0 "[ . 1 . 2]" 1
729 1 38 GLY QA 1 42 ASN HD22 . . 4.520 3.162 2.826 3.536 . 0 0 "[ . 1 . 2]" 1
730 1 38 GLY QA 1 66 ASN HB2 . . 4.240 3.238 2.692 3.698 . 0 0 "[ . 1 . 2]" 1
731 1 38 GLY QA 1 66 ASN HB3 . . 4.180 2.849 2.167 3.309 . 0 0 "[ . 1 . 2]" 1
732 1 38 GLY QA 1 67 LEU H . . 3.860 3.662 3.342 3.863 0.003 6 0 "[ . 1 . 2]" 1
733 1 38 GLY QA 1 67 LEU HA . . 4.210 3.025 2.769 3.243 . 0 0 "[ . 1 . 2]" 1
734 1 38 GLY QA 1 67 LEU MD2 . . 3.410 1.997 1.827 2.295 . 0 0 "[ . 1 . 2]" 1
735 1 38 GLY QA 1 67 LEU HG . . 4.130 2.441 2.151 2.710 . 0 0 "[ . 1 . 2]" 1
736 1 39 LEU H 1 39 LEU HB2 . . 3.570 2.565 2.432 2.735 . 0 0 "[ . 1 . 2]" 1
737 1 39 LEU H 1 39 LEU HB3 . . 3.860 3.613 3.599 3.621 . 0 0 "[ . 1 . 2]" 1
738 1 39 LEU H 1 39 LEU MD1 . . 3.900 3.635 3.494 3.788 . 0 0 "[ . 1 . 2]" 1
739 1 39 LEU H 1 39 LEU MD2 . . 3.810 3.237 2.910 3.569 . 0 0 "[ . 1 . 2]" 1
740 1 39 LEU H 1 39 LEU HG . . 3.350 2.237 1.954 2.487 . 0 0 "[ . 1 . 2]" 1
741 1 39 LEU H 1 42 ASN HD22 . . 5.250 4.503 4.205 4.832 . 0 0 "[ . 1 . 2]" 1
742 1 39 LEU H 1 66 ASN QD . . 5.260 3.819 3.075 5.137 . 0 0 "[ . 1 . 2]" 1
743 1 39 LEU HA 1 39 LEU MD1 . . 4.120 3.853 3.809 3.914 . 0 0 "[ . 1 . 2]" 1
744 1 39 LEU HA 1 39 LEU MD2 . . 3.200 2.023 1.952 2.231 . 0 0 "[ . 1 . 2]" 1
745 1 39 LEU HA 1 39 LEU HG . . 4.010 3.019 2.828 3.191 . 0 0 "[ . 1 . 2]" 1
746 1 39 LEU HA 1 42 ASN H . . 4.040 3.337 3.189 3.469 . 0 0 "[ . 1 . 2]" 1
747 1 39 LEU HA 1 42 ASN HB2 . . 4.230 2.405 2.072 2.598 . 0 0 "[ . 1 . 2]" 1
748 1 39 LEU HA 1 42 ASN HB3 . . 4.610 4.084 3.741 4.271 . 0 0 "[ . 1 . 2]" 1
749 1 39 LEU HA 1 42 ASN HD21 . . 4.270 2.251 1.932 2.518 . 0 0 "[ . 1 . 2]" 1
750 1 39 LEU HA 1 42 ASN HD22 . . 4.310 3.929 3.638 4.223 . 0 0 "[ . 1 . 2]" 1
751 1 39 LEU HA 1 43 ALA H . . 4.780 4.601 4.320 4.768 . 0 0 "[ . 1 . 2]" 1
752 1 39 LEU HA 1 55 PHE QE . . 4.570 2.646 2.038 3.857 . 0 0 "[ . 1 . 2]" 1
753 1 39 LEU HA 1 58 LEU MD1 . . 4.540 3.615 3.102 4.289 . 0 0 "[ . 1 . 2]" 1
754 1 39 LEU HB2 1 39 LEU MD1 . . 3.610 2.282 2.154 2.410 . 0 0 "[ . 1 . 2]" 1
755 1 39 LEU HB2 1 40 ALA H . . 3.950 2.343 2.180 2.549 . 0 0 "[ . 1 . 2]" 1
756 1 39 LEU HB2 1 55 PHE HZ . . 5.160 3.957 3.648 4.309 . 0 0 "[ . 1 . 2]" 1
757 1 39 LEU HB3 1 39 LEU MD1 . . 3.590 2.393 2.284 2.520 . 0 0 "[ . 1 . 2]" 1
758 1 39 LEU HB3 1 39 LEU MD2 . . 3.300 2.339 2.259 2.411 . 0 0 "[ . 1 . 2]" 1
759 1 39 LEU HB3 1 40 ALA H . . 4.350 3.240 3.073 3.472 . 0 0 "[ . 1 . 2]" 1
760 1 39 LEU HB3 1 55 PHE HZ . . 4.350 2.248 2.001 2.587 . 0 0 "[ . 1 . 2]" 1
761 1 39 LEU MD1 1 40 ALA H . . 5.050 4.255 4.072 4.472 . 0 0 "[ . 1 . 2]" 1
762 1 39 LEU MD1 1 55 PHE QE . . 4.530 3.827 3.465 4.136 . 0 0 "[ . 1 . 2]" 1
763 1 39 LEU MD1 1 55 PHE HZ . . 4.420 3.300 2.825 3.630 . 0 0 "[ . 1 . 2]" 1
764 1 39 LEU MD1 1 60 LYS HA . . 3.710 3.085 1.989 3.709 . 0 0 "[ . 1 . 2]" 1
765 1 39 LEU MD1 1 60 LYS QB . . 3.780 3.150 1.961 3.775 . 0 0 "[ . 1 . 2]" 1
766 1 39 LEU MD1 1 60 LYS QD . . 4.280 2.945 1.793 4.078 . 0 0 "[ . 1 . 2]" 1
767 1 39 LEU MD1 1 60 LYS QE . . 4.150 3.308 1.928 4.141 . 0 0 "[ . 1 . 2]" 1
768 1 39 LEU MD1 1 60 LYS QG . . 4.320 2.766 1.939 4.036 . 0 0 "[ . 1 . 2]" 1
769 1 39 LEU MD2 1 42 ASN H . . 5.060 4.829 4.614 4.994 . 0 0 "[ . 1 . 2]" 1
770 1 39 LEU MD2 1 42 ASN HD22 . . 4.610 4.548 4.325 4.613 0.003 19 0 "[ . 1 . 2]" 1
771 1 39 LEU MD2 1 55 PHE HZ . . 4.110 2.684 2.171 3.096 . 0 0 "[ . 1 . 2]" 1
772 1 39 LEU MD2 1 58 LEU H . . 5.500 5.318 4.844 5.499 . 0 0 "[ . 1 . 2]" 1
773 1 39 LEU MD2 1 58 LEU HB3 . . 3.640 3.158 2.553 3.575 . 0 0 "[ . 1 . 2]" 1
774 1 39 LEU MD2 1 60 LYS HA . . 4.070 3.428 2.619 3.885 . 0 0 "[ . 1 . 2]" 1
775 1 39 LEU MD2 1 66 ASN HD21 . . 4.470 3.268 2.303 4.433 . 0 0 "[ . 1 . 2]" 1
776 1 39 LEU MD2 1 66 ASN QD . . 3.870 2.873 2.209 3.751 . 0 0 "[ . 1 . 2]" 1
777 1 39 LEU MD2 1 66 ASN HD22 . . 4.470 3.258 2.582 4.075 . 0 0 "[ . 1 . 2]" 1
778 1 40 ALA H 1 40 ALA MB . . 3.110 2.111 2.034 2.233 . 0 0 "[ . 1 . 2]" 1
779 1 40 ALA H 1 41 PHE H . . 3.580 3.132 2.983 3.245 . 0 0 "[ . 1 . 2]" 1
780 1 40 ALA HA 1 43 ALA H . . 3.960 3.720 3.547 3.825 . 0 0 "[ . 1 . 2]" 1
781 1 40 ALA HA 1 43 ALA MB . . 3.450 2.552 2.402 2.704 . 0 0 "[ . 1 . 2]" 1
782 1 40 ALA HA 1 44 ILE H . . 5.090 4.634 4.383 4.942 . 0 0 "[ . 1 . 2]" 1
783 1 40 ALA MB 1 41 PHE H . . 3.400 2.379 2.163 2.535 . 0 0 "[ . 1 . 2]" 1
784 1 40 ALA MB 1 42 ASN H . . 5.330 4.379 4.225 4.503 . 0 0 "[ . 1 . 2]" 1
785 1 40 ALA MB 1 44 ILE MD . . 4.290 3.791 3.563 3.901 . 0 0 "[ . 1 . 2]" 1
786 1 41 PHE H 1 41 PHE HB2 . . 3.490 2.364 2.287 2.430 . 0 0 "[ . 1 . 2]" 1
787 1 41 PHE H 1 41 PHE QD . . 3.550 3.052 2.815 3.238 . 0 0 "[ . 1 . 2]" 1
788 1 41 PHE H 1 42 ASN H . . 3.360 2.723 2.587 2.839 . 0 0 "[ . 1 . 2]" 1
789 1 41 PHE H 1 42 ASN HD21 . . 4.890 4.446 4.029 4.821 . 0 0 "[ . 1 . 2]" 1
790 1 41 PHE H 1 43 ALA H . . 4.800 3.901 3.859 3.963 . 0 0 "[ . 1 . 2]" 1
791 1 41 PHE H 1 44 ILE MD . . 4.740 4.549 4.390 4.677 . 0 0 "[ . 1 . 2]" 1
792 1 41 PHE H 1 67 LEU MD2 . . 4.670 4.564 4.403 4.666 . 0 0 "[ . 1 . 2]" 1
793 1 41 PHE H 1 70 ALA MB . . 4.820 4.643 4.396 4.822 0.002 19 0 "[ . 1 . 2]" 1
794 1 41 PHE HA 1 41 PHE QD . . 4.250 2.255 2.051 2.469 . 0 0 "[ . 1 . 2]" 1
795 1 41 PHE HA 1 44 ILE H . . 4.410 3.494 3.426 3.610 . 0 0 "[ . 1 . 2]" 1
796 1 41 PHE HA 1 44 ILE MD . . 4.080 2.451 2.285 2.570 . 0 0 "[ . 1 . 2]" 1
797 1 41 PHE HA 1 70 ALA MB . . 4.750 4.182 3.878 4.490 . 0 0 "[ . 1 . 2]" 1
798 1 41 PHE HA 1 106 TYR QE . . 4.040 3.655 2.943 4.031 . 0 0 "[ . 1 . 2]" 1
799 1 41 PHE HB2 1 42 ASN H . . 3.720 2.671 2.598 2.798 . 0 0 "[ . 1 . 2]" 1
800 1 41 PHE HB2 1 70 ALA MB . . 3.570 2.847 2.606 3.165 . 0 0 "[ . 1 . 2]" 1
801 1 41 PHE HB3 1 42 ASN H . . 3.840 3.491 3.291 3.746 . 0 0 "[ . 1 . 2]" 1
802 1 41 PHE HB3 1 44 ILE MD . . 4.520 4.421 4.297 4.520 . 0 0 "[ . 1 . 2]" 1
803 1 41 PHE HB3 1 70 ALA MB . . 3.400 2.276 1.958 2.669 . 0 0 "[ . 1 . 2]" 1
804 1 41 PHE HB3 1 106 TYR QE . . 4.190 3.646 3.053 4.080 . 0 0 "[ . 1 . 2]" 1
805 1 41 PHE QD 1 42 ASN H . . 4.430 4.395 4.301 4.440 0.010 19 0 "[ . 1 . 2]" 1
806 1 41 PHE QD 1 44 ILE MD . . 4.320 2.763 2.393 3.099 . 0 0 "[ . 1 . 2]" 1
807 1 41 PHE QD 1 67 LEU HA . . 4.720 3.904 3.632 4.207 . 0 0 "[ . 1 . 2]" 1
808 1 41 PHE QD 1 67 LEU MD2 . . 3.600 2.354 2.106 2.574 . 0 0 "[ . 1 . 2]" 1
809 1 41 PHE QD 1 103 VAL HA . . 4.940 4.407 4.222 4.614 . 0 0 "[ . 1 . 2]" 1
810 1 41 PHE QD 1 106 TYR QE . . 4.060 3.243 2.656 3.666 . 0 0 "[ . 1 . 2]" 1
811 1 41 PHE QE 1 44 ILE MD . . 4.440 3.870 3.580 4.133 . 0 0 "[ . 1 . 2]" 1
812 1 41 PHE QE 1 67 LEU MD2 . . 3.640 2.984 2.621 3.278 . 0 0 "[ . 1 . 2]" 1
813 1 41 PHE QE 1 84 LEU MD1 . . 4.410 3.938 3.301 4.389 . 0 0 "[ . 1 . 2]" 1
814 1 41 PHE QE 1 89 VAL MG1 . . 3.330 2.762 2.429 3.115 . 0 0 "[ . 1 . 2]" 1
815 1 41 PHE QE 1 99 ILE MD . . 4.750 4.236 3.817 4.499 . 0 0 "[ . 1 . 2]" 1
816 1 41 PHE QE 1 99 ILE MG . . 4.110 3.256 3.040 3.433 . 0 0 "[ . 1 . 2]" 1
817 1 41 PHE QE 1 102 TYR QD . . 3.930 2.810 2.007 3.713 . 0 0 "[ . 1 . 2]" 1
818 1 41 PHE QE 1 103 VAL H . . 4.630 3.788 3.558 4.079 . 0 0 "[ . 1 . 2]" 1
819 1 41 PHE QE 1 103 VAL HA . . 4.150 3.011 2.735 3.329 . 0 0 "[ . 1 . 2]" 1
820 1 41 PHE QE 1 103 VAL MG1 . . 4.330 4.128 3.929 4.334 0.004 13 0 "[ . 1 . 2]" 1
821 1 41 PHE QE 1 106 TYR QE . . 5.230 4.741 4.368 5.114 . 0 0 "[ . 1 . 2]" 1
822 1 41 PHE HZ 1 84 LEU MD1 . . 4.160 3.402 2.625 3.973 . 0 0 "[ . 1 . 2]" 1
823 1 41 PHE HZ 1 89 VAL MG1 . . 4.220 4.017 3.678 4.224 0.004 19 0 "[ . 1 . 2]" 1
824 1 41 PHE HZ 1 89 VAL MG2 . . 4.350 4.234 3.946 4.352 0.002 20 0 "[ . 1 . 2]" 1
825 1 41 PHE HZ 1 99 ILE MD . . 4.420 4.209 3.802 4.426 0.006 17 0 "[ . 1 . 2]" 1
826 1 41 PHE HZ 1 99 ILE MG . . 3.850 2.211 1.968 2.636 . 0 0 "[ . 1 . 2]" 1
827 1 42 ASN H 1 42 ASN HB2 . . 3.390 2.497 2.411 2.619 . 0 0 "[ . 1 . 2]" 1
828 1 42 ASN H 1 42 ASN HB3 . . 3.710 3.604 3.588 3.614 . 0 0 "[ . 1 . 2]" 1
829 1 42 ASN H 1 42 ASN HD21 . . 3.390 2.630 2.286 2.940 . 0 0 "[ . 1 . 2]" 1
830 1 42 ASN H 1 43 ALA H . . 3.130 2.619 2.527 2.660 . 0 0 "[ . 1 . 2]" 1
831 1 42 ASN H 1 45 VAL MG2 . . 5.500 5.375 5.219 5.503 0.003 16 0 "[ . 1 . 2]" 1
832 1 42 ASN H 1 53 LEU MD1 . . 4.890 4.516 4.135 4.869 . 0 0 "[ . 1 . 2]" 1
833 1 42 ASN H 1 66 ASN HB3 . . 5.330 5.206 4.926 5.338 0.008 17 0 "[ . 1 . 2]" 1
834 1 42 ASN H 1 67 LEU MD2 . . 5.500 5.397 5.217 5.500 0.000 3 0 "[ . 1 . 2]" 1
835 1 42 ASN H 1 70 ALA MB . . 3.830 3.494 3.320 3.705 . 0 0 "[ . 1 . 2]" 1
836 1 42 ASN HA 1 42 ASN HD21 . . 4.910 4.173 3.988 4.261 . 0 0 "[ . 1 . 2]" 1
837 1 42 ASN HA 1 44 ILE H . . 5.300 4.370 4.031 4.567 . 0 0 "[ . 1 . 2]" 1
838 1 42 ASN HA 1 45 VAL H . . 4.020 3.940 3.793 4.028 0.008 17 0 "[ . 1 . 2]" 1
839 1 42 ASN HA 1 45 VAL HB . . 3.970 3.543 3.424 3.633 . 0 0 "[ . 1 . 2]" 1
840 1 42 ASN HA 1 45 VAL MG1 . . 5.360 4.824 4.716 4.954 . 0 0 "[ . 1 . 2]" 1
841 1 42 ASN HA 1 45 VAL MG2 . . 3.900 3.738 3.485 3.931 0.031 16 0 "[ . 1 . 2]" 1
842 1 42 ASN HA 1 46 HIS H . . 4.380 3.968 3.725 4.224 . 0 0 "[ . 1 . 2]" 1
843 1 42 ASN HA 1 53 LEU MD1 . . 4.030 2.433 2.014 2.799 . 0 0 "[ . 1 . 2]" 1
844 1 42 ASN HA 1 53 LEU MD2 . . 4.510 3.584 3.256 3.795 . 0 0 "[ . 1 . 2]" 1
845 1 42 ASN HA 1 70 ALA MB . . 3.900 2.966 2.490 3.246 . 0 0 "[ . 1 . 2]" 1
846 1 42 ASN HB2 1 42 ASN HD22 . . 4.070 3.443 3.433 3.466 . 0 0 "[ . 1 . 2]" 1
847 1 42 ASN HB2 1 43 ALA H . . 3.710 3.579 3.475 3.650 . 0 0 "[ . 1 . 2]" 1
848 1 42 ASN HB2 1 53 LEU MD1 . . 3.960 3.396 3.231 3.649 . 0 0 "[ . 1 . 2]" 1
849 1 42 ASN HB2 1 58 LEU MD1 . . 3.960 2.752 2.334 3.108 . 0 0 "[ . 1 . 2]" 1
850 1 42 ASN HB3 1 43 ALA H . . 4.410 4.314 4.235 4.410 . 0 0 "[ . 1 . 2]" 1
851 1 42 ASN HB3 1 46 HIS H . . 5.460 5.075 4.875 5.470 0.010 16 0 "[ . 1 . 2]" 1
852 1 42 ASN HB3 1 53 LEU MD1 . . 3.500 2.000 1.825 2.252 . 0 0 "[ . 1 . 2]" 1
853 1 42 ASN HB3 1 55 PHE QD . . 4.540 2.671 1.999 3.742 . 0 0 "[ . 1 . 2]" 1
854 1 42 ASN HB3 1 55 PHE QE . . 4.550 3.512 3.032 4.187 . 0 0 "[ . 1 . 2]" 1
855 1 42 ASN HB3 1 58 LEU MD1 . . 3.720 2.241 1.860 2.672 . 0 0 "[ . 1 . 2]" 1
856 1 42 ASN HB3 1 58 LEU HG . . 5.130 4.765 4.307 5.129 . 0 0 "[ . 1 . 2]" 1
857 1 42 ASN HD21 1 53 LEU MD1 . . 5.100 4.541 4.213 4.866 . 0 0 "[ . 1 . 2]" 1
858 1 42 ASN HD21 1 58 LEU MD1 . . 4.670 3.299 2.838 3.716 . 0 0 "[ . 1 . 2]" 1
859 1 42 ASN HD21 1 66 ASN HA . . 5.100 4.377 3.936 4.881 . 0 0 "[ . 1 . 2]" 1
860 1 42 ASN HD21 1 66 ASN HB3 . . 3.520 2.710 2.190 3.075 . 0 0 "[ . 1 . 2]" 1
861 1 42 ASN HD21 1 70 ALA MB . . 4.070 3.909 3.729 4.063 . 0 0 "[ . 1 . 2]" 1
862 1 42 ASN HD22 1 58 LEU MD1 . . 4.180 3.662 3.423 4.106 . 0 0 "[ . 1 . 2]" 1
863 1 42 ASN HD22 1 58 LEU MD2 . . 4.850 4.500 3.911 4.851 0.001 16 0 "[ . 1 . 2]" 1
864 1 42 ASN HD22 1 66 ASN HA . . 4.170 3.186 2.697 3.567 . 0 0 "[ . 1 . 2]" 1
865 1 42 ASN HD22 1 66 ASN HB3 . . 4.040 2.253 1.953 2.553 . 0 0 "[ . 1 . 2]" 1
866 1 42 ASN HD22 1 67 LEU H . . 4.420 4.181 3.842 4.420 . 0 0 "[ . 1 . 2]" 1
867 1 42 ASN HD22 1 70 ALA H . . 3.920 3.777 3.461 3.920 . 0 0 "[ . 1 . 2]" 1
868 1 42 ASN HD22 1 70 ALA MB . . 3.820 3.029 2.768 3.312 . 0 0 "[ . 1 . 2]" 1
869 1 43 ALA H 1 43 ALA MB . . 2.930 2.292 2.197 2.362 . 0 0 "[ . 1 . 2]" 1
870 1 43 ALA H 1 44 ILE H . . 3.380 2.175 2.132 2.213 . 0 0 "[ . 1 . 2]" 1
871 1 43 ALA H 1 44 ILE HB . . 4.660 4.394 4.321 4.507 . 0 0 "[ . 1 . 2]" 1
872 1 43 ALA H 1 44 ILE HG12 . . 5.500 5.407 4.945 5.504 0.004 17 0 "[ . 1 . 2]" 1
873 1 43 ALA H 1 44 ILE HG13 . . 5.070 3.740 3.425 3.823 . 0 0 "[ . 1 . 2]" 1
874 1 43 ALA H 1 44 ILE MG . . 5.500 5.500 5.447 5.526 0.026 19 0 "[ . 1 . 2]" 1
875 1 43 ALA H 1 45 VAL H . . 4.120 3.957 3.793 4.152 0.032 16 0 "[ . 1 . 2]" 1
876 1 43 ALA H 1 45 VAL MG2 . . 5.300 4.889 4.685 5.200 . 0 0 "[ . 1 . 2]" 1
877 1 43 ALA H 1 53 LEU MD1 . . 4.880 4.672 4.243 4.865 . 0 0 "[ . 1 . 2]" 1
878 1 43 ALA H 1 55 PHE QD . . 4.940 4.671 4.266 4.876 . 0 0 "[ . 1 . 2]" 1
879 1 43 ALA H 1 55 PHE QE . . 4.550 3.635 3.176 4.132 . 0 0 "[ . 1 . 2]" 1
880 1 43 ALA H 1 55 PHE HZ . . 5.500 5.217 4.624 5.504 0.004 16 0 "[ . 1 . 2]" 1
881 1 43 ALA HA 1 46 HIS H . . 4.550 3.995 3.667 4.218 . 0 0 "[ . 1 . 2]" 1
882 1 43 ALA HA 1 55 PHE QD . . 4.310 3.492 2.825 3.957 . 0 0 "[ . 1 . 2]" 1
883 1 43 ALA HA 1 55 PHE QE . . 4.490 3.385 2.545 3.929 . 0 0 "[ . 1 . 2]" 1
884 1 43 ALA MB 1 44 ILE H . . 3.340 2.698 2.558 2.901 . 0 0 "[ . 1 . 2]" 1
885 1 43 ALA MB 1 44 ILE HA . . 4.700 3.754 3.687 3.899 . 0 0 "[ . 1 . 2]" 1
886 1 43 ALA MB 1 44 ILE HG12 . . 4.430 4.303 3.951 4.389 . 0 0 "[ . 1 . 2]" 1
887 1 43 ALA MB 1 55 PHE QD . . 4.500 4.068 3.605 4.347 . 0 0 "[ . 1 . 2]" 1
888 1 43 ALA MB 1 55 PHE QE . . 3.700 2.881 2.306 3.394 . 0 0 "[ . 1 . 2]" 1
889 1 43 ALA MB 1 55 PHE HZ . . 4.380 3.147 2.674 3.436 . 0 0 "[ . 1 . 2]" 1
890 1 44 ILE H 1 44 ILE HB . . 3.300 2.544 2.487 2.598 . 0 0 "[ . 1 . 2]" 1
891 1 44 ILE H 1 44 ILE MD . . 3.970 3.365 3.204 3.588 . 0 0 "[ . 1 . 2]" 1
892 1 44 ILE H 1 44 ILE HG12 . . 3.600 3.494 3.343 3.580 . 0 0 "[ . 1 . 2]" 1
893 1 44 ILE H 1 44 ILE HG13 . . 3.290 2.084 1.964 2.217 . 0 0 "[ . 1 . 2]" 1
894 1 44 ILE H 1 44 ILE MG . . 3.890 3.765 3.761 3.785 . 0 0 "[ . 1 . 2]" 1
895 1 44 ILE H 1 45 VAL H . . 3.260 2.723 2.595 2.810 . 0 0 "[ . 1 . 2]" 1
896 1 44 ILE H 1 45 VAL MG2 . . 4.230 4.165 4.075 4.232 0.002 17 0 "[ . 1 . 2]" 1
897 1 44 ILE H 1 46 HIS H . . 4.670 4.483 3.569 4.666 . 0 0 "[ . 1 . 2]" 1
898 1 44 ILE H 1 106 TYR QD . . 5.060 4.926 4.750 5.072 0.012 17 0 "[ . 1 . 2]" 1
899 1 44 ILE H 1 106 TYR QE . . 5.250 4.863 4.585 5.174 . 0 0 "[ . 1 . 2]" 1
900 1 44 ILE HA 1 44 ILE MD . . 4.560 3.874 3.848 3.901 . 0 0 "[ . 1 . 2]" 1
901 1 44 ILE HA 1 44 ILE HG12 . . 3.720 2.658 2.580 2.761 . 0 0 "[ . 1 . 2]" 1
902 1 44 ILE HA 1 44 ILE HG13 . . 3.450 2.876 2.810 3.116 . 0 0 "[ . 1 . 2]" 1
903 1 44 ILE HA 1 44 ILE MG . . 3.320 2.356 2.291 2.421 . 0 0 "[ . 1 . 2]" 1
904 1 44 ILE HA 1 47 LYS H . . 4.500 4.007 3.544 4.256 . 0 0 "[ . 1 . 2]" 1
905 1 44 ILE HA 1 47 LYS QB . . 4.560 3.221 3.013 3.434 . 0 0 "[ . 1 . 2]" 1
906 1 44 ILE HB 1 44 ILE MD . . 3.410 2.355 2.294 2.474 . 0 0 "[ . 1 . 2]" 1
907 1 44 ILE HB 1 45 VAL H . . 2.920 2.422 2.271 2.607 . 0 0 "[ . 1 . 2]" 1
908 1 44 ILE HB 1 106 TYR QD . . 4.230 2.490 2.332 2.627 . 0 0 "[ . 1 . 2]" 1
909 1 44 ILE HB 1 106 TYR QE . . 4.060 3.112 2.682 3.463 . 0 0 "[ . 1 . 2]" 1
910 1 44 ILE MD 1 103 VAL MG1 . . 4.860 4.601 4.443 4.835 . 0 0 "[ . 1 . 2]" 1
911 1 44 ILE MD 1 103 VAL MG2 . . 3.820 2.445 2.285 2.700 . 0 0 "[ . 1 . 2]" 1
912 1 44 ILE MD 1 106 TYR HB2 . . 4.560 3.304 3.081 3.577 . 0 0 "[ . 1 . 2]" 1
913 1 44 ILE MD 1 106 TYR HB3 . . 4.700 3.202 2.881 3.538 . 0 0 "[ . 1 . 2]" 1
914 1 44 ILE MD 1 106 TYR QE . . 4.580 3.381 3.042 3.808 . 0 0 "[ . 1 . 2]" 1
915 1 44 ILE HG12 1 45 VAL H . . 5.070 4.954 4.785 5.059 . 0 0 "[ . 1 . 2]" 1
916 1 44 ILE HG12 1 103 VAL MG2 . . 4.920 4.497 4.242 4.792 . 0 0 "[ . 1 . 2]" 1
917 1 44 ILE HG13 1 44 ILE MG . . 3.510 3.184 3.167 3.201 . 0 0 "[ . 1 . 2]" 1
918 1 44 ILE HG13 1 45 VAL H . . 4.210 4.172 3.953 4.216 0.006 8 0 "[ . 1 . 2]" 1
919 1 44 ILE MG 1 45 VAL H . . 3.700 3.307 3.167 3.507 . 0 0 "[ . 1 . 2]" 1
920 1 44 ILE MG 1 45 VAL HA . . 4.550 3.418 3.302 3.557 . 0 0 "[ . 1 . 2]" 1
921 1 44 ILE MG 1 48 HIS HD2 . . 3.710 2.760 1.973 3.098 . 0 0 "[ . 1 . 2]" 1
922 1 44 ILE MG 1 48 HIS HE1 . . 3.850 3.677 3.437 3.854 0.004 6 0 "[ . 1 . 2]" 1
923 1 44 ILE MG 1 106 TYR H . . 5.500 5.443 5.295 5.504 0.004 17 0 "[ . 1 . 2]" 1
924 1 44 ILE MG 1 106 TYR HB2 . . 4.240 3.583 3.428 3.732 . 0 0 "[ . 1 . 2]" 1
925 1 44 ILE MG 1 106 TYR HB3 . . 3.920 2.480 2.292 2.679 . 0 0 "[ . 1 . 2]" 1
926 1 44 ILE MG 1 106 TYR QD . . 3.340 2.078 1.849 2.313 . 0 0 "[ . 1 . 2]" 1
927 1 44 ILE MG 1 106 TYR QE . . 4.340 3.755 3.277 4.053 . 0 0 "[ . 1 . 2]" 1
928 1 44 ILE MG 1 110 PHE QD . . 3.870 3.750 3.439 3.880 0.010 12 0 "[ . 1 . 2]" 1
929 1 45 VAL H 1 45 VAL HB . . 3.240 2.549 2.522 2.593 . 0 0 "[ . 1 . 2]" 1
930 1 45 VAL H 1 45 VAL MG1 . . 3.830 3.765 3.762 3.769 . 0 0 "[ . 1 . 2]" 1
931 1 45 VAL H 1 45 VAL MG2 . . 2.930 2.118 1.987 2.276 . 0 0 "[ . 1 . 2]" 1
932 1 45 VAL H 1 46 HIS H . . 3.260 2.855 2.583 3.021 . 0 0 "[ . 1 . 2]" 1
933 1 45 VAL H 1 46 HIS QB . . 4.820 4.430 4.321 4.580 . 0 0 "[ . 1 . 2]" 1
934 1 45 VAL H 1 53 LEU MD1 . . 5.340 4.752 4.308 5.056 . 0 0 "[ . 1 . 2]" 1
935 1 45 VAL H 1 106 TYR QE . . 4.370 3.838 3.387 4.334 . 0 0 "[ . 1 . 2]" 1
936 1 45 VAL H 1 110 PHE QE . . 5.500 5.407 4.965 5.502 0.002 17 0 "[ . 1 . 2]" 1
937 1 45 VAL HA 1 45 VAL MG1 . . 3.400 2.366 2.277 2.452 . 0 0 "[ . 1 . 2]" 1
938 1 45 VAL HA 1 45 VAL MG2 . . 3.240 2.348 2.288 2.392 . 0 0 "[ . 1 . 2]" 1
939 1 45 VAL HA 1 48 HIS H . . 4.320 3.304 3.185 3.472 . 0 0 "[ . 1 . 2]" 1
940 1 45 VAL HA 1 48 HIS HB2 . . 4.520 3.197 2.884 3.518 . 0 0 "[ . 1 . 2]" 1
941 1 45 VAL HA 1 48 HIS HD2 . . 3.980 2.302 2.075 2.781 . 0 0 "[ . 1 . 2]" 1
942 1 45 VAL HA 1 49 ARG H . . 4.030 3.618 3.026 3.832 . 0 0 "[ . 1 . 2]" 1
943 1 45 VAL HA 1 49 ARG QG . . 5.070 4.949 4.697 5.194 0.124 16 0 "[ . 1 . 2]" 1
944 1 45 VAL HA 1 53 LEU MD2 . . 4.910 4.571 4.295 4.741 . 0 0 "[ . 1 . 2]" 1
945 1 45 VAL HA 1 110 PHE QE . . 4.170 3.565 3.305 3.730 . 0 0 "[ . 1 . 2]" 1
946 1 45 VAL HB 1 46 HIS H . . 3.280 2.188 2.083 3.054 . 0 0 "[ . 1 . 2]" 1
947 1 45 VAL HB 1 53 LEU H . . 5.500 5.455 5.017 5.507 0.007 20 0 "[ . 1 . 2]" 1
948 1 45 VAL HB 1 70 ALA MB . . 4.950 4.616 4.228 4.888 . 0 0 "[ . 1 . 2]" 1
949 1 45 VAL MG1 1 46 HIS H . . 3.820 3.138 3.003 3.838 0.018 16 0 "[ . 1 . 2]" 1
950 1 45 VAL MG1 1 48 HIS H . . 4.740 4.127 3.935 4.557 . 0 0 "[ . 1 . 2]" 1
951 1 45 VAL MG1 1 48 HIS HD2 . . 4.740 3.959 3.648 4.525 . 0 0 "[ . 1 . 2]" 1
952 1 45 VAL MG1 1 49 ARG H . . 4.170 2.908 2.719 3.190 . 0 0 "[ . 1 . 2]" 1
953 1 45 VAL MG1 1 49 ARG HB2 . . 3.800 2.738 2.442 3.597 . 0 0 "[ . 1 . 2]" 1
954 1 45 VAL MG1 1 49 ARG HB3 . . 4.590 4.032 2.057 4.449 . 0 0 "[ . 1 . 2]" 1
955 1 45 VAL MG1 1 52 LEU H . . 4.760 4.441 3.812 4.676 . 0 0 "[ . 1 . 2]" 1
956 1 45 VAL MG1 1 52 LEU HA . . 5.500 5.216 4.993 5.329 . 0 0 "[ . 1 . 2]" 1
957 1 45 VAL MG1 1 52 LEU HB3 . . 4.000 3.554 3.365 3.734 . 0 0 "[ . 1 . 2]" 1
958 1 45 VAL MG1 1 53 LEU H . . 3.930 3.891 3.560 3.950 0.020 17 0 "[ . 1 . 2]" 1
959 1 45 VAL MG1 1 74 ALA MB . . 4.920 4.138 3.725 4.523 . 0 0 "[ . 1 . 2]" 1
960 1 45 VAL MG1 1 78 LEU MD1 . . 3.450 3.316 3.123 3.450 . 12 0 "[ . 1 . 2]" 1
961 1 45 VAL MG2 1 46 HIS H . . 4.060 3.660 3.610 3.967 . 0 0 "[ . 1 . 2]" 1
962 1 45 VAL MG2 1 48 HIS HD2 . . 3.610 3.554 3.385 3.707 0.097 16 0 "[ . 1 . 2]" 1
963 1 45 VAL MG2 1 70 ALA HA . . 4.540 4.092 3.670 4.362 . 0 0 "[ . 1 . 2]" 1
964 1 45 VAL MG2 1 70 ALA MB . . 3.770 3.486 3.126 3.766 . 0 0 "[ . 1 . 2]" 1
965 1 45 VAL MG2 1 74 ALA H . . 4.660 4.312 3.917 4.661 0.001 16 0 "[ . 1 . 2]" 1
966 1 45 VAL MG2 1 74 ALA MB . . 3.800 2.963 2.577 3.217 . 0 0 "[ . 1 . 2]" 1
967 1 45 VAL MG2 1 78 LEU MD1 . . 3.610 2.612 2.488 2.856 . 0 0 "[ . 1 . 2]" 1
968 1 45 VAL MG2 1 78 LEU HG . . 4.280 4.232 4.116 4.288 0.008 17 0 "[ . 1 . 2]" 1
969 1 45 VAL MG2 1 106 TYR QD . . 3.710 3.482 3.087 3.712 0.002 1 0 "[ . 1 . 2]" 1
970 1 45 VAL MG2 1 106 TYR QE . . 3.420 2.428 2.114 2.858 . 0 0 "[ . 1 . 2]" 1
971 1 45 VAL MG2 1 110 PHE QD . . 5.500 5.277 5.023 5.458 . 0 0 "[ . 1 . 2]" 1
972 1 45 VAL MG2 1 110 PHE QE . . 4.250 3.465 3.184 3.711 . 0 0 "[ . 1 . 2]" 1
973 1 46 HIS H 1 46 HIS QB . . 2.940 2.228 2.169 2.285 . 0 0 "[ . 1 . 2]" 1
974 1 46 HIS H 1 46 HIS HD2 . . 5.160 4.736 4.448 5.043 . 0 0 "[ . 1 . 2]" 1
975 1 46 HIS H 1 47 LYS H . . 3.430 2.975 2.448 3.208 . 0 0 "[ . 1 . 2]" 1
976 1 46 HIS H 1 47 LYS QB . . 5.340 4.690 4.242 4.795 . 0 0 "[ . 1 . 2]" 1
977 1 46 HIS H 1 48 HIS H . . 4.660 4.460 3.907 4.555 . 0 0 "[ . 1 . 2]" 1
978 1 46 HIS H 1 53 LEU MD1 . . 3.540 3.345 2.847 3.547 0.007 16 0 "[ . 1 . 2]" 1
979 1 46 HIS H 1 53 LEU MD2 . . 3.920 2.734 2.433 3.605 . 0 0 "[ . 1 . 2]" 1
980 1 46 HIS H 1 53 LEU HG . . 4.820 4.187 3.892 4.627 . 0 0 "[ . 1 . 2]" 1
981 1 46 HIS HA 1 46 HIS HD2 . . 4.260 3.007 2.432 3.654 . 0 0 "[ . 1 . 2]" 1
982 1 46 HIS HA 1 48 HIS H . . 4.550 4.488 4.317 4.555 0.005 8 0 "[ . 1 . 2]" 1
983 1 46 HIS HA 1 49 ARG H . . 3.790 3.702 3.476 3.825 0.035 16 0 "[ . 1 . 2]" 1
984 1 46 HIS HA 1 50 PRO HA . . 3.710 2.503 1.998 2.869 . 0 0 "[ . 1 . 2]" 1
985 1 46 HIS HA 1 52 LEU H . . 5.500 5.131 4.721 5.291 . 0 0 "[ . 1 . 2]" 1
986 1 46 HIS HA 1 53 LEU H . . 4.570 4.028 3.808 4.357 . 0 0 "[ . 1 . 2]" 1
987 1 46 HIS HA 1 53 LEU MD2 . . 3.640 2.561 2.224 3.089 . 0 0 "[ . 1 . 2]" 1
988 1 46 HIS QB 1 47 LYS H . . 3.380 2.562 2.139 2.918 . 0 0 "[ . 1 . 2]" 1
989 1 46 HIS QB 1 53 LEU H . . 4.950 4.865 4.540 4.960 0.010 19 0 "[ . 1 . 2]" 1
990 1 46 HIS QB 1 53 LEU MD1 . . 3.690 2.824 2.350 3.246 . 0 0 "[ . 1 . 2]" 1
991 1 46 HIS QB 1 53 LEU MD2 . . 3.580 2.933 2.587 3.351 . 0 0 "[ . 1 . 2]" 1
992 1 46 HIS QB 1 53 LEU HG . . 4.700 2.899 2.577 3.141 . 0 0 "[ . 1 . 2]" 1
993 1 46 HIS QB 1 55 PHE QB . . 4.520 2.870 2.448 3.285 . 0 0 "[ . 1 . 2]" 1
994 1 46 HIS QB 1 55 PHE QD . . 5.440 3.383 2.772 3.947 . 0 0 "[ . 1 . 2]" 1
995 1 46 HIS HD2 1 50 PRO HA . . 3.710 2.872 2.001 3.644 . 0 0 "[ . 1 . 2]" 1
996 1 46 HIS HD2 1 53 LEU MD1 . . 4.330 3.871 3.489 4.331 0.001 11 0 "[ . 1 . 2]" 1
997 1 46 HIS HD2 1 53 LEU MD2 . . 3.850 3.255 2.650 3.856 0.006 16 0 "[ . 1 . 2]" 1
998 1 46 HIS HD2 1 53 LEU HG . . 3.700 2.493 2.004 3.060 . 0 0 "[ . 1 . 2]" 1
999 1 46 HIS HE1 1 50 PRO QB . . 4.610 3.657 2.974 4.334 . 0 0 "[ . 1 . 2]" 1
1000 1 47 LYS H 1 47 LYS HB2 . . 3.220 2.367 2.142 2.521 . 0 0 "[ . 1 . 2]" 1
1001 1 47 LYS H 1 47 LYS HB3 . . 3.220 2.699 2.566 3.032 . 0 0 "[ . 1 . 2]" 1
1002 1 47 LYS H 1 47 LYS HD2 . . 5.040 4.738 4.477 5.096 0.056 18 0 "[ . 1 . 2]" 1
1003 1 47 LYS H 1 47 LYS QD . . 4.320 3.989 3.478 4.201 . 0 0 "[ . 1 . 2]" 1
1004 1 47 LYS H 1 47 LYS HD3 . . 5.040 4.318 3.540 4.728 . 0 0 "[ . 1 . 2]" 1
1005 1 47 LYS H 1 47 LYS HG2 . . 4.860 4.619 4.607 4.632 . 0 0 "[ . 1 . 2]" 1
1006 1 47 LYS H 1 47 LYS QG . . 4.160 4.038 3.988 4.051 . 0 0 "[ . 1 . 2]" 1
1007 1 47 LYS H 1 47 LYS HG3 . . 4.860 4.457 4.363 4.489 . 0 0 "[ . 1 . 2]" 1
1008 1 47 LYS H 1 48 HIS H . . 3.510 2.739 2.485 2.950 . 0 0 "[ . 1 . 2]" 1
1009 1 47 LYS H 1 48 HIS HB2 . . 5.180 5.174 5.098 5.207 0.027 18 0 "[ . 1 . 2]" 1
1010 1 47 LYS H 1 49 ARG H . . 4.600 4.274 4.012 4.499 . 0 0 "[ . 1 . 2]" 1
1011 1 47 LYS HA 1 47 LYS HD2 . . 3.890 2.553 2.351 3.449 . 0 0 "[ . 1 . 2]" 1
1012 1 47 LYS HA 1 47 LYS QD . . 3.300 2.424 2.270 2.540 . 0 0 "[ . 1 . 2]" 1
1013 1 47 LYS HA 1 47 LYS HD3 . . 3.890 3.177 2.612 3.682 . 0 0 "[ . 1 . 2]" 1
1014 1 47 LYS HA 1 47 LYS QE . . 4.640 4.309 3.942 4.508 . 0 0 "[ . 1 . 2]" 1
1015 1 47 LYS QB 1 47 LYS QE . . 4.190 3.438 2.419 3.790 . 0 0 "[ . 1 . 2]" 1
1016 1 47 LYS QB 1 48 HIS H . . 3.400 2.458 2.394 2.719 . 0 0 "[ . 1 . 2]" 1
1017 1 47 LYS QB 1 49 ARG H . . 5.340 4.770 4.641 4.847 . 0 0 "[ . 1 . 2]" 1
1018 1 47 LYS HB2 1 48 HIS H . . 3.900 3.707 3.432 3.917 0.017 16 0 "[ . 1 . 2]" 1
1019 1 47 LYS HB3 1 48 HIS H . . 3.900 2.496 2.426 2.773 . 0 0 "[ . 1 . 2]" 1
1020 1 47 LYS QE 1 47 LYS HG2 . . 3.680 2.286 2.125 3.017 . 0 0 "[ . 1 . 2]" 1
1021 1 47 LYS QE 1 47 LYS HG3 . . 3.680 2.816 2.438 3.210 . 0 0 "[ . 1 . 2]" 1
1022 1 47 LYS HG2 1 48 HIS H . . 4.690 4.537 4.332 4.700 0.010 16 0 "[ . 1 . 2]" 1
1023 1 47 LYS HG3 1 48 HIS H . . 4.690 4.056 3.786 4.411 . 0 0 "[ . 1 . 2]" 1
1024 1 48 HIS H 1 48 HIS HB2 . . 3.380 2.665 2.563 2.774 . 0 0 "[ . 1 . 2]" 1
1025 1 48 HIS H 1 48 HIS HB3 . . 3.820 3.613 3.596 3.667 . 0 0 "[ . 1 . 2]" 1
1026 1 48 HIS H 1 49 ARG H . . 2.880 2.573 2.329 2.748 . 0 0 "[ . 1 . 2]" 1
1027 1 48 HIS HA 1 110 PHE HZ . . 5.180 5.072 4.750 5.184 0.004 12 0 "[ . 1 . 2]" 1
1028 1 48 HIS HB2 1 49 ARG H . . 3.570 2.357 2.237 2.516 . 0 0 "[ . 1 . 2]" 1
1029 1 48 HIS HB2 1 110 PHE QD . . 5.210 4.958 4.513 5.204 . 0 0 "[ . 1 . 2]" 1
1030 1 48 HIS HB2 1 110 PHE HZ . . 4.680 2.413 2.097 2.630 . 0 0 "[ . 1 . 2]" 1
1031 1 48 HIS HB3 1 49 ARG H . . 3.850 3.643 3.479 3.801 . 0 0 "[ . 1 . 2]" 1
1032 1 48 HIS HB3 1 110 PHE QD . . 4.590 4.145 3.622 4.459 . 0 0 "[ . 1 . 2]" 1
1033 1 48 HIS HB3 1 110 PHE HZ . . 4.300 2.942 2.575 3.209 . 0 0 "[ . 1 . 2]" 1
1034 1 48 HIS HD2 1 78 LEU MD1 . . 5.090 4.537 4.246 5.041 . 0 0 "[ . 1 . 2]" 1
1035 1 48 HIS HD2 1 110 PHE QD . . 4.430 3.752 3.363 3.965 . 0 0 "[ . 1 . 2]" 1
1036 1 49 ARG H 1 49 ARG HB2 . . 3.400 2.723 2.550 3.243 . 0 0 "[ . 1 . 2]" 1
1037 1 49 ARG H 1 49 ARG HB3 . . 4.010 3.744 2.653 3.868 . 0 0 "[ . 1 . 2]" 1
1038 1 49 ARG H 1 49 ARG QG . . 3.980 2.935 2.718 4.041 0.061 16 0 "[ . 1 . 2]" 1
1039 1 49 ARG H 1 50 PRO HD3 . . 4.080 3.646 3.283 3.808 . 0 0 "[ . 1 . 2]" 1
1040 1 49 ARG H 1 52 LEU MD1 . . 4.600 4.156 3.925 4.646 0.046 16 0 "[ . 1 . 2]" 1
1041 1 49 ARG H 1 110 PHE QE . . 5.470 5.094 4.702 5.406 . 0 0 "[ . 1 . 2]" 1
1042 1 49 ARG HA 1 49 ARG HD2 . . 4.170 2.827 2.131 3.939 . 0 0 "[ . 1 . 2]" 1
1043 1 49 ARG HA 1 49 ARG HD3 . . 4.170 3.721 2.385 4.013 . 0 0 "[ . 1 . 2]" 1
1044 1 49 ARG HA 1 49 ARG HE . . 4.490 3.396 1.870 4.301 . 0 0 "[ . 1 . 2]" 1
1045 1 49 ARG HA 1 50 PRO HD2 . . 3.650 1.954 1.931 2.036 . 0 0 "[ . 1 . 2]" 1
1046 1 49 ARG HA 1 50 PRO HD3 . . 3.820 2.682 2.615 2.848 . 0 0 "[ . 1 . 2]" 1
1047 1 49 ARG HA 1 52 LEU H . . 4.910 4.511 4.356 4.740 . 0 0 "[ . 1 . 2]" 1
1048 1 49 ARG HB2 1 49 ARG HE . . 4.030 3.590 2.285 4.096 0.066 15 0 "[ . 1 . 2]" 1
1049 1 49 ARG HB2 1 52 LEU MD1 . . 4.130 2.239 1.974 3.773 . 0 0 "[ . 1 . 2]" 1
1050 1 49 ARG HB3 1 49 ARG HE . . 4.120 2.349 1.884 3.402 . 0 0 "[ . 1 . 2]" 1
1051 1 49 ARG HB3 1 52 LEU MD1 . . 4.180 3.171 2.556 3.508 . 0 0 "[ . 1 . 2]" 1
1052 1 49 ARG HE 1 52 LEU MD1 . . 5.200 4.358 3.300 5.202 0.002 7 0 "[ . 1 . 2]" 1
1053 1 49 ARG HE 1 52 LEU HG . . 4.540 3.815 2.621 4.462 . 0 0 "[ . 1 . 2]" 1
1054 1 49 ARG QG 1 52 LEU MD1 . . 3.570 2.803 2.213 3.477 . 0 0 "[ . 1 . 2]" 1
1055 1 50 PRO HA 1 53 LEU MD2 . . 4.540 3.895 3.440 4.473 . 0 0 "[ . 1 . 2]" 1
1056 1 50 PRO HD2 1 51 ASP H . . 4.430 3.044 2.949 3.100 . 0 0 "[ . 1 . 2]" 1
1057 1 50 PRO HD2 1 52 LEU H . . 5.500 5.126 5.016 5.354 . 0 0 "[ . 1 . 2]" 1
1058 1 50 PRO HD3 1 51 ASP H . . 4.640 4.051 4.002 4.082 . 0 0 "[ . 1 . 2]" 1
1059 1 50 PRO QG 1 51 ASP H . . 4.140 3.292 3.162 3.364 . 0 0 "[ . 1 . 2]" 1
1060 1 51 ASP H 1 51 ASP QB . . 3.710 2.350 2.216 2.682 . 0 0 "[ . 1 . 2]" 1
1061 1 51 ASP H 1 52 LEU H . . 3.060 2.337 2.240 2.521 . 0 0 "[ . 1 . 2]" 1
1062 1 51 ASP H 1 52 LEU MD2 . . 4.590 4.501 4.182 4.611 0.021 16 0 "[ . 1 . 2]" 1
1063 1 51 ASP H 1 53 LEU H . . 4.450 4.409 4.313 4.483 0.033 17 0 "[ . 1 . 2]" 1
1064 1 51 ASP QB 1 52 LEU H . . 4.120 2.555 2.421 2.795 . 0 0 "[ . 1 . 2]" 1
1065 1 51 ASP QB 1 53 LEU H . . 5.180 5.094 4.971 5.168 . 0 0 "[ . 1 . 2]" 1
1066 1 52 LEU H 1 52 LEU HB2 . . 3.100 2.648 2.522 2.783 . 0 0 "[ . 1 . 2]" 1
1067 1 52 LEU H 1 52 LEU HB3 . . 3.820 3.589 3.570 3.602 . 0 0 "[ . 1 . 2]" 1
1068 1 52 LEU H 1 52 LEU MD1 . . 3.870 3.676 3.482 3.780 . 0 0 "[ . 1 . 2]" 1
1069 1 52 LEU H 1 52 LEU MD2 . . 3.970 2.815 2.437 2.999 . 0 0 "[ . 1 . 2]" 1
1070 1 52 LEU H 1 52 LEU HG . . 3.270 2.099 1.885 2.278 . 0 0 "[ . 1 . 2]" 1
1071 1 52 LEU H 1 53 LEU H . . 3.260 3.093 2.853 3.221 . 0 0 "[ . 1 . 2]" 1
1072 1 52 LEU H 1 53 LEU HA . . 5.500 5.414 5.274 5.468 . 0 0 "[ . 1 . 2]" 1
1073 1 52 LEU H 1 53 LEU MD2 . . 4.370 3.936 3.643 4.122 . 0 0 "[ . 1 . 2]" 1
1074 1 52 LEU HA 1 52 LEU MD1 . . 4.260 3.826 3.751 3.944 . 0 0 "[ . 1 . 2]" 1
1075 1 52 LEU HA 1 52 LEU MD2 . . 2.890 2.088 1.942 2.387 . 0 0 "[ . 1 . 2]" 1
1076 1 52 LEU HA 1 73 LEU MD1 . . 4.870 4.203 3.686 4.789 . 0 0 "[ . 1 . 2]" 1
1077 1 52 LEU HA 1 73 LEU MD2 . . 5.070 3.538 3.201 4.089 . 0 0 "[ . 1 . 2]" 1
1078 1 52 LEU HB2 1 52 LEU MD1 . . 3.420 2.419 2.210 2.535 . 0 0 "[ . 1 . 2]" 1
1079 1 52 LEU HB2 1 52 LEU MD2 . . 3.530 3.182 3.176 3.192 . 0 0 "[ . 1 . 2]" 1
1080 1 52 LEU HB2 1 53 LEU H . . 3.410 2.107 1.998 2.205 . 0 0 "[ . 1 . 2]" 1
1081 1 52 LEU HB2 1 53 LEU MD2 . . 3.370 2.109 1.914 2.275 . 0 0 "[ . 1 . 2]" 1
1082 1 52 LEU HB3 1 52 LEU MD1 . . 3.480 2.214 2.111 2.404 . 0 0 "[ . 1 . 2]" 1
1083 1 52 LEU HB3 1 52 LEU MD2 . . 3.320 2.379 2.222 2.510 . 0 0 "[ . 1 . 2]" 1
1084 1 52 LEU HB3 1 53 LEU H . . 3.920 3.253 3.094 3.486 . 0 0 "[ . 1 . 2]" 1
1085 1 52 LEU HB3 1 53 LEU MD2 . . 3.550 2.869 2.448 3.121 . 0 0 "[ . 1 . 2]" 1
1086 1 52 LEU HB3 1 73 LEU MD1 . . 3.780 2.543 2.077 3.029 . 0 0 "[ . 1 . 2]" 1
1087 1 52 LEU HB3 1 73 LEU MD2 . . 3.660 2.381 1.979 2.886 . 0 0 "[ . 1 . 2]" 1
1088 1 52 LEU MD1 1 53 LEU H . . 4.280 4.165 3.982 4.283 0.003 3 0 "[ . 1 . 2]" 1
1089 1 52 LEU MD1 1 73 LEU HB2 . . 4.750 4.423 3.865 4.744 . 0 0 "[ . 1 . 2]" 1
1090 1 52 LEU MD1 1 73 LEU HB3 . . 4.530 2.975 2.604 3.273 . 0 0 "[ . 1 . 2]" 1
1091 1 52 LEU MD1 1 73 LEU MD1 . . 3.320 3.223 3.000 3.324 0.004 20 0 "[ . 1 . 2]" 1
1092 1 52 LEU MD1 1 77 GLU QB . . 3.880 2.359 2.090 2.712 . 0 0 "[ . 1 . 2]" 1
1093 1 52 LEU MD1 1 77 GLU QG . . 3.940 2.196 1.861 2.580 . 0 0 "[ . 1 . 2]" 1
1094 1 52 LEU MD2 1 77 GLU H . . 5.430 4.920 4.683 5.186 . 0 0 "[ . 1 . 2]" 1
1095 1 52 LEU MD2 1 77 GLU HB2 . . 3.700 3.546 3.121 3.705 0.005 20 0 "[ . 1 . 2]" 1
1096 1 52 LEU MD2 1 77 GLU HB3 . . 3.700 2.811 2.319 3.212 . 0 0 "[ . 1 . 2]" 1
1097 1 52 LEU MD2 1 77 GLU HG2 . . 3.870 3.322 3.038 3.708 . 0 0 "[ . 1 . 2]" 1
1098 1 52 LEU MD2 1 77 GLU QG . . 3.220 1.978 1.782 2.463 . 0 0 "[ . 1 . 2]" 1
1099 1 52 LEU MD2 1 77 GLU HG3 . . 3.870 1.994 1.792 2.500 . 0 0 "[ . 1 . 2]" 1
1100 1 53 LEU H 1 53 LEU QB . . 3.490 2.941 2.878 2.994 . 0 0 "[ . 1 . 2]" 1
1101 1 53 LEU H 1 53 LEU MD1 . . 4.390 4.041 3.968 4.125 . 0 0 "[ . 1 . 2]" 1
1102 1 53 LEU H 1 53 LEU MD2 . . 3.120 1.918 1.779 2.136 . 0 0 "[ . 1 . 2]" 1
1103 1 53 LEU H 1 53 LEU HG . . 3.410 2.958 2.611 3.316 . 0 0 "[ . 1 . 2]" 1
1104 1 53 LEU H 1 54 ASP H . . 4.620 4.453 4.409 4.487 . 0 0 "[ . 1 . 2]" 1
1105 1 53 LEU H 1 54 ASP HA . . 4.890 4.899 4.850 4.927 0.037 17 0 "[ . 1 . 2]" 1
1106 1 53 LEU HA 1 53 LEU MD1 . . 4.340 4.090 4.039 4.124 . 0 0 "[ . 1 . 2]" 1
1107 1 53 LEU HA 1 53 LEU MD2 . . 4.430 3.520 3.402 3.618 . 0 0 "[ . 1 . 2]" 1
1108 1 53 LEU QB 1 54 ASP H . . 4.060 2.261 1.982 2.651 . 0 0 "[ . 1 . 2]" 1
1109 1 53 LEU HB2 1 53 LEU MD1 . . 3.410 2.202 2.030 2.364 . 0 0 "[ . 1 . 2]" 1
1110 1 53 LEU HB2 1 54 ASP H . . 4.740 2.282 1.992 2.699 . 0 0 "[ . 1 . 2]" 1
1111 1 53 LEU HB3 1 53 LEU MD1 . . 3.410 2.506 2.340 2.622 . 0 0 "[ . 1 . 2]" 1
1112 1 53 LEU HB3 1 54 ASP H . . 4.740 3.707 3.528 3.927 . 0 0 "[ . 1 . 2]" 1
1113 1 53 LEU MD1 1 54 ASP H . . 5.130 3.733 3.274 4.305 . 0 0 "[ . 1 . 2]" 1
1114 1 53 LEU MD1 1 55 PHE H . . 4.640 3.680 2.999 4.196 . 0 0 "[ . 1 . 2]" 1
1115 1 53 LEU MD1 1 55 PHE HA . . 3.850 3.432 2.984 3.735 . 0 0 "[ . 1 . 2]" 1
1116 1 53 LEU MD1 1 55 PHE QB . . 4.170 3.541 2.079 4.164 . 0 0 "[ . 1 . 2]" 1
1117 1 53 LEU MD1 1 55 PHE QD . . 3.850 2.980 2.421 3.375 . 0 0 "[ . 1 . 2]" 1
1118 1 53 LEU MD1 1 58 LEU MD1 . . 3.380 2.124 1.835 2.919 . 0 0 "[ . 1 . 2]" 1
1119 1 53 LEU MD1 1 69 ASN HD21 . . 4.090 2.872 2.200 3.572 . 0 0 "[ . 1 . 2]" 1
1120 1 53 LEU MD1 1 69 ASN HD22 . . 4.090 3.158 2.323 4.034 . 0 0 "[ . 1 . 2]" 1
1121 1 53 LEU MD1 1 70 ALA H . . 5.500 4.955 4.523 5.438 . 0 0 "[ . 1 . 2]" 1
1122 1 53 LEU MD1 1 70 ALA MB . . 4.200 3.732 3.413 4.193 . 0 0 "[ . 1 . 2]" 1
1123 1 54 ASP H 1 55 PHE H . . 3.950 3.372 2.066 3.958 0.008 17 0 "[ . 1 . 2]" 1
1124 1 54 ASP HA 1 56 GLU H . . 4.770 3.916 3.490 4.771 0.001 6 0 "[ . 1 . 2]" 1
1125 1 54 ASP QB 1 55 PHE H . . 4.160 3.489 2.586 3.860 . 0 0 "[ . 1 . 2]" 1
1126 1 54 ASP QB 1 57 SER H . . 3.960 2.695 2.215 3.664 . 0 0 "[ . 1 . 2]" 1
1127 1 54 ASP HB2 1 55 PHE H . . 4.940 4.090 2.695 4.598 . 0 0 "[ . 1 . 2]" 1
1128 1 54 ASP HB2 1 57 SER H . . 4.680 3.352 2.457 4.682 0.002 7 0 "[ . 1 . 2]" 1
1129 1 54 ASP HB3 1 55 PHE H . . 4.940 3.899 2.652 4.517 . 0 0 "[ . 1 . 2]" 1
1130 1 54 ASP HB3 1 57 SER H . . 4.680 3.036 2.241 4.576 . 0 0 "[ . 1 . 2]" 1
1131 1 55 PHE H 1 55 PHE HB2 . . 3.760 2.441 2.174 3.184 . 0 0 "[ . 1 . 2]" 1
1132 1 55 PHE H 1 55 PHE QB . . 3.260 2.355 2.125 2.997 . 0 0 "[ . 1 . 2]" 1
1133 1 55 PHE H 1 55 PHE HB3 . . 3.760 3.146 2.854 3.706 . 0 0 "[ . 1 . 2]" 1
1134 1 55 PHE H 1 55 PHE QD . . 4.410 3.966 3.723 4.360 . 0 0 "[ . 1 . 2]" 1
1135 1 55 PHE H 1 56 GLU H . . 3.390 2.848 2.575 2.986 . 0 0 "[ . 1 . 2]" 1
1136 1 55 PHE H 1 57 SER H . . 4.660 4.176 3.822 4.577 . 0 0 "[ . 1 . 2]" 1
1137 1 55 PHE H 1 58 LEU MD1 . . 5.160 3.700 3.195 4.112 . 0 0 "[ . 1 . 2]" 1
1138 1 55 PHE HA 1 55 PHE QD . . 3.830 2.618 2.169 2.994 . 0 0 "[ . 1 . 2]" 1
1139 1 55 PHE HA 1 57 SER H . . 4.510 4.184 3.841 4.488 . 0 0 "[ . 1 . 2]" 1
1140 1 55 PHE HA 1 58 LEU H . . 4.180 3.470 3.152 3.876 . 0 0 "[ . 1 . 2]" 1
1141 1 55 PHE HA 1 58 LEU MD1 . . 3.660 2.037 1.914 2.243 . 0 0 "[ . 1 . 2]" 1
1142 1 55 PHE HA 1 58 LEU MD2 . . 4.560 4.060 3.740 4.404 . 0 0 "[ . 1 . 2]" 1
1143 1 55 PHE HA 1 58 LEU HG . . 3.910 2.621 2.220 3.102 . 0 0 "[ . 1 . 2]" 1
1144 1 55 PHE QB 1 56 GLU H . . 3.980 2.849 2.344 3.889 . 0 0 "[ . 1 . 2]" 1
1145 1 55 PHE QB 1 58 LEU MD1 . . 4.560 3.543 3.154 3.841 . 0 0 "[ . 1 . 2]" 1
1146 1 55 PHE HB2 1 56 GLU H . . 4.640 3.835 3.466 4.606 . 0 0 "[ . 1 . 2]" 1
1147 1 55 PHE HB3 1 56 GLU H . . 4.640 2.963 2.383 4.192 . 0 0 "[ . 1 . 2]" 1
1148 1 55 PHE QD 1 56 GLU H . . 4.940 4.293 3.916 4.824 . 0 0 "[ . 1 . 2]" 1
1149 1 55 PHE QD 1 56 GLU HA . . 4.470 4.131 3.647 4.428 . 0 0 "[ . 1 . 2]" 1
1150 1 55 PHE QD 1 58 LEU MD1 . . 4.080 2.473 1.959 3.074 . 0 0 "[ . 1 . 2]" 1
1151 1 56 GLU H 1 56 GLU QB . . 2.890 2.515 2.196 2.891 0.001 14 0 "[ . 1 . 2]" 1
1152 1 56 GLU H 1 56 GLU HG2 . . 4.090 2.803 2.095 4.020 . 0 0 "[ . 1 . 2]" 1
1153 1 56 GLU H 1 56 GLU QG . . 3.380 2.335 2.078 2.835 . 0 0 "[ . 1 . 2]" 1
1154 1 56 GLU H 1 56 GLU HG3 . . 4.090 2.975 2.093 3.794 . 0 0 "[ . 1 . 2]" 1
1155 1 56 GLU H 1 57 SER H . . 3.230 2.501 1.824 2.764 . 0 0 "[ . 1 . 2]" 1
1156 1 56 GLU H 1 57 SER HA . . 5.350 5.137 4.572 5.359 0.009 12 0 "[ . 1 . 2]" 1
1157 1 56 GLU H 1 58 LEU H . . 4.460 4.010 3.168 4.353 . 0 0 "[ . 1 . 2]" 1
1158 1 56 GLU HA 1 56 GLU HG2 . . 3.940 3.141 2.247 3.899 . 0 0 "[ . 1 . 2]" 1
1159 1 56 GLU HA 1 56 GLU HG3 . . 3.940 3.426 2.497 3.793 . 0 0 "[ . 1 . 2]" 1
1160 1 56 GLU HA 1 58 LEU H . . 4.650 4.571 4.415 4.652 0.002 19 0 "[ . 1 . 2]" 1
1161 1 56 GLU QB 1 57 SER H . . 3.530 3.052 2.469 3.551 0.021 13 0 "[ . 1 . 2]" 1
1162 1 56 GLU QB 1 58 LEU H . . 5.460 4.990 4.586 5.346 . 0 0 "[ . 1 . 2]" 1
1163 1 56 GLU QG 1 57 SER H . . 4.370 3.262 1.852 4.385 0.015 4 0 "[ . 1 . 2]" 1
1164 1 57 SER H 1 57 SER HB2 . . 3.720 2.545 2.221 3.603 . 0 0 "[ . 1 . 2]" 1
1165 1 57 SER H 1 57 SER QB . . 2.950 2.301 2.198 2.534 . 0 0 "[ . 1 . 2]" 1
1166 1 57 SER H 1 57 SER HB3 . . 3.720 2.884 2.337 3.639 . 0 0 "[ . 1 . 2]" 1
1167 1 57 SER H 1 57 SER HG . . 4.830 3.877 1.984 4.467 . 0 0 "[ . 1 . 2]" 1
1168 1 57 SER H 1 58 LEU HA . . 5.280 5.107 4.882 5.204 . 0 0 "[ . 1 . 2]" 1
1169 1 57 SER H 1 58 LEU HB2 . . 4.890 4.754 4.477 4.892 0.002 8 0 "[ . 1 . 2]" 1
1170 1 57 SER H 1 58 LEU MD1 . . 5.080 4.974 4.738 5.079 . 0 0 "[ . 1 . 2]" 1
1171 1 57 SER H 1 58 LEU MD2 . . 4.990 4.849 4.532 4.995 0.005 17 0 "[ . 1 . 2]" 1
1172 1 57 SER H 1 58 LEU HG . . 4.220 3.893 3.564 4.029 . 0 0 "[ . 1 . 2]" 1
1173 1 57 SER QB 1 58 LEU H . . 4.200 2.625 2.455 3.374 . 0 0 "[ . 1 . 2]" 1
1174 1 58 LEU H 1 58 LEU HB2 . . 3.290 2.655 2.521 2.793 . 0 0 "[ . 1 . 2]" 1
1175 1 58 LEU H 1 58 LEU MD1 . . 3.630 3.552 3.460 3.612 . 0 0 "[ . 1 . 2]" 1
1176 1 58 LEU H 1 58 LEU MD2 . . 3.410 3.045 2.848 3.250 . 0 0 "[ . 1 . 2]" 1
1177 1 58 LEU H 1 58 LEU HG . . 3.070 2.017 1.922 2.182 . 0 0 "[ . 1 . 2]" 1
1178 1 58 LEU H 1 59 LYS H . . 4.890 4.593 4.368 4.643 . 0 0 "[ . 1 . 2]" 1
1179 1 58 LEU HA 1 58 LEU MD1 . . 4.110 3.897 3.866 3.936 . 0 0 "[ . 1 . 2]" 1
1180 1 58 LEU HA 1 58 LEU MD2 . . 3.280 2.115 1.977 2.335 . 0 0 "[ . 1 . 2]" 1
1181 1 58 LEU HB2 1 58 LEU MD1 . . 3.430 2.259 2.167 2.397 . 0 0 "[ . 1 . 2]" 1
1182 1 58 LEU MD1 1 65 TYR QE . . 5.230 4.759 4.367 5.175 . 0 0 "[ . 1 . 2]" 1
1183 1 58 LEU MD1 1 66 ASN HA . . 4.970 3.860 3.267 4.405 . 0 0 "[ . 1 . 2]" 1
1184 1 58 LEU MD1 1 66 ASN HB3 . . 5.130 3.857 3.192 4.498 . 0 0 "[ . 1 . 2]" 1
1185 1 58 LEU MD1 1 69 ASN QD . . 5.070 3.513 2.916 4.031 . 0 0 "[ . 1 . 2]" 1
1186 1 58 LEU MD2 1 59 LYS H . . 4.460 3.540 3.337 3.814 . 0 0 "[ . 1 . 2]" 1
1187 1 58 LEU MD2 1 65 TYR QD . . 3.960 3.388 2.847 3.819 . 0 0 "[ . 1 . 2]" 1
1188 1 58 LEU MD2 1 65 TYR QE . . 3.290 2.557 2.109 3.047 . 0 0 "[ . 1 . 2]" 1
1189 1 58 LEU MD2 1 66 ASN HA . . 4.160 3.155 2.547 3.813 . 0 0 "[ . 1 . 2]" 1
1190 1 58 LEU MD2 1 66 ASN HB3 . . 4.840 4.246 3.191 4.832 . 0 0 "[ . 1 . 2]" 1
1191 1 58 LEU MD2 1 66 ASN QD . . 5.250 3.720 2.797 4.902 . 0 0 "[ . 1 . 2]" 1
1192 1 58 LEU MD2 1 69 ASN HB2 . . 5.170 4.293 3.579 5.079 . 0 0 "[ . 1 . 2]" 1
1193 1 58 LEU MD2 1 69 ASN HB3 . . 4.670 4.007 3.232 4.671 0.001 16 0 "[ . 1 . 2]" 1
1194 1 58 LEU MD2 1 69 ASN HD21 . . 4.570 3.452 2.490 4.389 . 0 0 "[ . 1 . 2]" 1
1195 1 58 LEU MD2 1 69 ASN HD22 . . 4.570 3.620 2.675 4.564 . 0 0 "[ . 1 . 2]" 1
1196 1 59 LYS H 1 59 LYS HG2 . . 4.970 3.843 2.111 4.973 0.003 12 0 "[ . 1 . 2]" 1
1197 1 59 LYS H 1 59 LYS QG . . 4.360 3.302 2.072 4.204 . 0 0 "[ . 1 . 2]" 1
1198 1 59 LYS H 1 59 LYS HG3 . . 4.970 3.870 2.721 4.587 . 0 0 "[ . 1 . 2]" 1
1199 1 59 LYS HA 1 59 LYS QD . . 4.450 3.219 2.063 4.448 . 0 0 "[ . 1 . 2]" 1
1200 1 59 LYS QB 1 62 ASN H . . 4.110 3.204 2.590 3.853 . 0 0 "[ . 1 . 2]" 1
1201 1 59 LYS HB2 1 61 CYS H . . 4.550 3.952 2.406 4.572 0.022 8 0 "[ . 1 . 2]" 1
1202 1 59 LYS HB2 1 62 ASN H . . 4.810 3.927 2.731 4.810 0.000 9 0 "[ . 1 . 2]" 1
1203 1 59 LYS HB3 1 61 CYS H . . 4.550 3.207 2.726 4.433 . 0 0 "[ . 1 . 2]" 1
1204 1 59 LYS HB3 1 62 ASN H . . 4.810 3.614 2.923 4.811 0.001 16 0 "[ . 1 . 2]" 1
1205 1 60 LYS HA 1 60 LYS QG . . 3.860 2.648 2.151 3.437 . 0 0 "[ . 1 . 2]" 1
1206 1 60 LYS HA 1 62 ASN H . . 4.840 4.543 3.891 4.842 0.002 8 0 "[ . 1 . 2]" 1
1207 1 60 LYS QB 1 61 CYS H . . 4.380 3.250 2.155 4.044 . 0 0 "[ . 1 . 2]" 1
1208 1 60 LYS QE 1 60 LYS QG . . 3.300 2.242 2.062 2.489 . 0 0 "[ . 1 . 2]" 1
1209 1 61 CYS H 1 61 CYS QB . . 3.680 2.385 2.166 2.630 . 0 0 "[ . 1 . 2]" 1
1210 1 61 CYS H 1 62 ASN H . . 3.980 2.588 1.820 3.199 . 0 0 "[ . 1 . 2]" 1
1211 1 61 CYS QB 1 62 ASN H . . 4.330 2.381 2.063 3.495 . 0 0 "[ . 1 . 2]" 1
1212 1 61 CYS HB2 1 62 ASN H . . 4.940 3.374 2.275 4.133 . 0 0 "[ . 1 . 2]" 1
1213 1 61 CYS HB3 1 62 ASN H . . 4.940 2.605 2.078 3.770 . 0 0 "[ . 1 . 2]" 1
1214 1 62 ASN H 1 62 ASN QB . . 3.490 2.332 2.166 2.817 . 0 0 "[ . 1 . 2]" 1
1215 1 62 ASN H 1 63 ALA H . . 4.530 4.283 3.710 4.557 0.027 17 0 "[ . 1 . 2]" 1
1216 1 62 ASN HA 1 63 ALA H . . 3.260 2.190 2.140 2.417 . 0 0 "[ . 1 . 2]" 1
1217 1 62 ASN HA 1 64 HIS H . . 4.680 4.040 3.323 4.368 . 0 0 "[ . 1 . 2]" 1
1218 1 62 ASN HA 1 65 TYR H . . 4.870 4.482 3.700 4.869 . 0 0 "[ . 1 . 2]" 1
1219 1 62 ASN QB 1 63 ALA H . . 4.460 3.701 3.143 3.996 . 0 0 "[ . 1 . 2]" 1
1220 1 62 ASN QD 1 63 ALA MB . . 5.270 4.804 3.819 5.274 0.004 12 0 "[ . 1 . 2]" 1
1221 1 62 ASN QD 1 64 HIS H . . 4.980 3.991 2.530 4.932 . 0 0 "[ . 1 . 2]" 1
1222 1 62 ASN QD 1 65 TYR H . . 4.880 2.970 1.617 4.443 . 0 0 "[ . 1 . 2]" 1
1223 1 63 ALA H 1 63 ALA MB . . 3.060 2.230 2.026 2.461 . 0 0 "[ . 1 . 2]" 1
1224 1 63 ALA H 1 64 HIS H . . 3.750 2.447 2.050 2.929 . 0 0 "[ . 1 . 2]" 1
1225 1 63 ALA HA 1 66 ASN HB2 . . 4.040 2.477 2.187 2.897 . 0 0 "[ . 1 . 2]" 1
1226 1 63 ALA HA 1 66 ASN HB3 . . 4.500 4.017 3.764 4.359 . 0 0 "[ . 1 . 2]" 1
1227 1 63 ALA HA 1 66 ASN QD . . 3.820 3.179 1.906 3.852 0.032 17 0 "[ . 1 . 2]" 1
1228 1 63 ALA HA 1 67 LEU H . . 5.130 3.967 3.552 4.344 . 0 0 "[ . 1 . 2]" 1
1229 1 63 ALA MB 1 64 HIS H . . 3.230 2.446 2.051 2.888 . 0 0 "[ . 1 . 2]" 1
1230 1 63 ALA MB 1 64 HIS HA . . 4.290 3.675 3.583 3.880 . 0 0 "[ . 1 . 2]" 1
1231 1 63 ALA MB 1 64 HIS QB . . 4.300 3.853 3.545 4.191 . 0 0 "[ . 1 . 2]" 1
1232 1 63 ALA MB 1 65 TYR H . . 4.880 4.601 4.272 4.894 0.014 17 0 "[ . 1 . 2]" 1
1233 1 63 ALA MB 1 67 LEU MD1 . . 3.800 2.697 2.137 3.177 . 0 0 "[ . 1 . 2]" 1
1234 1 63 ALA MB 1 67 LEU MD2 . . 4.930 4.335 3.412 4.928 . 0 0 "[ . 1 . 2]" 1
1235 1 63 ALA MB 1 90 ASN HB2 . . 5.000 3.543 2.382 4.043 . 0 0 "[ . 1 . 2]" 1
1236 1 63 ALA MB 1 90 ASN QB . . 4.220 3.336 1.975 3.836 . 0 0 "[ . 1 . 2]" 1
1237 1 63 ALA MB 1 90 ASN HB3 . . 5.000 4.333 2.003 4.938 . 0 0 "[ . 1 . 2]" 1
1238 1 63 ALA MB 1 90 ASN HD21 . . 4.400 2.997 1.953 4.051 . 0 0 "[ . 1 . 2]" 1
1239 1 63 ALA MB 1 90 ASN QD . . 3.690 2.575 1.713 3.606 . 0 0 "[ . 1 . 2]" 1
1240 1 63 ALA MB 1 90 ASN HD22 . . 4.400 2.969 1.869 4.413 0.013 17 0 "[ . 1 . 2]" 1
1241 1 64 HIS H 1 64 HIS QB . . 2.830 2.223 2.136 2.274 . 0 0 "[ . 1 . 2]" 1
1242 1 64 HIS H 1 65 TYR H . . 3.380 2.960 2.733 3.236 . 0 0 "[ . 1 . 2]" 1
1243 1 64 HIS H 1 65 TYR QB . . 5.340 4.657 4.457 4.871 . 0 0 "[ . 1 . 2]" 1
1244 1 64 HIS H 1 67 LEU MD1 . . 4.550 3.885 3.586 4.074 . 0 0 "[ . 1 . 2]" 1
1245 1 64 HIS H 1 90 ASN QB . . 5.340 4.749 3.942 5.344 0.004 20 0 "[ . 1 . 2]" 1
1246 1 64 HIS H 1 90 ASN QD . . 4.610 3.529 2.660 4.631 0.021 17 0 "[ . 1 . 2]" 1
1247 1 64 HIS HA 1 67 LEU QB . . 3.860 2.811 2.527 3.425 . 0 0 "[ . 1 . 2]" 1
1248 1 64 HIS HA 1 67 LEU MD1 . . 3.610 2.554 2.097 2.919 . 0 0 "[ . 1 . 2]" 1
1249 1 64 HIS HA 1 86 PRO HB2 . . 4.440 3.071 2.684 3.397 . 0 0 "[ . 1 . 2]" 1
1250 1 64 HIS HA 1 86 PRO QB . . 3.900 2.999 2.643 3.269 . 0 0 "[ . 1 . 2]" 1
1251 1 64 HIS HA 1 86 PRO HB3 . . 4.440 4.227 3.960 4.442 0.002 4 0 "[ . 1 . 2]" 1
1252 1 64 HIS QB 1 65 TYR H . . 2.920 2.340 2.028 2.636 . 0 0 "[ . 1 . 2]" 1
1253 1 64 HIS QB 1 90 ASN QD . . 4.340 3.484 2.778 4.297 . 0 0 "[ . 1 . 2]" 1
1254 1 64 HIS HE1 1 86 PRO QB . . 4.170 3.155 2.659 4.059 . 0 0 "[ . 1 . 2]" 1
1255 1 64 HIS HE1 1 86 PRO HG2 . . 3.970 2.439 1.999 3.420 . 0 0 "[ . 1 . 2]" 1
1256 1 64 HIS HE1 1 87 GLU QG . . 4.220 3.332 2.349 4.170 . 0 0 "[ . 1 . 2]" 1
1257 1 65 TYR H 1 65 TYR HB2 . . 3.260 2.681 2.552 2.891 . 0 0 "[ . 1 . 2]" 1
1258 1 65 TYR H 1 65 TYR HB3 . . 3.260 2.402 2.283 2.504 . 0 0 "[ . 1 . 2]" 1
1259 1 65 TYR H 1 65 TYR QD . . 4.340 4.158 4.048 4.196 . 0 0 "[ . 1 . 2]" 1
1260 1 65 TYR H 1 66 ASN H . . 3.410 2.733 2.469 2.946 . 0 0 "[ . 1 . 2]" 1
1261 1 65 TYR HA 1 65 TYR QD . . 3.730 2.999 2.461 3.231 . 0 0 "[ . 1 . 2]" 1
1262 1 65 TYR HA 1 68 GLN H . . 4.210 4.002 3.468 4.177 . 0 0 "[ . 1 . 2]" 1
1263 1 65 TYR HA 1 68 GLN QB . . 4.250 3.884 3.406 4.137 . 0 0 "[ . 1 . 2]" 1
1264 1 65 TYR HA 1 68 GLN QE . . 4.320 2.696 1.881 3.604 . 0 0 "[ . 1 . 2]" 1
1265 1 65 TYR HA 1 68 GLN HG2 . . 4.480 2.329 1.993 2.745 . 0 0 "[ . 1 . 2]" 1
1266 1 65 TYR HA 1 68 GLN QG . . 3.840 2.269 1.980 2.604 . 0 0 "[ . 1 . 2]" 1
1267 1 65 TYR HA 1 68 GLN HG3 . . 4.480 3.484 2.368 4.024 . 0 0 "[ . 1 . 2]" 1
1268 1 65 TYR HA 1 69 ASN H . . 4.270 3.867 3.604 4.280 0.010 20 0 "[ . 1 . 2]" 1
1269 1 65 TYR QB 1 66 ASN H . . 3.290 2.522 2.292 2.716 . 0 0 "[ . 1 . 2]" 1
1270 1 65 TYR HB2 1 66 ASN H . . 4.020 3.910 3.743 4.033 0.013 8 0 "[ . 1 . 2]" 1
1271 1 65 TYR HB3 1 66 ASN H . . 4.020 2.554 2.313 2.762 . 0 0 "[ . 1 . 2]" 1
1272 1 65 TYR QD 1 66 ASN H . . 3.800 2.984 2.450 3.321 . 0 0 "[ . 1 . 2]" 1
1273 1 65 TYR QD 1 66 ASN HA . . 3.820 2.941 2.446 3.818 . 0 0 "[ . 1 . 2]" 1
1274 1 65 TYR QE 1 66 ASN HA . . 4.520 4.030 3.530 4.521 0.001 6 0 "[ . 1 . 2]" 1
1275 1 66 ASN H 1 66 ASN HB2 . . 3.600 2.324 2.189 2.530 . 0 0 "[ . 1 . 2]" 1
1276 1 66 ASN H 1 66 ASN HB3 . . 3.780 3.552 3.497 3.590 . 0 0 "[ . 1 . 2]" 1
1277 1 66 ASN H 1 66 ASN QD . . 4.210 3.729 2.731 4.179 . 0 0 "[ . 1 . 2]" 1
1278 1 66 ASN H 1 67 LEU H . . 3.490 2.713 2.543 2.847 . 0 0 "[ . 1 . 2]" 1
1279 1 66 ASN H 1 67 LEU MD1 . . 5.500 5.126 4.917 5.388 . 0 0 "[ . 1 . 2]" 1
1280 1 66 ASN H 1 68 GLN H . . 4.880 4.833 4.679 4.898 0.018 17 0 "[ . 1 . 2]" 1
1281 1 66 ASN HA 1 66 ASN QD . . 4.510 3.893 3.557 4.047 . 0 0 "[ . 1 . 2]" 1
1282 1 66 ASN HA 1 69 ASN H . . 4.630 3.948 3.695 4.154 . 0 0 "[ . 1 . 2]" 1
1283 1 66 ASN HA 1 69 ASN HB3 . . 3.890 3.012 2.799 3.463 . 0 0 "[ . 1 . 2]" 1
1284 1 66 ASN HA 1 69 ASN QD . . 4.680 4.115 3.474 4.600 . 0 0 "[ . 1 . 2]" 1
1285 1 66 ASN HB2 1 67 LEU H . . 3.850 2.776 2.381 3.033 . 0 0 "[ . 1 . 2]" 1
1286 1 66 ASN HB3 1 67 LEU H . . 3.970 3.497 3.215 3.820 . 0 0 "[ . 1 . 2]" 1
1287 1 66 ASN HB3 1 70 ALA MB . . 5.460 4.911 4.496 5.323 . 0 0 "[ . 1 . 2]" 1
1288 1 67 LEU H 1 67 LEU HB2 . . 3.750 2.312 2.206 2.508 . 0 0 "[ . 1 . 2]" 1
1289 1 67 LEU H 1 67 LEU QB . . 3.150 2.284 2.184 2.463 . 0 0 "[ . 1 . 2]" 1
1290 1 67 LEU H 1 67 LEU HB3 . . 3.750 3.551 3.509 3.596 . 0 0 "[ . 1 . 2]" 1
1291 1 67 LEU H 1 67 LEU MD1 . . 3.500 3.441 3.192 3.506 0.006 17 0 "[ . 1 . 2]" 1
1292 1 67 LEU H 1 67 LEU MD2 . . 4.550 3.873 3.670 4.036 . 0 0 "[ . 1 . 2]" 1
1293 1 67 LEU H 1 67 LEU HG . . 3.230 2.652 2.242 2.873 . 0 0 "[ . 1 . 2]" 1
1294 1 67 LEU H 1 68 GLN H . . 3.410 2.921 2.681 3.029 . 0 0 "[ . 1 . 2]" 1
1295 1 67 LEU H 1 68 GLN HA . . 5.500 5.415 5.240 5.507 0.007 4 0 "[ . 1 . 2]" 1
1296 1 67 LEU HA 1 67 LEU MD2 . . 3.320 2.252 2.074 2.546 . 0 0 "[ . 1 . 2]" 1
1297 1 67 LEU HA 1 67 LEU HG . . 3.970 2.759 2.585 2.891 . 0 0 "[ . 1 . 2]" 1
1298 1 67 LEU HA 1 69 ASN H . . 4.980 4.291 3.951 4.526 . 0 0 "[ . 1 . 2]" 1
1299 1 67 LEU HA 1 70 ALA H . . 4.130 3.653 3.450 3.831 . 0 0 "[ . 1 . 2]" 1
1300 1 67 LEU HA 1 70 ALA MB . . 4.160 3.257 2.879 3.650 . 0 0 "[ . 1 . 2]" 1
1301 1 67 LEU HA 1 71 PHE H . . 4.530 4.144 3.912 4.435 . 0 0 "[ . 1 . 2]" 1
1302 1 67 LEU QB 1 68 GLN H . . 3.460 2.096 1.943 2.205 . 0 0 "[ . 1 . 2]" 1
1303 1 67 LEU QB 1 86 PRO QB . . 3.860 2.096 1.889 2.345 . 0 0 "[ . 1 . 2]" 1
1304 1 67 LEU QB 1 86 PRO HG3 . . 4.590 4.190 3.945 4.515 . 0 0 "[ . 1 . 2]" 1
1305 1 67 LEU HB2 1 68 GLN H . . 4.300 2.168 1.966 2.328 . 0 0 "[ . 1 . 2]" 1
1306 1 67 LEU HB2 1 86 PRO HA . . 4.190 3.072 2.494 3.370 . 0 0 "[ . 1 . 2]" 1
1307 1 67 LEU HB3 1 68 GLN H . . 4.300 2.840 2.622 3.052 . 0 0 "[ . 1 . 2]" 1
1308 1 67 LEU HB3 1 86 PRO HA . . 4.190 2.329 2.004 2.626 . 0 0 "[ . 1 . 2]" 1
1309 1 67 LEU MD1 1 68 GLN H . . 4.220 3.938 3.628 4.094 . 0 0 "[ . 1 . 2]" 1
1310 1 67 LEU MD1 1 71 PHE QE . . 4.850 3.494 3.018 4.566 . 0 0 "[ . 1 . 2]" 1
1311 1 67 LEU MD1 1 86 PRO HA . . 3.410 2.339 1.990 2.680 . 0 0 "[ . 1 . 2]" 1
1312 1 67 LEU MD1 1 86 PRO HB2 . . 4.460 3.242 2.825 3.486 . 0 0 "[ . 1 . 2]" 1
1313 1 67 LEU MD1 1 86 PRO QB . . 3.690 2.979 2.598 3.177 . 0 0 "[ . 1 . 2]" 1
1314 1 67 LEU MD1 1 86 PRO HB3 . . 4.460 3.483 3.033 3.720 . 0 0 "[ . 1 . 2]" 1
1315 1 67 LEU MD1 1 86 PRO HG3 . . 5.490 5.268 4.864 5.459 . 0 0 "[ . 1 . 2]" 1
1316 1 67 LEU MD1 1 87 GLU H . . 5.110 4.507 4.199 4.781 . 0 0 "[ . 1 . 2]" 1
1317 1 67 LEU MD1 1 89 VAL HB . . 3.580 2.969 1.969 3.430 . 0 0 "[ . 1 . 2]" 1
1318 1 67 LEU MD1 1 89 VAL MG1 . . 3.800 3.176 2.186 3.537 . 0 0 "[ . 1 . 2]" 1
1319 1 67 LEU MD1 1 90 ASN H . . 3.420 2.863 2.361 3.186 . 0 0 "[ . 1 . 2]" 1
1320 1 67 LEU MD1 1 90 ASN HA . . 4.570 3.251 2.996 3.683 . 0 0 "[ . 1 . 2]" 1
1321 1 67 LEU MD1 1 90 ASN HB2 . . 4.020 2.279 1.861 3.860 . 0 0 "[ . 1 . 2]" 1
1322 1 67 LEU MD1 1 90 ASN QB . . 3.390 2.046 1.781 2.416 . 0 0 "[ . 1 . 2]" 1
1323 1 67 LEU MD1 1 90 ASN HB3 . . 4.020 3.095 1.827 3.704 . 0 0 "[ . 1 . 2]" 1
1324 1 67 LEU MD1 1 90 ASN QD . . 4.700 3.188 2.130 4.059 . 0 0 "[ . 1 . 2]" 1
1325 1 67 LEU MD1 1 91 VAL H . . 5.500 5.114 4.800 5.490 . 0 0 "[ . 1 . 2]" 1
1326 1 67 LEU MD2 1 71 PHE QE . . 4.450 2.491 1.973 3.139 . 0 0 "[ . 1 . 2]" 1
1327 1 67 LEU MD2 1 71 PHE HZ . . 3.940 2.815 2.068 3.490 . 0 0 "[ . 1 . 2]" 1
1328 1 67 LEU MD2 1 89 VAL HB . . 3.980 2.999 2.312 3.464 . 0 0 "[ . 1 . 2]" 1
1329 1 67 LEU MD2 1 89 VAL MG1 . . 3.330 2.668 1.840 3.270 . 0 0 "[ . 1 . 2]" 1
1330 1 68 GLN H 1 68 GLN QB . . 2.970 2.281 2.162 2.425 . 0 0 "[ . 1 . 2]" 1
1331 1 68 GLN H 1 68 GLN HG2 . . 4.150 2.752 2.305 3.582 . 0 0 "[ . 1 . 2]" 1
1332 1 68 GLN H 1 68 GLN QG . . 3.560 2.605 2.268 2.890 . 0 0 "[ . 1 . 2]" 1
1333 1 68 GLN H 1 68 GLN HG3 . . 4.150 3.724 2.305 4.067 . 0 0 "[ . 1 . 2]" 1
1334 1 68 GLN H 1 69 ASN H . . 3.400 2.892 2.801 2.965 . 0 0 "[ . 1 . 2]" 1
1335 1 68 GLN H 1 70 ALA H . . 4.980 4.659 4.385 4.938 . 0 0 "[ . 1 . 2]" 1
1336 1 68 GLN H 1 71 PHE QB . . 5.150 4.680 4.233 5.037 . 0 0 "[ . 1 . 2]" 1
1337 1 68 GLN H 1 71 PHE QD . . 5.040 3.784 3.365 4.940 . 0 0 "[ . 1 . 2]" 1
1338 1 68 GLN H 1 86 PRO HA . . 4.150 4.060 3.524 4.156 0.006 20 0 "[ . 1 . 2]" 1
1339 1 68 GLN H 1 86 PRO QB . . 3.330 2.128 1.930 2.271 . 0 0 "[ . 1 . 2]" 1
1340 1 68 GLN H 1 86 PRO HG2 . . 4.670 4.566 4.385 4.671 0.001 8 0 "[ . 1 . 2]" 1
1341 1 68 GLN H 1 86 PRO HG3 . . 4.130 3.629 3.375 3.881 . 0 0 "[ . 1 . 2]" 1
1342 1 68 GLN HA 1 68 GLN HG2 . . 4.220 3.795 3.628 4.236 0.016 8 0 "[ . 1 . 2]" 1
1343 1 68 GLN HA 1 68 GLN QG . . 3.670 3.328 3.274 3.447 . 0 0 "[ . 1 . 2]" 1
1344 1 68 GLN HA 1 68 GLN HG3 . . 4.220 3.706 3.557 3.844 . 0 0 "[ . 1 . 2]" 1
1345 1 68 GLN HA 1 70 ALA H . . 4.820 4.634 4.239 4.839 0.019 20 0 "[ . 1 . 2]" 1
1346 1 68 GLN HA 1 71 PHE H . . 3.810 3.558 3.255 3.801 . 0 0 "[ . 1 . 2]" 1
1347 1 68 GLN HA 1 71 PHE QB . . 3.710 2.402 1.990 2.751 . 0 0 "[ . 1 . 2]" 1
1348 1 68 GLN HA 1 71 PHE QD . . 4.230 2.404 2.011 3.747 . 0 0 "[ . 1 . 2]" 1
1349 1 68 GLN HA 1 72 ASN H . . 4.240 3.741 3.452 3.889 . 0 0 "[ . 1 . 2]" 1
1350 1 68 GLN HA 1 86 PRO HG2 . . 4.630 4.485 4.267 4.630 . 0 0 "[ . 1 . 2]" 1
1351 1 68 GLN HA 1 86 PRO HG3 . . 4.190 2.820 2.572 2.976 . 0 0 "[ . 1 . 2]" 1
1352 1 68 GLN QB 1 69 ASN H . . 3.600 3.408 3.273 3.523 . 0 0 "[ . 1 . 2]" 1
1353 1 68 GLN QB 1 69 ASN HA . . 4.560 4.483 4.313 4.561 0.001 2 0 "[ . 1 . 2]" 1
1354 1 68 GLN QB 1 72 ASN H . . 4.930 4.557 4.304 4.791 . 0 0 "[ . 1 . 2]" 1
1355 1 68 GLN QB 1 72 ASN HD21 . . 4.620 3.346 2.805 3.823 . 0 0 "[ . 1 . 2]" 1
1356 1 68 GLN QB 1 72 ASN HD22 . . 4.620 2.627 2.068 4.700 0.080 6 0 "[ . 1 . 2]" 1
1357 1 68 GLN QB 1 86 PRO QD . . 4.640 3.706 3.382 4.030 . 0 0 "[ . 1 . 2]" 1
1358 1 68 GLN QB 1 86 PRO HG2 . . 3.940 3.287 3.073 3.603 . 0 0 "[ . 1 . 2]" 1
1359 1 68 GLN QE 1 68 GLN QG . . 3.100 2.180 2.067 2.538 . 0 0 "[ . 1 . 2]" 1
1360 1 68 GLN QE 1 69 ASN H . . 4.520 4.096 2.630 4.527 0.007 6 0 "[ . 1 . 2]" 1
1361 1 68 GLN QG 1 72 ASN QD . . 3.610 2.718 2.281 3.555 . 0 0 "[ . 1 . 2]" 1
1362 1 68 GLN HG2 1 72 ASN HD21 . . 4.640 4.464 3.973 4.641 0.001 18 0 "[ . 1 . 2]" 1
1363 1 68 GLN HG2 1 72 ASN HD22 . . 4.640 4.520 4.211 4.663 0.023 20 0 "[ . 1 . 2]" 1
1364 1 68 GLN HG3 1 72 ASN HD21 . . 4.640 3.063 2.404 4.351 . 0 0 "[ . 1 . 2]" 1
1365 1 68 GLN HG3 1 72 ASN HD22 . . 4.640 3.274 2.576 4.648 0.008 18 0 "[ . 1 . 2]" 1
1366 1 69 ASN H 1 69 ASN HB2 . . 3.090 2.390 2.216 2.593 . 0 0 "[ . 1 . 2]" 1
1367 1 69 ASN H 1 69 ASN HB3 . . 3.250 2.689 2.470 2.897 . 0 0 "[ . 1 . 2]" 1
1368 1 69 ASN H 1 70 ALA H . . 3.320 2.886 2.759 3.039 . 0 0 "[ . 1 . 2]" 1
1369 1 69 ASN H 1 70 ALA MB . . 4.670 4.482 4.368 4.588 . 0 0 "[ . 1 . 2]" 1
1370 1 69 ASN HA 1 71 PHE H . . 4.930 4.775 4.277 4.930 0.000 18 0 "[ . 1 . 2]" 1
1371 1 69 ASN HA 1 72 ASN H . . 4.170 3.874 3.682 4.170 . 0 0 "[ . 1 . 2]" 1
1372 1 69 ASN HA 1 72 ASN QB . . 4.170 3.205 2.715 4.278 0.108 20 0 "[ . 1 . 2]" 1
1373 1 69 ASN HB2 1 69 ASN HD22 . . 4.070 3.980 3.845 4.084 0.014 10 0 "[ . 1 . 2]" 1
1374 1 69 ASN HB2 1 70 ALA H . . 4.140 3.645 3.368 3.906 . 0 0 "[ . 1 . 2]" 1
1375 1 69 ASN HB3 1 69 ASN QD . . 3.300 2.147 2.097 2.339 . 0 0 "[ . 1 . 2]" 1
1376 1 69 ASN HB3 1 69 ASN HD22 . . 3.830 3.455 3.435 3.537 . 0 0 "[ . 1 . 2]" 1
1377 1 69 ASN HB3 1 70 ALA H . . 3.230 2.318 2.099 2.607 . 0 0 "[ . 1 . 2]" 1
1378 1 69 ASN HB3 1 70 ALA MB . . 4.400 3.675 3.448 3.820 . 0 0 "[ . 1 . 2]" 1
1379 1 69 ASN HB3 1 71 PHE H . . 5.230 4.912 4.485 5.150 . 0 0 "[ . 1 . 2]" 1
1380 1 69 ASN QD 1 70 ALA H . . 3.870 3.408 2.575 3.859 . 0 0 "[ . 1 . 2]" 1
1381 1 69 ASN HD21 1 73 LEU MD1 . . 3.660 2.779 2.440 3.581 . 0 0 "[ . 1 . 2]" 1
1382 1 69 ASN HD22 1 73 LEU MD1 . . 3.660 2.270 1.849 2.771 . 0 0 "[ . 1 . 2]" 1
1383 1 70 ALA H 1 70 ALA MB . . 2.870 2.102 2.039 2.229 . 0 0 "[ . 1 . 2]" 1
1384 1 70 ALA H 1 71 PHE H . . 3.230 2.723 2.585 2.926 . 0 0 "[ . 1 . 2]" 1
1385 1 70 ALA H 1 71 PHE QB . . 5.280 4.609 4.422 4.831 . 0 0 "[ . 1 . 2]" 1
1386 1 70 ALA H 1 72 ASN H . . 4.600 4.250 3.925 4.543 . 0 0 "[ . 1 . 2]" 1
1387 1 70 ALA HA 1 72 ASN H . . 4.690 4.488 4.226 4.685 . 0 0 "[ . 1 . 2]" 1
1388 1 70 ALA HA 1 73 LEU H . . 4.030 3.657 3.430 3.914 . 0 0 "[ . 1 . 2]" 1
1389 1 70 ALA HA 1 73 LEU HB2 . . 3.980 2.526 2.224 2.781 . 0 0 "[ . 1 . 2]" 1
1390 1 70 ALA HA 1 73 LEU HB3 . . 4.740 3.991 3.627 4.248 . 0 0 "[ . 1 . 2]" 1
1391 1 70 ALA HA 1 73 LEU MD1 . . 3.890 2.965 2.409 3.245 . 0 0 "[ . 1 . 2]" 1
1392 1 70 ALA HA 1 73 LEU MD2 . . 5.420 5.056 4.659 5.251 . 0 0 "[ . 1 . 2]" 1
1393 1 70 ALA HA 1 74 ALA H . . 4.010 3.757 3.435 4.010 . 0 0 "[ . 1 . 2]" 1
1394 1 70 ALA MB 1 71 PHE H . . 3.160 2.480 2.313 2.849 . 0 0 "[ . 1 . 2]" 1
1395 1 70 ALA MB 1 71 PHE HA . . 4.970 3.680 3.607 3.793 . 0 0 "[ . 1 . 2]" 1
1396 1 70 ALA MB 1 106 TYR QE . . 4.280 3.919 3.442 4.251 . 0 0 "[ . 1 . 2]" 1
1397 1 71 PHE H 1 71 PHE QB . . 3.090 2.407 2.242 2.585 . 0 0 "[ . 1 . 2]" 1
1398 1 71 PHE H 1 71 PHE QD . . 3.420 3.011 2.035 3.210 . 0 0 "[ . 1 . 2]" 1
1399 1 71 PHE H 1 71 PHE QE . . 4.720 4.512 4.151 4.727 0.007 6 0 "[ . 1 . 2]" 1
1400 1 71 PHE H 1 72 ASN H . . 3.260 2.826 2.651 2.996 . 0 0 "[ . 1 . 2]" 1
1401 1 71 PHE HA 1 71 PHE QD . . 3.780 2.140 1.997 2.589 . 0 0 "[ . 1 . 2]" 1
1402 1 71 PHE HA 1 71 PHE QE . . 4.400 4.307 4.254 4.403 0.003 20 0 "[ . 1 . 2]" 1
1403 1 71 PHE HA 1 74 ALA H . . 4.380 3.983 3.619 4.314 . 0 0 "[ . 1 . 2]" 1
1404 1 71 PHE HA 1 74 ALA MB . . 4.060 3.146 2.798 3.679 . 0 0 "[ . 1 . 2]" 1
1405 1 71 PHE HA 1 82 LYS QD . . 4.700 4.158 3.758 4.612 . 0 0 "[ . 1 . 2]" 1
1406 1 71 PHE QB 1 72 ASN H . . 4.140 2.490 2.335 2.678 . 0 0 "[ . 1 . 2]" 1
1407 1 71 PHE QB 1 82 LYS QB . . 4.620 3.624 2.163 4.435 . 0 0 "[ . 1 . 2]" 1
1408 1 71 PHE QB 1 82 LYS QD . . 3.840 2.206 1.919 2.873 . 0 0 "[ . 1 . 2]" 1
1409 1 71 PHE QB 1 82 LYS HG2 . . 4.680 2.730 2.010 4.685 0.005 20 0 "[ . 1 . 2]" 1
1410 1 71 PHE QB 1 82 LYS QG . . 3.940 2.576 1.992 3.887 . 0 0 "[ . 1 . 2]" 1
1411 1 71 PHE QB 1 82 LYS HG3 . . 4.680 3.589 3.096 4.383 . 0 0 "[ . 1 . 2]" 1
1412 1 71 PHE QB 1 86 PRO HG3 . . 5.410 4.389 3.948 4.755 . 0 0 "[ . 1 . 2]" 1
1413 1 71 PHE QD 1 72 ASN H . . 4.500 4.340 4.204 4.462 . 0 0 "[ . 1 . 2]" 1
1414 1 71 PHE QD 1 86 PRO QD . . 3.970 2.655 2.106 3.165 . 0 0 "[ . 1 . 2]" 1
1415 1 71 PHE QD 1 86 PRO HG3 . . 4.400 3.606 3.220 4.153 . 0 0 "[ . 1 . 2]" 1
1416 1 71 PHE QD 1 102 TYR QE . . 4.500 3.174 2.227 4.433 . 0 0 "[ . 1 . 2]" 1
1417 1 71 PHE QE 1 84 LEU H . . 5.120 4.578 2.805 5.129 0.009 17 0 "[ . 1 . 2]" 1
1418 1 71 PHE QE 1 84 LEU MD1 . . 4.390 3.618 2.864 4.121 . 0 0 "[ . 1 . 2]" 1
1419 1 71 PHE QE 1 86 PRO HA . . 3.860 2.287 1.997 3.652 . 0 0 "[ . 1 . 2]" 1
1420 1 71 PHE QE 1 86 PRO HG3 . . 5.210 4.804 3.929 5.217 0.007 20 0 "[ . 1 . 2]" 1
1421 1 71 PHE QE 1 89 VAL MG2 . . 4.100 3.351 2.926 3.822 . 0 0 "[ . 1 . 2]" 1
1422 1 71 PHE QE 1 102 TYR QE . . 4.370 3.264 2.078 3.936 . 0 0 "[ . 1 . 2]" 1
1423 1 71 PHE HZ 1 84 LEU MD1 . . 4.060 3.496 2.952 3.840 . 0 0 "[ . 1 . 2]" 1
1424 1 71 PHE HZ 1 89 VAL MG1 . . 4.400 3.492 3.114 3.994 . 0 0 "[ . 1 . 2]" 1
1425 1 71 PHE HZ 1 89 VAL MG2 . . 3.530 2.481 1.973 3.050 . 0 0 "[ . 1 . 2]" 1
1426 1 72 ASN H 1 72 ASN HB2 . . 3.620 2.580 2.358 3.605 . 0 0 "[ . 1 . 2]" 1
1427 1 72 ASN H 1 72 ASN QB . . 2.830 2.419 2.316 2.525 . 0 0 "[ . 1 . 2]" 1
1428 1 72 ASN H 1 72 ASN HB3 . . 3.620 3.470 2.346 3.606 . 0 0 "[ . 1 . 2]" 1
1429 1 72 ASN H 1 72 ASN HD21 . . 5.020 3.200 2.745 3.530 . 0 0 "[ . 1 . 2]" 1
1430 1 72 ASN H 1 72 ASN QD . . 4.250 3.051 2.681 3.334 . 0 0 "[ . 1 . 2]" 1
1431 1 72 ASN H 1 72 ASN HD22 . . 5.020 3.878 3.562 4.095 . 0 0 "[ . 1 . 2]" 1
1432 1 72 ASN H 1 73 LEU H . . 3.230 2.719 2.547 2.900 . 0 0 "[ . 1 . 2]" 1
1433 1 72 ASN H 1 73 LEU HB2 . . 5.080 4.510 4.363 4.676 . 0 0 "[ . 1 . 2]" 1
1434 1 72 ASN H 1 74 ALA H . . 4.640 4.224 4.047 4.529 . 0 0 "[ . 1 . 2]" 1
1435 1 72 ASN H 1 82 LYS QD . . 4.940 4.025 3.434 4.894 . 0 0 "[ . 1 . 2]" 1
1436 1 72 ASN HA 1 74 ALA H . . 5.030 4.537 4.216 4.950 . 0 0 "[ . 1 . 2]" 1
1437 1 72 ASN HA 1 75 GLU H . . 3.760 3.337 3.119 3.518 . 0 0 "[ . 1 . 2]" 1
1438 1 72 ASN HA 1 75 GLU HB2 . . 5.140 3.438 3.010 3.733 . 0 0 "[ . 1 . 2]" 1
1439 1 72 ASN HA 1 75 GLU QB . . 4.440 2.323 2.071 2.598 . 0 0 "[ . 1 . 2]" 1
1440 1 72 ASN HA 1 75 GLU HB3 . . 5.140 2.370 2.086 2.660 . 0 0 "[ . 1 . 2]" 1
1441 1 72 ASN HA 1 76 LYS H . . 4.380 4.241 3.978 4.385 0.005 12 0 "[ . 1 . 2]" 1
1442 1 72 ASN HA 1 82 LYS QD . . 4.850 3.454 2.880 4.654 . 0 0 "[ . 1 . 2]" 1
1443 1 72 ASN HA 1 82 LYS QE . . 4.330 3.591 2.317 4.312 . 0 0 "[ . 1 . 2]" 1
1444 1 72 ASN QB 1 72 ASN QD . . 3.060 2.079 2.063 2.103 . 0 0 "[ . 1 . 2]" 1
1445 1 72 ASN QB 1 73 LEU H . . 3.160 2.407 2.090 3.253 0.093 20 0 "[ . 1 . 2]" 1
1446 1 72 ASN QB 1 74 ALA H . . 5.150 4.727 4.406 5.144 . 0 0 "[ . 1 . 2]" 1
1447 1 72 ASN HB2 1 72 ASN HD22 . . 4.020 3.497 3.433 3.980 . 0 0 "[ . 1 . 2]" 1
1448 1 72 ASN HB2 1 73 LEU H . . 3.690 2.495 2.114 3.739 0.049 6 0 "[ . 1 . 2]" 1
1449 1 72 ASN HB3 1 72 ASN HD22 . . 4.020 3.835 3.438 3.951 . 0 0 "[ . 1 . 2]" 1
1450 1 72 ASN HB3 1 73 LEU H . . 3.690 3.404 3.115 3.619 . 0 0 "[ . 1 . 2]" 1
1451 1 73 LEU H 1 73 LEU HB2 . . 3.070 2.266 2.198 2.377 . 0 0 "[ . 1 . 2]" 1
1452 1 73 LEU H 1 73 LEU HB3 . . 3.720 3.537 3.502 3.581 . 0 0 "[ . 1 . 2]" 1
1453 1 73 LEU H 1 73 LEU MD1 . . 4.040 3.729 3.552 3.863 . 0 0 "[ . 1 . 2]" 1
1454 1 73 LEU H 1 73 LEU MD2 . . 4.310 3.707 3.538 3.889 . 0 0 "[ . 1 . 2]" 1
1455 1 73 LEU H 1 73 LEU HG . . 3.410 2.723 2.489 2.855 . 0 0 "[ . 1 . 2]" 1
1456 1 73 LEU H 1 74 ALA H . . 3.200 2.908 2.711 3.070 . 0 0 "[ . 1 . 2]" 1
1457 1 73 LEU H 1 74 ALA MB . . 4.780 4.502 4.313 4.668 . 0 0 "[ . 1 . 2]" 1
1458 1 73 LEU H 1 75 GLU H . . 4.590 4.040 3.813 4.471 . 0 0 "[ . 1 . 2]" 1
1459 1 73 LEU HA 1 73 LEU MD1 . . 3.990 3.810 3.779 3.834 . 0 0 "[ . 1 . 2]" 1
1460 1 73 LEU HA 1 73 LEU MD2 . . 3.200 2.014 1.957 2.162 . 0 0 "[ . 1 . 2]" 1
1461 1 73 LEU HA 1 73 LEU HG . . 4.140 2.837 2.671 2.944 . 0 0 "[ . 1 . 2]" 1
1462 1 73 LEU HA 1 76 LYS H . . 4.140 3.592 3.298 4.009 . 0 0 "[ . 1 . 2]" 1
1463 1 73 LEU HA 1 76 LYS HB2 . . 4.450 4.000 3.675 4.314 . 0 0 "[ . 1 . 2]" 1
1464 1 73 LEU HA 1 76 LYS HB3 . . 4.280 3.088 2.709 3.395 . 0 0 "[ . 1 . 2]" 1
1465 1 73 LEU HA 1 77 GLU H . . 3.920 3.336 2.821 3.851 . 0 0 "[ . 1 . 2]" 1
1466 1 73 LEU HA 1 77 GLU QG . . 4.490 3.086 2.410 3.884 . 0 0 "[ . 1 . 2]" 1
1467 1 73 LEU HB2 1 73 LEU MD1 . . 3.370 2.340 2.253 2.435 . 0 0 "[ . 1 . 2]" 1
1468 1 73 LEU HB2 1 73 LEU MD2 . . 3.640 3.184 3.178 3.192 . 0 0 "[ . 1 . 2]" 1
1469 1 73 LEU HB2 1 74 ALA H . . 3.310 2.622 2.446 2.748 . 0 0 "[ . 1 . 2]" 1
1470 1 73 LEU HB3 1 73 LEU MD1 . . 3.570 2.364 2.254 2.475 . 0 0 "[ . 1 . 2]" 1
1471 1 73 LEU HB3 1 73 LEU MD2 . . 3.510 2.335 2.257 2.368 . 0 0 "[ . 1 . 2]" 1
1472 1 73 LEU HB3 1 74 ALA H . . 3.790 3.145 2.810 3.414 . 0 0 "[ . 1 . 2]" 1
1473 1 73 LEU MD1 1 74 ALA H . . 4.810 4.489 4.235 4.640 . 0 0 "[ . 1 . 2]" 1
1474 1 73 LEU MD2 1 77 GLU H . . 4.610 3.939 3.466 4.617 0.007 6 0 "[ . 1 . 2]" 1
1475 1 73 LEU MD2 1 77 GLU HG2 . . 4.230 2.715 2.140 3.826 . 0 0 "[ . 1 . 2]" 1
1476 1 73 LEU MD2 1 77 GLU QG . . 3.470 2.400 1.833 3.258 . 0 0 "[ . 1 . 2]" 1
1477 1 73 LEU MD2 1 77 GLU HG3 . . 4.230 2.709 1.989 3.528 . 0 0 "[ . 1 . 2]" 1
1478 1 73 LEU HG 1 74 ALA H . . 4.730 4.691 4.589 4.735 0.005 4 0 "[ . 1 . 2]" 1
1479 1 74 ALA H 1 74 ALA MB . . 2.820 2.093 2.038 2.171 . 0 0 "[ . 1 . 2]" 1
1480 1 74 ALA H 1 75 GLU H . . 3.310 2.556 2.422 2.726 . 0 0 "[ . 1 . 2]" 1
1481 1 74 ALA H 1 75 GLU QB . . 5.180 4.325 4.231 4.512 . 0 0 "[ . 1 . 2]" 1
1482 1 74 ALA H 1 78 LEU MD1 . . 4.510 4.249 3.921 4.505 . 0 0 "[ . 1 . 2]" 1
1483 1 74 ALA H 1 80 LEU MD1 . . 5.500 5.349 5.110 5.468 . 0 0 "[ . 1 . 2]" 1
1484 1 74 ALA HA 1 76 LYS H . . 5.010 3.862 3.591 4.162 . 0 0 "[ . 1 . 2]" 1
1485 1 74 ALA HA 1 77 GLU H . . 4.380 3.976 3.383 4.346 . 0 0 "[ . 1 . 2]" 1
1486 1 74 ALA HA 1 78 LEU H . . 3.580 2.632 2.333 2.910 . 0 0 "[ . 1 . 2]" 1
1487 1 74 ALA HA 1 78 LEU HB2 . . 4.060 2.974 2.646 3.264 . 0 0 "[ . 1 . 2]" 1
1488 1 74 ALA HA 1 78 LEU MD1 . . 3.500 2.334 2.017 2.831 . 0 0 "[ . 1 . 2]" 1
1489 1 74 ALA HA 1 78 LEU MD2 . . 4.340 3.860 3.721 4.064 . 0 0 "[ . 1 . 2]" 1
1490 1 74 ALA HA 1 78 LEU HG . . 3.700 2.207 2.068 2.434 . 0 0 "[ . 1 . 2]" 1
1491 1 74 ALA HA 1 80 LEU MD1 . . 4.440 3.902 3.497 4.323 . 0 0 "[ . 1 . 2]" 1
1492 1 74 ALA MB 1 75 GLU H . . 3.390 2.830 2.519 3.183 . 0 0 "[ . 1 . 2]" 1
1493 1 74 ALA MB 1 78 LEU H . . 4.520 4.112 3.649 4.400 . 0 0 "[ . 1 . 2]" 1
1494 1 74 ALA MB 1 78 LEU MD1 . . 3.510 1.866 1.706 2.078 . 0 0 "[ . 1 . 2]" 1
1495 1 74 ALA MB 1 78 LEU MD2 . . 4.830 4.077 3.693 4.327 . 0 0 "[ . 1 . 2]" 1
1496 1 74 ALA MB 1 78 LEU HG . . 3.590 3.317 2.738 3.591 0.001 7 0 "[ . 1 . 2]" 1
1497 1 74 ALA MB 1 80 LEU H . . 4.130 3.851 3.665 4.057 . 0 0 "[ . 1 . 2]" 1
1498 1 74 ALA MB 1 80 LEU HB2 . . 4.090 2.891 2.747 3.064 . 0 0 "[ . 1 . 2]" 1
1499 1 74 ALA MB 1 80 LEU HB3 . . 4.410 4.258 4.032 4.413 0.003 6 0 "[ . 1 . 2]" 1
1500 1 74 ALA MB 1 80 LEU MD1 . . 3.410 2.296 2.040 2.573 . 0 0 "[ . 1 . 2]" 1
1501 1 74 ALA MB 1 80 LEU MD2 . . 4.760 4.587 4.396 4.721 . 0 0 "[ . 1 . 2]" 1
1502 1 74 ALA MB 1 80 LEU HG . . 5.150 4.027 3.773 4.363 . 0 0 "[ . 1 . 2]" 1
1503 1 74 ALA MB 1 102 TYR QE . . 4.940 4.137 3.599 4.811 . 0 0 "[ . 1 . 2]" 1
1504 1 74 ALA MB 1 106 TYR QE . . 3.660 2.831 2.545 3.208 . 0 0 "[ . 1 . 2]" 1
1505 1 74 ALA MB 1 106 TYR HH . . 3.480 2.328 1.814 3.355 . 0 0 "[ . 1 . 2]" 1
1506 1 75 GLU H 1 75 GLU HB2 . . 3.240 2.632 2.405 2.793 . 0 0 "[ . 1 . 2]" 1
1507 1 75 GLU H 1 75 GLU HB3 . . 3.240 2.499 2.346 2.702 . 0 0 "[ . 1 . 2]" 1
1508 1 75 GLU H 1 75 GLU HG2 . . 4.880 4.460 4.357 4.516 . 0 0 "[ . 1 . 2]" 1
1509 1 75 GLU H 1 75 GLU QG . . 4.230 4.034 3.957 4.104 . 0 0 "[ . 1 . 2]" 1
1510 1 75 GLU H 1 75 GLU HG3 . . 4.880 4.604 4.420 4.712 . 0 0 "[ . 1 . 2]" 1
1511 1 75 GLU H 1 76 LYS H . . 3.210 2.447 2.151 2.769 . 0 0 "[ . 1 . 2]" 1
1512 1 75 GLU H 1 77 GLU H . . 4.880 4.483 4.084 4.728 . 0 0 "[ . 1 . 2]" 1
1513 1 75 GLU H 1 80 LEU H . . 4.470 4.366 4.267 4.471 0.001 4 0 "[ . 1 . 2]" 1
1514 1 75 GLU HA 1 75 GLU HG2 . . 3.810 2.536 2.321 2.720 . 0 0 "[ . 1 . 2]" 1
1515 1 75 GLU HA 1 75 GLU HG3 . . 3.810 3.392 2.792 3.721 . 0 0 "[ . 1 . 2]" 1
1516 1 75 GLU HA 1 78 LEU H . . 5.500 5.295 5.087 5.441 . 0 0 "[ . 1 . 2]" 1
1517 1 75 GLU HA 1 79 GLY H . . 3.630 3.374 3.145 3.520 . 0 0 "[ . 1 . 2]" 1
1518 1 75 GLU HA 1 80 LEU H . . 3.180 2.171 2.029 2.328 . 0 0 "[ . 1 . 2]" 1
1519 1 75 GLU HA 1 81 THR H . . 5.440 5.080 4.745 5.354 . 0 0 "[ . 1 . 2]" 1
1520 1 75 GLU HA 1 82 LYS H . . 4.890 4.674 4.398 4.885 . 0 0 "[ . 1 . 2]" 1
1521 1 75 GLU QB 1 76 LYS H . . 3.220 3.087 2.905 3.221 0.001 1 0 "[ . 1 . 2]" 1
1522 1 75 GLU QB 1 76 LYS HB2 . . 4.240 4.007 3.833 4.171 . 0 0 "[ . 1 . 2]" 1
1523 1 75 GLU QB 1 82 LYS H . . 5.260 3.575 2.903 4.220 . 0 0 "[ . 1 . 2]" 1
1524 1 75 GLU QG 1 76 LYS H . . 4.720 4.372 4.093 4.658 . 0 0 "[ . 1 . 2]" 1
1525 1 75 GLU QG 1 80 LEU H . . 4.420 4.028 3.854 4.242 . 0 0 "[ . 1 . 2]" 1
1526 1 75 GLU QG 1 81 THR H . . 5.290 4.906 4.540 5.126 . 0 0 "[ . 1 . 2]" 1
1527 1 75 GLU QG 1 81 THR HA . . 3.900 3.119 2.619 3.495 . 0 0 "[ . 1 . 2]" 1
1528 1 75 GLU QG 1 82 LYS H . . 3.830 2.711 2.363 3.217 . 0 0 "[ . 1 . 2]" 1
1529 1 75 GLU HG2 1 76 LYS H . . 5.500 4.646 4.270 5.042 . 0 0 "[ . 1 . 2]" 1
1530 1 75 GLU HG2 1 81 THR HA . . 4.450 3.607 3.011 4.430 . 0 0 "[ . 1 . 2]" 1
1531 1 75 GLU HG3 1 76 LYS H . . 5.500 5.342 5.182 5.477 . 0 0 "[ . 1 . 2]" 1
1532 1 75 GLU HG3 1 81 THR HA . . 4.450 3.656 2.650 4.252 . 0 0 "[ . 1 . 2]" 1
1533 1 76 LYS H 1 76 LYS HB2 . . 2.940 2.761 2.576 2.940 . 0 0 "[ . 1 . 2]" 1
1534 1 76 LYS H 1 76 LYS HB3 . . 3.140 2.654 2.436 2.878 . 0 0 "[ . 1 . 2]" 1
1535 1 76 LYS H 1 76 LYS QD . . 4.800 4.573 4.302 4.809 0.009 7 0 "[ . 1 . 2]" 1
1536 1 76 LYS H 1 76 LYS QE . . 5.500 4.812 4.493 5.467 . 0 0 "[ . 1 . 2]" 1
1537 1 76 LYS H 1 76 LYS HG2 . . 4.950 4.577 4.426 4.817 . 0 0 "[ . 1 . 2]" 1
1538 1 76 LYS H 1 76 LYS QG . . 4.320 4.070 3.977 4.166 . 0 0 "[ . 1 . 2]" 1
1539 1 76 LYS H 1 76 LYS HG3 . . 4.950 4.578 4.320 4.790 . 0 0 "[ . 1 . 2]" 1
1540 1 76 LYS H 1 78 LEU H . . 4.610 4.040 3.689 4.212 . 0 0 "[ . 1 . 2]" 1
1541 1 76 LYS H 1 79 GLY H . . 4.130 3.715 3.458 3.953 . 0 0 "[ . 1 . 2]" 1
1542 1 76 LYS H 1 80 LEU H . . 4.960 4.546 4.385 4.775 . 0 0 "[ . 1 . 2]" 1
1543 1 76 LYS HA 1 76 LYS QD . . 4.200 3.333 1.993 4.196 . 0 0 "[ . 1 . 2]" 1
1544 1 76 LYS HA 1 76 LYS HG2 . . 3.880 3.079 2.165 3.851 . 0 0 "[ . 1 . 2]" 1
1545 1 76 LYS HA 1 76 LYS QG . . 3.380 2.462 2.143 2.913 . 0 0 "[ . 1 . 2]" 1
1546 1 76 LYS HA 1 76 LYS HG3 . . 3.880 2.824 2.275 3.520 . 0 0 "[ . 1 . 2]" 1
1547 1 76 LYS HA 1 78 LEU H . . 5.500 5.413 5.144 5.502 0.002 6 0 "[ . 1 . 2]" 1
1548 1 76 LYS HB2 1 76 LYS QD . . 3.840 2.707 2.157 3.431 . 0 0 "[ . 1 . 2]" 1
1549 1 76 LYS HB2 1 77 GLU H . . 3.710 3.519 3.262 3.678 . 0 0 "[ . 1 . 2]" 1
1550 1 76 LYS HB3 1 76 LYS QE . . 3.730 2.952 2.178 3.770 0.040 18 0 "[ . 1 . 2]" 1
1551 1 76 LYS HB3 1 77 GLU H . . 3.060 2.106 1.945 2.290 . 0 0 "[ . 1 . 2]" 1
1552 1 76 LYS HB3 1 77 GLU QG . . 3.900 2.988 2.766 3.308 . 0 0 "[ . 1 . 2]" 1
1553 1 76 LYS QD 1 77 GLU H . . 5.500 4.157 2.871 5.022 . 0 0 "[ . 1 . 2]" 1
1554 1 76 LYS QG 1 77 GLU QG . . 4.840 4.000 3.341 4.741 . 0 0 "[ . 1 . 2]" 1
1555 1 76 LYS HG2 1 77 GLU H . . 5.480 3.886 3.033 4.474 . 0 0 "[ . 1 . 2]" 1
1556 1 76 LYS HG3 1 77 GLU H . . 5.480 4.220 3.108 4.775 . 0 0 "[ . 1 . 2]" 1
1557 1 77 GLU H 1 77 GLU HB2 . . 4.050 2.512 2.287 2.638 . 0 0 "[ . 1 . 2]" 1
1558 1 77 GLU H 1 77 GLU QB . . 3.340 2.464 2.261 2.574 . 0 0 "[ . 1 . 2]" 1
1559 1 77 GLU H 1 77 GLU HB3 . . 4.050 3.584 3.548 3.596 . 0 0 "[ . 1 . 2]" 1
1560 1 77 GLU H 1 77 GLU HG2 . . 4.030 2.175 1.930 2.653 . 0 0 "[ . 1 . 2]" 1
1561 1 77 GLU H 1 77 GLU QG . . 3.200 2.154 1.920 2.594 . 0 0 "[ . 1 . 2]" 1
1562 1 77 GLU H 1 77 GLU HG3 . . 4.030 3.548 3.356 3.732 . 0 0 "[ . 1 . 2]" 1
1563 1 77 GLU H 1 78 LEU H . . 3.110 3.012 2.925 3.097 . 0 0 "[ . 1 . 2]" 1
1564 1 77 GLU H 1 78 LEU MD1 . . 5.500 5.485 5.406 5.504 0.004 14 0 "[ . 1 . 2]" 1
1565 1 77 GLU H 1 78 LEU MD2 . . 5.500 5.406 5.215 5.500 0.000 9 0 "[ . 1 . 2]" 1
1566 1 77 GLU H 1 78 LEU HG . . 4.620 4.560 4.465 4.619 . 0 0 "[ . 1 . 2]" 1
1567 1 77 GLU H 1 79 GLY H . . 4.150 4.039 3.899 4.154 0.004 6 0 "[ . 1 . 2]" 1
1568 1 77 GLU QB 1 78 LEU H . . 3.730 2.016 1.926 2.156 . 0 0 "[ . 1 . 2]" 1
1569 1 77 GLU QB 1 78 LEU MD2 . . 4.350 3.148 2.988 3.252 . 0 0 "[ . 1 . 2]" 1
1570 1 77 GLU HB2 1 78 LEU H . . 4.600 2.050 1.942 2.244 . 0 0 "[ . 1 . 2]" 1
1571 1 77 GLU HB2 1 78 LEU HG . . 4.560 2.866 2.729 3.144 . 0 0 "[ . 1 . 2]" 1
1572 1 77 GLU HB3 1 78 LEU H . . 4.600 3.048 2.746 3.326 . 0 0 "[ . 1 . 2]" 1
1573 1 77 GLU HB3 1 78 LEU HG . . 4.560 3.853 3.437 4.088 . 0 0 "[ . 1 . 2]" 1
1574 1 77 GLU QG 1 78 LEU H . . 4.430 3.790 3.623 4.004 . 0 0 "[ . 1 . 2]" 1
1575 1 78 LEU H 1 78 LEU HB2 . . 3.370 2.681 2.642 2.701 . 0 0 "[ . 1 . 2]" 1
1576 1 78 LEU H 1 78 LEU HB3 . . 3.850 3.578 3.571 3.595 . 0 0 "[ . 1 . 2]" 1
1577 1 78 LEU H 1 78 LEU MD1 . . 4.110 3.456 3.396 3.510 . 0 0 "[ . 1 . 2]" 1
1578 1 78 LEU H 1 78 LEU MD2 . . 3.690 3.070 2.970 3.176 . 0 0 "[ . 1 . 2]" 1
1579 1 78 LEU H 1 78 LEU HG . . 3.320 1.927 1.886 2.019 . 0 0 "[ . 1 . 2]" 1
1580 1 78 LEU H 1 79 GLY H . . 3.010 2.711 2.530 2.852 . 0 0 "[ . 1 . 2]" 1
1581 1 78 LEU H 1 80 LEU H . . 4.770 4.585 4.435 4.749 . 0 0 "[ . 1 . 2]" 1
1582 1 78 LEU H 1 80 LEU MD1 . . 5.010 4.887 4.696 4.994 . 0 0 "[ . 1 . 2]" 1
1583 1 78 LEU HA 1 78 LEU MD1 . . 4.540 3.947 3.929 3.974 . 0 0 "[ . 1 . 2]" 1
1584 1 78 LEU HA 1 78 LEU MD2 . . 3.470 2.335 2.114 2.473 . 0 0 "[ . 1 . 2]" 1
1585 1 78 LEU HB2 1 78 LEU MD1 . . 3.630 2.235 2.132 2.325 . 0 0 "[ . 1 . 2]" 1
1586 1 78 LEU HB2 1 78 LEU MD2 . . 3.340 3.176 3.167 3.184 . 0 0 "[ . 1 . 2]" 1
1587 1 78 LEU HB2 1 79 GLY H . . 3.980 2.470 2.299 2.618 . 0 0 "[ . 1 . 2]" 1
1588 1 78 LEU HB2 1 80 LEU H . . 4.060 3.043 2.782 3.231 . 0 0 "[ . 1 . 2]" 1
1589 1 78 LEU HB2 1 80 LEU MD1 . . 3.900 2.726 2.389 2.937 . 0 0 "[ . 1 . 2]" 1
1590 1 78 LEU HB2 1 80 LEU HG . . 4.510 2.740 2.472 2.949 . 0 0 "[ . 1 . 2]" 1
1591 1 78 LEU HB3 1 79 GLY H . . 4.420 3.725 3.570 3.852 . 0 0 "[ . 1 . 2]" 1
1592 1 78 LEU HB3 1 80 LEU MD1 . . 4.700 3.062 2.551 3.353 . 0 0 "[ . 1 . 2]" 1
1593 1 78 LEU HB3 1 109 TYR QE . . 3.910 3.378 2.911 3.793 . 0 0 "[ . 1 . 2]" 1
1594 1 78 LEU MD1 1 79 GLY H . . 4.960 4.198 4.103 4.306 . 0 0 "[ . 1 . 2]" 1
1595 1 78 LEU MD1 1 80 LEU H . . 4.440 4.315 4.151 4.443 0.003 20 0 "[ . 1 . 2]" 1
1596 1 78 LEU MD1 1 80 LEU MD1 . . 3.740 1.995 1.904 2.132 . 0 0 "[ . 1 . 2]" 1
1597 1 78 LEU MD1 1 109 TYR QD . . 4.700 3.727 3.156 4.067 . 0 0 "[ . 1 . 2]" 1
1598 1 78 LEU MD1 1 109 TYR QE . . 4.280 3.770 3.026 4.249 . 0 0 "[ . 1 . 2]" 1
1599 1 78 LEU MD1 1 110 PHE QE . . 3.810 3.093 2.760 3.522 . 0 0 "[ . 1 . 2]" 1
1600 1 78 LEU MD2 1 79 GLY H . . 4.760 4.626 4.578 4.680 . 0 0 "[ . 1 . 2]" 1
1601 1 78 LEU MD2 1 109 TYR QD . . 4.970 3.605 3.271 3.993 . 0 0 "[ . 1 . 2]" 1
1602 1 78 LEU MD2 1 109 TYR QE . . 3.470 2.294 1.981 2.693 . 0 0 "[ . 1 . 2]" 1
1603 1 78 LEU HG 1 79 GLY H . . 4.180 3.981 3.912 4.055 . 0 0 "[ . 1 . 2]" 1
1604 1 79 GLY H 1 80 LEU H . . 3.240 2.276 2.078 2.429 . 0 0 "[ . 1 . 2]" 1
1605 1 79 GLY H 1 80 LEU HB2 . . 4.980 4.367 4.188 4.489 . 0 0 "[ . 1 . 2]" 1
1606 1 80 LEU H 1 80 LEU HB2 . . 3.740 2.434 2.374 2.511 . 0 0 "[ . 1 . 2]" 1
1607 1 80 LEU H 1 80 LEU HB3 . . 3.820 3.641 3.607 3.690 . 0 0 "[ . 1 . 2]" 1
1608 1 80 LEU H 1 80 LEU MD1 . . 4.010 3.565 3.437 3.697 . 0 0 "[ . 1 . 2]" 1
1609 1 80 LEU H 1 80 LEU MD2 . . 4.110 3.966 3.791 4.100 . 0 0 "[ . 1 . 2]" 1
1610 1 80 LEU H 1 80 LEU HG . . 3.470 2.790 2.582 2.984 . 0 0 "[ . 1 . 2]" 1
1611 1 80 LEU HA 1 80 LEU MD2 . . 3.040 2.318 2.145 2.460 . 0 0 "[ . 1 . 2]" 1
1612 1 80 LEU HA 1 81 THR H . . 2.660 2.314 2.163 2.609 . 0 0 "[ . 1 . 2]" 1
1613 1 80 LEU HA 1 81 THR HB . . 4.820 4.736 4.625 4.800 . 0 0 "[ . 1 . 2]" 1
1614 1 80 LEU HB2 1 80 LEU MD1 . . 3.530 2.185 1.981 2.288 . 0 0 "[ . 1 . 2]" 1
1615 1 80 LEU HB3 1 80 LEU MD1 . . 3.500 2.531 2.448 2.676 . 0 0 "[ . 1 . 2]" 1
1616 1 80 LEU HB3 1 81 THR H . . 4.150 2.683 1.997 3.184 . 0 0 "[ . 1 . 2]" 1
1617 1 80 LEU MD1 1 81 THR H . . 5.140 4.759 4.255 5.109 . 0 0 "[ . 1 . 2]" 1
1618 1 80 LEU MD1 1 102 TYR QE . . 5.170 4.151 3.407 5.064 . 0 0 "[ . 1 . 2]" 1
1619 1 80 LEU MD1 1 106 TYR H . . 4.800 3.975 3.731 4.414 . 0 0 "[ . 1 . 2]" 1
1620 1 80 LEU MD1 1 106 TYR HA . . 3.660 3.072 2.830 3.347 . 0 0 "[ . 1 . 2]" 1
1621 1 80 LEU MD1 1 106 TYR QD . . 3.830 2.554 2.223 3.236 . 0 0 "[ . 1 . 2]" 1
1622 1 80 LEU MD1 1 106 TYR QE . . 3.880 2.323 1.886 3.180 . 0 0 "[ . 1 . 2]" 1
1623 1 80 LEU MD1 1 109 TYR H . . 5.120 5.018 4.851 5.131 0.011 17 0 "[ . 1 . 2]" 1
1624 1 80 LEU MD1 1 109 TYR HB2 . . 4.220 3.660 3.365 3.999 . 0 0 "[ . 1 . 2]" 1
1625 1 80 LEU MD1 1 109 TYR HB3 . . 4.260 3.576 3.376 3.774 . 0 0 "[ . 1 . 2]" 1
1626 1 80 LEU MD1 1 109 TYR QD . . 4.230 3.889 3.239 4.224 . 0 0 "[ . 1 . 2]" 1
1627 1 80 LEU MD1 1 109 TYR QE . . 5.260 4.675 4.071 5.169 . 0 0 "[ . 1 . 2]" 1
1628 1 80 LEU MD1 1 110 PHE H . . 5.250 5.183 5.053 5.259 0.009 12 0 "[ . 1 . 2]" 1
1629 1 80 LEU MD2 1 81 THR H . . 3.540 3.246 3.030 3.541 0.001 17 0 "[ . 1 . 2]" 1
1630 1 80 LEU MD2 1 105 THR HA . . 4.850 3.948 3.561 4.413 . 0 0 "[ . 1 . 2]" 1
1631 1 80 LEU MD2 1 105 THR HB . . 3.450 2.090 1.885 2.537 . 0 0 "[ . 1 . 2]" 1
1632 1 80 LEU MD2 1 105 THR MG . . 4.020 3.181 2.688 3.553 . 0 0 "[ . 1 . 2]" 1
1633 1 80 LEU MD2 1 106 TYR H . . 5.040 4.595 4.258 4.980 . 0 0 "[ . 1 . 2]" 1
1634 1 80 LEU MD2 1 106 TYR QD . . 4.500 3.883 3.506 4.365 . 0 0 "[ . 1 . 2]" 1
1635 1 80 LEU MD2 1 106 TYR QE . . 5.500 4.399 4.026 4.852 . 0 0 "[ . 1 . 2]" 1
1636 1 80 LEU MD2 1 109 TYR H . . 4.470 4.313 4.091 4.478 0.008 14 0 "[ . 1 . 2]" 1
1637 1 80 LEU MD2 1 109 TYR HB2 . . 3.530 2.634 2.415 2.928 . 0 0 "[ . 1 . 2]" 1
1638 1 80 LEU MD2 1 109 TYR HB3 . . 3.880 3.517 3.318 3.686 . 0 0 "[ . 1 . 2]" 1
1639 1 80 LEU MD2 1 109 TYR QD . . 3.720 3.164 2.415 3.695 . 0 0 "[ . 1 . 2]" 1
1640 1 80 LEU MD2 1 109 TYR QE . . 4.820 4.401 3.663 4.770 . 0 0 "[ . 1 . 2]" 1
1641 1 80 LEU MD2 1 110 PHE H . . 5.500 5.367 5.166 5.500 . 0 0 "[ . 1 . 2]" 1
1642 1 80 LEU HG 1 81 THR H . . 4.950 4.781 4.575 4.952 0.002 17 0 "[ . 1 . 2]" 1
1643 1 81 THR H 1 81 THR HB . . 2.980 2.535 2.440 2.646 . 0 0 "[ . 1 . 2]" 1
1644 1 81 THR H 1 81 THR MG . . 3.900 3.790 3.761 3.863 . 0 0 "[ . 1 . 2]" 1
1645 1 81 THR H 1 82 LYS H . . 4.460 4.358 4.178 4.473 0.013 11 0 "[ . 1 . 2]" 1
1646 1 81 THR H 1 83 LEU MD2 . . 4.880 4.334 4.023 4.637 . 0 0 "[ . 1 . 2]" 1
1647 1 81 THR HA 1 81 THR MG . . 3.420 2.342 2.252 2.458 . 0 0 "[ . 1 . 2]" 1
1648 1 81 THR HA 1 82 LYS H . . 2.700 2.149 2.140 2.181 . 0 0 "[ . 1 . 2]" 1
1649 1 81 THR HA 1 82 LYS QB . . 4.630 4.214 4.123 4.496 . 0 0 "[ . 1 . 2]" 1
1650 1 81 THR HA 1 82 LYS QG . . 4.750 4.324 3.589 4.646 . 0 0 "[ . 1 . 2]" 1
1651 1 81 THR HB 1 82 LYS H . . 4.540 4.336 4.245 4.443 . 0 0 "[ . 1 . 2]" 1
1652 1 81 THR HB 1 83 LEU MD1 . . 5.110 4.673 4.435 4.996 . 0 0 "[ . 1 . 2]" 1
1653 1 81 THR HB 1 83 LEU MD2 . . 3.670 2.706 2.440 3.037 . 0 0 "[ . 1 . 2]" 1
1654 1 81 THR HB 1 83 LEU HG . . 4.460 4.167 3.947 4.434 . 0 0 "[ . 1 . 2]" 1
1655 1 81 THR MG 1 82 LYS H . . 3.180 2.833 2.610 3.050 . 0 0 "[ . 1 . 2]" 1
1656 1 81 THR MG 1 82 LYS QB . . 5.030 3.919 3.626 4.504 . 0 0 "[ . 1 . 2]" 1
1657 1 81 THR MG 1 83 LEU H . . 4.760 4.359 3.658 4.602 . 0 0 "[ . 1 . 2]" 1
1658 1 81 THR MG 1 83 LEU HA . . 4.330 3.764 3.167 3.950 . 0 0 "[ . 1 . 2]" 1
1659 1 81 THR MG 1 83 LEU HB3 . . 5.500 5.118 4.822 5.360 . 0 0 "[ . 1 . 2]" 1
1660 1 81 THR MG 1 83 LEU MD2 . . 3.080 2.436 2.247 2.631 . 0 0 "[ . 1 . 2]" 1
1661 1 81 THR MG 1 83 LEU HG . . 4.210 4.108 3.962 4.212 0.002 20 0 "[ . 1 . 2]" 1
1662 1 82 LYS H 1 82 LYS HB2 . . 3.940 2.505 2.195 3.590 . 0 0 "[ . 1 . 2]" 1
1663 1 82 LYS H 1 82 LYS QB . . 3.420 2.265 2.173 2.578 . 0 0 "[ . 1 . 2]" 1
1664 1 82 LYS H 1 82 LYS HB3 . . 3.940 3.323 2.311 3.561 . 0 0 "[ . 1 . 2]" 1
1665 1 82 LYS H 1 82 LYS QE . . 4.810 3.976 3.298 4.828 0.018 10 0 "[ . 1 . 2]" 1
1666 1 82 LYS H 1 82 LYS QG . . 3.320 2.601 1.890 2.866 . 0 0 "[ . 1 . 2]" 1
1667 1 82 LYS H 1 83 LEU H . . 4.550 4.334 4.034 4.488 . 0 0 "[ . 1 . 2]" 1
1668 1 82 LYS H 1 83 LEU MD2 . . 4.930 4.769 4.468 4.932 0.002 20 0 "[ . 1 . 2]" 1
1669 1 82 LYS HA 1 82 LYS QG . . 3.730 2.460 2.149 3.343 . 0 0 "[ . 1 . 2]" 1
1670 1 82 LYS HA 1 83 LEU H . . 3.090 2.178 2.142 2.323 . 0 0 "[ . 1 . 2]" 1
1671 1 82 LYS HA 1 84 LEU H . . 4.620 3.631 3.407 3.841 . 0 0 "[ . 1 . 2]" 1
1672 1 82 LYS HA 1 102 TYR QE . . 4.620 2.305 1.998 2.895 . 0 0 "[ . 1 . 2]" 1
1673 1 82 LYS QB 1 82 LYS QD . . 3.180 2.158 2.038 2.264 . 0 0 "[ . 1 . 2]" 1
1674 1 82 LYS QB 1 82 LYS QE . . 3.820 2.636 2.003 3.666 . 0 0 "[ . 1 . 2]" 1
1675 1 82 LYS QB 1 83 LEU H . . 4.040 3.615 3.384 3.840 . 0 0 "[ . 1 . 2]" 1
1676 1 82 LYS QB 1 84 LEU H . . 4.250 3.881 3.548 4.199 . 0 0 "[ . 1 . 2]" 1
1677 1 82 LYS QB 1 102 TYR QE . . 5.340 3.928 2.702 4.806 . 0 0 "[ . 1 . 2]" 1
1678 1 82 LYS HB2 1 82 LYS QE . . 4.350 2.947 2.034 4.209 . 0 0 "[ . 1 . 2]" 1
1679 1 82 LYS HB3 1 82 LYS QE . . 4.350 3.243 2.205 4.034 . 0 0 "[ . 1 . 2]" 1
1680 1 82 LYS QG 1 84 LEU H . . 4.730 4.519 4.190 4.730 0.000 20 0 "[ . 1 . 2]" 1
1681 1 83 LEU H 1 83 LEU HB2 . . 3.660 2.664 2.545 2.778 . 0 0 "[ . 1 . 2]" 1
1682 1 83 LEU H 1 83 LEU MD1 . . 4.110 3.564 3.354 3.804 . 0 0 "[ . 1 . 2]" 1
1683 1 83 LEU H 1 83 LEU MD2 . . 3.980 3.271 2.891 3.478 . 0 0 "[ . 1 . 2]" 1
1684 1 83 LEU H 1 83 LEU HG . . 3.410 2.143 1.900 2.372 . 0 0 "[ . 1 . 2]" 1
1685 1 83 LEU H 1 84 LEU H . . 3.070 2.346 2.169 2.768 . 0 0 "[ . 1 . 2]" 1
1686 1 83 LEU H 1 84 LEU MD2 . . 5.500 5.289 4.905 5.465 . 0 0 "[ . 1 . 2]" 1
1687 1 83 LEU H 1 84 LEU HG . . 5.070 4.327 3.985 4.602 . 0 0 "[ . 1 . 2]" 1
1688 1 83 LEU H 1 102 TYR HB2 . . 5.010 4.588 4.324 4.991 . 0 0 "[ . 1 . 2]" 1
1689 1 83 LEU H 1 102 TYR QD . . 3.700 2.502 2.185 2.916 . 0 0 "[ . 1 . 2]" 1
1690 1 83 LEU HA 1 83 LEU MD1 . . 4.140 3.951 3.853 4.023 . 0 0 "[ . 1 . 2]" 1
1691 1 83 LEU HA 1 83 LEU MD2 . . 2.970 2.338 2.084 2.689 . 0 0 "[ . 1 . 2]" 1
1692 1 83 LEU HA 1 83 LEU HG . . 3.580 3.239 3.181 3.316 . 0 0 "[ . 1 . 2]" 1
1693 1 83 LEU HB2 1 83 LEU MD1 . . 3.460 2.196 2.050 2.318 . 0 0 "[ . 1 . 2]" 1
1694 1 83 LEU HB2 1 84 LEU H . . 3.930 2.737 2.510 3.021 . 0 0 "[ . 1 . 2]" 1
1695 1 83 LEU HB2 1 84 LEU MD1 . . 4.690 4.050 3.833 4.397 . 0 0 "[ . 1 . 2]" 1
1696 1 83 LEU HB2 1 102 TYR HB2 . . 4.710 2.884 2.381 3.262 . 0 0 "[ . 1 . 2]" 1
1697 1 83 LEU HB2 1 102 TYR HB3 . . 4.970 4.580 4.012 4.881 . 0 0 "[ . 1 . 2]" 1
1698 1 83 LEU HB2 1 102 TYR QD . . 3.970 2.216 1.990 2.699 . 0 0 "[ . 1 . 2]" 1
1699 1 83 LEU HB3 1 83 LEU MD1 . . 3.440 2.446 2.301 2.588 . 0 0 "[ . 1 . 2]" 1
1700 1 83 LEU HB3 1 83 LEU MD2 . . 3.380 2.221 2.052 2.361 . 0 0 "[ . 1 . 2]" 1
1701 1 83 LEU HB3 1 84 LEU H . . 4.620 3.927 3.703 4.168 . 0 0 "[ . 1 . 2]" 1
1702 1 83 LEU HB3 1 102 TYR QD . . 4.260 3.858 3.469 4.109 . 0 0 "[ . 1 . 2]" 1
1703 1 83 LEU MD1 1 84 LEU H . . 4.700 4.407 4.141 4.610 . 0 0 "[ . 1 . 2]" 1
1704 1 83 LEU MD1 1 101 THR H . . 5.500 5.410 5.125 5.507 0.007 20 0 "[ . 1 . 2]" 1
1705 1 83 LEU MD1 1 101 THR MG . . 3.220 2.818 2.459 3.091 . 0 0 "[ . 1 . 2]" 1
1706 1 83 LEU MD1 1 102 TYR H . . 4.300 3.667 3.299 3.851 . 0 0 "[ . 1 . 2]" 1
1707 1 83 LEU MD1 1 102 TYR HA . . 3.550 2.066 1.943 2.316 . 0 0 "[ . 1 . 2]" 1
1708 1 83 LEU MD1 1 102 TYR HB2 . . 4.190 2.802 2.631 3.097 . 0 0 "[ . 1 . 2]" 1
1709 1 83 LEU MD1 1 102 TYR HB3 . . 4.520 4.078 3.932 4.286 . 0 0 "[ . 1 . 2]" 1
1710 1 83 LEU MD1 1 102 TYR QD . . 3.540 2.758 2.151 3.332 . 0 0 "[ . 1 . 2]" 1
1711 1 83 LEU MD1 1 105 THR H . . 4.740 4.564 4.339 4.748 0.008 14 0 "[ . 1 . 2]" 1
1712 1 83 LEU MD1 1 105 THR MG . . 3.250 2.477 2.111 2.728 . 0 0 "[ . 1 . 2]" 1
1713 1 83 LEU MD2 1 102 TYR HA . . 4.980 4.683 4.489 4.933 . 0 0 "[ . 1 . 2]" 1
1714 1 83 LEU MD2 1 102 TYR QD . . 4.630 4.211 3.648 4.631 0.001 4 0 "[ . 1 . 2]" 1
1715 1 83 LEU MD2 1 105 THR MG . . 4.450 3.989 3.758 4.198 . 0 0 "[ . 1 . 2]" 1
1716 1 83 LEU HG 1 84 LEU H . . 4.200 4.021 3.860 4.174 . 0 0 "[ . 1 . 2]" 1
1717 1 83 LEU HG 1 102 TYR QD . . 4.310 2.825 2.005 3.695 . 0 0 "[ . 1 . 2]" 1
1718 1 83 LEU HG 1 105 THR MG . . 4.210 3.950 3.619 4.217 0.007 17 0 "[ . 1 . 2]" 1
1719 1 84 LEU H 1 84 LEU HB2 . . 3.840 2.574 2.438 2.727 . 0 0 "[ . 1 . 2]" 1
1720 1 84 LEU H 1 84 LEU QB . . 3.230 2.529 2.403 2.667 . 0 0 "[ . 1 . 2]" 1
1721 1 84 LEU H 1 84 LEU HB3 . . 3.840 3.709 3.628 3.779 . 0 0 "[ . 1 . 2]" 1
1722 1 84 LEU H 1 84 LEU MD1 . . 4.010 3.784 3.556 4.014 0.004 8 0 "[ . 1 . 2]" 1
1723 1 84 LEU H 1 84 LEU MD2 . . 3.820 3.735 3.529 3.823 0.003 14 0 "[ . 1 . 2]" 1
1724 1 84 LEU H 1 84 LEU HG . . 4.620 2.686 2.488 2.910 . 0 0 "[ . 1 . 2]" 1
1725 1 84 LEU H 1 85 ASP H . . 4.670 4.447 4.399 4.517 . 0 0 "[ . 1 . 2]" 1
1726 1 84 LEU H 1 102 TYR HB2 . . 5.040 4.146 3.748 4.486 . 0 0 "[ . 1 . 2]" 1
1727 1 84 LEU H 1 102 TYR QD . . 4.410 2.687 1.939 3.782 . 0 0 "[ . 1 . 2]" 1
1728 1 84 LEU HA 1 84 LEU MD1 . . 4.130 3.919 3.834 3.966 . 0 0 "[ . 1 . 2]" 1
1729 1 84 LEU HA 1 84 LEU MD2 . . 3.440 2.224 2.010 2.388 . 0 0 "[ . 1 . 2]" 1
1730 1 84 LEU HA 1 85 ASP H . . 3.250 2.612 2.539 2.651 . 0 0 "[ . 1 . 2]" 1
1731 1 84 LEU HA 1 85 ASP HB2 . . 4.590 4.393 4.227 4.533 . 0 0 "[ . 1 . 2]" 1
1732 1 84 LEU QB 1 85 ASP H . . 4.070 2.019 1.921 2.108 . 0 0 "[ . 1 . 2]" 1
1733 1 84 LEU QB 1 89 VAL MG2 . . 3.450 2.079 1.890 2.395 . 0 0 "[ . 1 . 2]" 1
1734 1 84 LEU HB2 1 84 LEU MD1 . . 3.540 2.196 2.067 2.369 . 0 0 "[ . 1 . 2]" 1
1735 1 84 LEU HB2 1 85 ASP H . . 4.730 3.136 2.932 3.365 . 0 0 "[ . 1 . 2]" 1
1736 1 84 LEU HB2 1 89 VAL MG2 . . 3.970 2.843 2.498 3.135 . 0 0 "[ . 1 . 2]" 1
1737 1 84 LEU HB3 1 84 LEU MD1 . . 3.540 2.456 2.291 2.564 . 0 0 "[ . 1 . 2]" 1
1738 1 84 LEU HB3 1 85 ASP H . . 4.730 2.045 1.936 2.133 . 0 0 "[ . 1 . 2]" 1
1739 1 84 LEU HB3 1 89 VAL MG2 . . 3.970 2.142 1.923 2.486 . 0 0 "[ . 1 . 2]" 1
1740 1 84 LEU MD1 1 89 VAL HA . . 5.500 4.485 4.120 4.718 . 0 0 "[ . 1 . 2]" 1
1741 1 84 LEU MD1 1 89 VAL MG1 . . 4.930 3.401 2.837 3.774 . 0 0 "[ . 1 . 2]" 1
1742 1 84 LEU MD1 1 89 VAL MG2 . . 3.170 2.127 1.890 2.374 . 0 0 "[ . 1 . 2]" 1
1743 1 84 LEU MD1 1 98 SER HA . . 5.500 4.555 4.239 5.363 . 0 0 "[ . 1 . 2]" 1
1744 1 84 LEU MD1 1 99 ILE HA . . 3.530 1.962 1.826 2.126 . 0 0 "[ . 1 . 2]" 1
1745 1 84 LEU MD1 1 99 ILE MD . . 4.030 3.623 3.379 3.782 . 0 0 "[ . 1 . 2]" 1
1746 1 84 LEU MD1 1 99 ILE HG12 . . 4.330 2.309 1.981 2.521 . 0 0 "[ . 1 . 2]" 1
1747 1 84 LEU MD1 1 99 ILE HG13 . . 4.390 2.995 2.489 3.465 . 0 0 "[ . 1 . 2]" 1
1748 1 84 LEU MD1 1 101 THR HB . . 5.500 4.957 4.411 5.463 . 0 0 "[ . 1 . 2]" 1
1749 1 84 LEU MD1 1 102 TYR H . . 4.540 3.579 3.280 4.014 . 0 0 "[ . 1 . 2]" 1
1750 1 84 LEU MD1 1 102 TYR HB2 . . 3.870 2.430 2.045 2.941 . 0 0 "[ . 1 . 2]" 1
1751 1 84 LEU MD1 1 102 TYR HB3 . . 3.810 2.351 1.986 2.649 . 0 0 "[ . 1 . 2]" 1
1752 1 84 LEU MD1 1 102 TYR QD . . 3.780 3.054 2.407 3.525 . 0 0 "[ . 1 . 2]" 1
1753 1 84 LEU MD1 1 103 VAL H . . 4.200 4.079 3.727 4.203 0.003 14 0 "[ . 1 . 2]" 1
1754 1 84 LEU MD2 1 85 ASP H . . 4.010 3.421 3.097 3.633 . 0 0 "[ . 1 . 2]" 1
1755 1 84 LEU MD2 1 88 ASP QB . . 4.270 3.801 3.572 4.046 . 0 0 "[ . 1 . 2]" 1
1756 1 84 LEU MD2 1 89 VAL MG2 . . 3.400 2.912 2.356 3.364 . 0 0 "[ . 1 . 2]" 1
1757 1 84 LEU MD2 1 98 SER HA . . 4.680 3.550 3.273 3.910 . 0 0 "[ . 1 . 2]" 1
1758 1 84 LEU MD2 1 98 SER HB2 . . 3.830 3.296 2.106 3.824 . 0 0 "[ . 1 . 2]" 1
1759 1 84 LEU MD2 1 98 SER HB3 . . 3.830 2.394 1.936 3.818 . 0 0 "[ . 1 . 2]" 1
1760 1 84 LEU MD2 1 99 ILE HA . . 4.020 3.448 2.566 3.699 . 0 0 "[ . 1 . 2]" 1
1761 1 84 LEU MD2 1 99 ILE HG13 . . 4.370 3.802 2.835 4.225 . 0 0 "[ . 1 . 2]" 1
1762 1 84 LEU MD2 1 102 TYR H . . 5.020 4.686 4.410 4.843 . 0 0 "[ . 1 . 2]" 1
1763 1 84 LEU MD2 1 102 TYR HB2 . . 4.040 3.760 3.448 4.041 0.001 5 0 "[ . 1 . 2]" 1
1764 1 84 LEU MD2 1 102 TYR QD . . 4.540 4.318 3.763 4.546 0.006 17 0 "[ . 1 . 2]" 1
1765 1 84 LEU HG 1 99 ILE HA . . 5.270 4.095 3.510 4.421 . 0 0 "[ . 1 . 2]" 1
1766 1 84 LEU HG 1 102 TYR HB2 . . 4.510 2.613 2.198 2.817 . 0 0 "[ . 1 . 2]" 1
1767 1 85 ASP H 1 85 ASP HB2 . . 3.540 2.609 2.489 2.732 . 0 0 "[ . 1 . 2]" 1
1768 1 85 ASP H 1 85 ASP HB3 . . 4.120 3.733 3.611 3.833 . 0 0 "[ . 1 . 2]" 1
1769 1 85 ASP H 1 88 ASP QB . . 4.390 2.687 2.425 2.994 . 0 0 "[ . 1 . 2]" 1
1770 1 85 ASP HA 1 86 PRO QD . . 3.290 2.083 2.027 2.126 . 0 0 "[ . 1 . 2]" 1
1771 1 85 ASP HA 1 86 PRO HG3 . . 4.880 4.465 4.407 4.509 . 0 0 "[ . 1 . 2]" 1
1772 1 85 ASP HA 1 87 GLU H . . 4.690 3.843 3.777 3.894 . 0 0 "[ . 1 . 2]" 1
1773 1 85 ASP HA 1 89 VAL H . . 5.500 5.213 5.081 5.446 . 0 0 "[ . 1 . 2]" 1
1774 1 85 ASP HB2 1 86 PRO QD . . 4.100 3.591 3.488 3.781 . 0 0 "[ . 1 . 2]" 1
1775 1 85 ASP HB2 1 87 GLU H . . 3.850 3.176 2.933 3.458 . 0 0 "[ . 1 . 2]" 1
1776 1 85 ASP HB2 1 88 ASP H . . 4.360 2.630 2.387 2.961 . 0 0 "[ . 1 . 2]" 1
1777 1 85 ASP HB2 1 89 VAL H . . 4.930 4.120 3.838 4.457 . 0 0 "[ . 1 . 2]" 1
1778 1 85 ASP HB3 1 86 PRO QD . . 3.750 2.131 1.992 2.468 . 0 0 "[ . 1 . 2]" 1
1779 1 85 ASP HB3 1 86 PRO HG2 . . 4.650 3.838 3.724 4.078 . 0 0 "[ . 1 . 2]" 1
1780 1 85 ASP HB3 1 87 GLU H . . 3.780 2.358 2.206 2.538 . 0 0 "[ . 1 . 2]" 1
1781 1 85 ASP HB3 1 87 GLU QB . . 4.880 3.734 2.919 4.339 . 0 0 "[ . 1 . 2]" 1
1782 1 86 PRO HA 1 89 VAL H . . 4.570 4.205 3.858 4.487 . 0 0 "[ . 1 . 2]" 1
1783 1 86 PRO HA 1 89 VAL HB . . 4.300 3.576 3.454 3.779 . 0 0 "[ . 1 . 2]" 1
1784 1 86 PRO QB 1 87 GLU H . . 3.730 3.678 3.550 3.712 . 0 0 "[ . 1 . 2]" 1
1785 1 86 PRO HB2 1 87 GLU H . . 4.580 3.911 3.752 3.955 . 0 0 "[ . 1 . 2]" 1
1786 1 86 PRO HB3 1 87 GLU H . . 4.580 4.474 4.384 4.499 . 0 0 "[ . 1 . 2]" 1
1787 1 86 PRO QD 1 87 GLU H . . 3.680 2.888 2.746 2.935 . 0 0 "[ . 1 . 2]" 1
1788 1 86 PRO QD 1 87 GLU QG . . 5.070 3.412 2.943 4.183 . 0 0 "[ . 1 . 2]" 1
1789 1 86 PRO HG2 1 87 GLU H . . 3.310 3.246 2.967 3.327 0.017 14 0 "[ . 1 . 2]" 1
1790 1 86 PRO HG3 1 87 GLU H . . 4.660 4.541 4.330 4.602 . 0 0 "[ . 1 . 2]" 1
1791 1 87 GLU H 1 87 GLU HB2 . . 3.730 3.148 2.345 3.736 0.006 14 0 "[ . 1 . 2]" 1
1792 1 87 GLU H 1 87 GLU QB . . 3.210 2.729 2.315 3.035 . 0 0 "[ . 1 . 2]" 1
1793 1 87 GLU H 1 87 GLU HB3 . . 3.730 3.369 3.034 3.714 . 0 0 "[ . 1 . 2]" 1
1794 1 87 GLU H 1 87 GLU HG2 . . 4.050 2.862 1.921 4.032 . 0 0 "[ . 1 . 2]" 1
1795 1 87 GLU H 1 87 GLU HG3 . . 4.050 2.962 2.285 4.052 0.002 17 0 "[ . 1 . 2]" 1
1796 1 87 GLU H 1 88 ASP H . . 3.440 2.026 1.875 2.256 . 0 0 "[ . 1 . 2]" 1
1797 1 87 GLU H 1 89 VAL H . . 4.620 3.590 3.381 3.765 . 0 0 "[ . 1 . 2]" 1
1798 1 87 GLU H 1 89 VAL MG2 . . 5.500 4.630 4.348 4.970 . 0 0 "[ . 1 . 2]" 1
1799 1 87 GLU HA 1 87 GLU HG2 . . 3.900 3.148 2.256 3.773 . 0 0 "[ . 1 . 2]" 1
1800 1 87 GLU HA 1 87 GLU QG . . 3.380 2.898 2.218 3.337 . 0 0 "[ . 1 . 2]" 1
1801 1 87 GLU HA 1 87 GLU HG3 . . 3.900 3.526 3.020 3.841 . 0 0 "[ . 1 . 2]" 1
1802 1 87 GLU HA 1 89 VAL H . . 4.690 4.549 4.048 4.697 0.007 20 0 "[ . 1 . 2]" 1
1803 1 87 GLU HA 1 90 ASN H . . 4.410 3.831 3.685 4.241 . 0 0 "[ . 1 . 2]" 1
1804 1 87 GLU HA 1 90 ASN QB . . 4.730 3.111 2.618 4.340 . 0 0 "[ . 1 . 2]" 1
1805 1 87 GLU QB 1 89 VAL H . . 5.340 5.028 4.673 5.316 . 0 0 "[ . 1 . 2]" 1
1806 1 87 GLU HB2 1 88 ASP H . . 4.590 3.303 2.315 4.079 . 0 0 "[ . 1 . 2]" 1
1807 1 87 GLU HB3 1 88 ASP H . . 4.590 3.870 3.372 4.462 . 0 0 "[ . 1 . 2]" 1
1808 1 87 GLU QG 1 88 ASP H . . 4.800 3.150 2.058 4.351 . 0 0 "[ . 1 . 2]" 1
1809 1 87 GLU HG2 1 88 ASP H . . 5.500 3.878 2.538 4.998 . 0 0 "[ . 1 . 2]" 1
1810 1 87 GLU HG3 1 88 ASP H . . 5.500 3.381 2.084 4.981 . 0 0 "[ . 1 . 2]" 1
1811 1 88 ASP H 1 88 ASP HB2 . . 3.890 2.275 2.187 2.395 . 0 0 "[ . 1 . 2]" 1
1812 1 88 ASP H 1 88 ASP QB . . 3.390 2.245 2.166 2.361 . 0 0 "[ . 1 . 2]" 1
1813 1 88 ASP H 1 88 ASP HB3 . . 3.890 3.501 2.865 3.582 . 0 0 "[ . 1 . 2]" 1
1814 1 88 ASP H 1 89 VAL H . . 3.080 2.530 2.049 2.831 . 0 0 "[ . 1 . 2]" 1
1815 1 88 ASP H 1 89 VAL MG2 . . 4.280 4.042 3.519 4.262 . 0 0 "[ . 1 . 2]" 1
1816 1 88 ASP H 1 90 ASN H . . 4.610 4.167 3.491 4.619 0.009 17 0 "[ . 1 . 2]" 1
1817 1 88 ASP QB 1 89 VAL H . . 3.440 2.627 2.440 3.028 . 0 0 "[ . 1 . 2]" 1
1818 1 88 ASP QB 1 89 VAL MG2 . . 3.550 3.181 2.809 3.498 . 0 0 "[ . 1 . 2]" 1
1819 1 88 ASP HB2 1 89 VAL H . . 4.120 2.779 2.512 3.743 . 0 0 "[ . 1 . 2]" 1
1820 1 88 ASP HB2 1 89 VAL MG2 . . 4.080 3.465 3.213 4.106 0.026 8 0 "[ . 1 . 2]" 1
1821 1 88 ASP HB3 1 89 VAL H . . 4.120 3.355 2.984 3.693 . 0 0 "[ . 1 . 2]" 1
1822 1 88 ASP HB3 1 89 VAL MG2 . . 4.080 3.806 2.861 4.091 0.011 14 0 "[ . 1 . 2]" 1
1823 1 89 VAL H 1 89 VAL HB . . 3.290 2.491 2.394 2.615 . 0 0 "[ . 1 . 2]" 1
1824 1 89 VAL H 1 89 VAL MG1 . . 3.960 3.760 3.739 3.804 . 0 0 "[ . 1 . 2]" 1
1825 1 89 VAL H 1 89 VAL MG2 . . 3.120 2.202 2.058 2.437 . 0 0 "[ . 1 . 2]" 1
1826 1 89 VAL H 1 90 ASN H . . 3.000 2.683 2.340 2.932 . 0 0 "[ . 1 . 2]" 1
1827 1 89 VAL H 1 90 ASN HA . . 5.500 5.276 5.006 5.431 . 0 0 "[ . 1 . 2]" 1
1828 1 89 VAL H 1 90 ASN QB . . 5.050 4.489 4.118 5.061 0.011 9 0 "[ . 1 . 2]" 1
1829 1 89 VAL H 1 91 VAL MG1 . . 5.500 5.174 4.861 5.504 0.004 19 0 "[ . 1 . 2]" 1
1830 1 89 VAL HA 1 89 VAL MG1 . . 3.490 2.386 2.242 2.469 . 0 0 "[ . 1 . 2]" 1
1831 1 89 VAL HA 1 89 VAL MG2 . . 3.220 2.340 2.254 2.515 . 0 0 "[ . 1 . 2]" 1
1832 1 89 VAL HA 1 91 VAL H . . 5.370 4.692 4.329 5.358 . 0 0 "[ . 1 . 2]" 1
1833 1 89 VAL HA 1 91 VAL MG1 . . 4.110 3.509 3.269 3.863 . 0 0 "[ . 1 . 2]" 1
1834 1 89 VAL HA 1 94 PRO HB2 . . 4.280 3.495 3.159 3.723 . 0 0 "[ . 1 . 2]" 1
1835 1 89 VAL HA 1 94 PRO HB3 . . 3.990 2.917 2.627 3.105 . 0 0 "[ . 1 . 2]" 1
1836 1 89 VAL HA 1 94 PRO HG3 . . 4.650 4.452 4.238 4.686 0.036 17 0 "[ . 1 . 2]" 1
1837 1 89 VAL HA 1 99 ILE MD . . 4.170 3.775 3.322 4.108 . 0 0 "[ . 1 . 2]" 1
1838 1 89 VAL HB 1 90 ASN H . . 3.530 2.453 2.054 2.891 . 0 0 "[ . 1 . 2]" 1
1839 1 89 VAL MG1 1 90 ASN H . . 4.160 3.259 2.824 3.580 . 0 0 "[ . 1 . 2]" 1
1840 1 89 VAL MG1 1 90 ASN HA . . 4.490 3.373 3.202 3.661 . 0 0 "[ . 1 . 2]" 1
1841 1 89 VAL MG1 1 91 VAL H . . 4.690 4.010 3.795 4.132 . 0 0 "[ . 1 . 2]" 1
1842 1 89 VAL MG1 1 94 PRO HB2 . . 4.090 3.425 2.839 3.986 . 0 0 "[ . 1 . 2]" 1
1843 1 89 VAL MG1 1 94 PRO HB3 . . 3.990 3.278 2.923 3.631 . 0 0 "[ . 1 . 2]" 1
1844 1 89 VAL MG1 1 94 PRO HG3 . . 4.390 3.279 2.925 3.582 . 0 0 "[ . 1 . 2]" 1
1845 1 89 VAL MG1 1 99 ILE MD . . 3.180 2.446 2.091 2.977 . 0 0 "[ . 1 . 2]" 1
1846 1 89 VAL MG1 1 99 ILE MG . . 4.440 3.599 3.291 4.145 . 0 0 "[ . 1 . 2]" 1
1847 1 89 VAL MG2 1 90 ASN H . . 4.390 3.798 3.639 3.975 . 0 0 "[ . 1 . 2]" 1
1848 1 89 VAL MG2 1 94 PRO HB2 . . 5.080 4.376 3.996 4.635 . 0 0 "[ . 1 . 2]" 1
1849 1 89 VAL MG2 1 94 PRO HB3 . . 4.620 4.526 4.287 4.648 0.028 17 0 "[ . 1 . 2]" 1
1850 1 89 VAL MG2 1 99 ILE HG13 . . 5.340 3.806 3.358 4.354 . 0 0 "[ . 1 . 2]" 1
1851 1 90 ASN H 1 90 ASN HB2 . . 3.390 2.703 2.291 3.562 0.172 9 0 "[ . 1 . 2]" 1
1852 1 90 ASN H 1 90 ASN QB . . 2.960 2.286 2.145 2.775 . 0 0 "[ . 1 . 2]" 1
1853 1 90 ASN H 1 90 ASN HB3 . . 3.390 2.558 2.165 2.904 . 0 0 "[ . 1 . 2]" 1
1854 1 90 ASN H 1 91 VAL H . . 4.350 4.138 3.976 4.394 0.044 19 0 "[ . 1 . 2]" 1
1855 1 90 ASN H 1 91 VAL MG1 . . 4.980 4.665 4.309 4.898 . 0 0 "[ . 1 . 2]" 1
1856 1 90 ASN HA 1 91 VAL H . . 2.920 2.263 2.149 2.356 . 0 0 "[ . 1 . 2]" 1
1857 1 90 ASN QB 1 91 VAL H . . 4.270 3.958 3.570 4.057 . 0 0 "[ . 1 . 2]" 1
1858 1 90 ASN HB2 1 90 ASN HD22 . . 4.060 3.568 3.432 3.802 . 0 0 "[ . 1 . 2]" 1
1859 1 90 ASN HB2 1 91 VAL H . . 4.850 4.448 3.732 4.628 . 0 0 "[ . 1 . 2]" 1
1860 1 90 ASN HB3 1 90 ASN HD22 . . 4.060 3.719 3.467 4.056 . 0 0 "[ . 1 . 2]" 1
1861 1 90 ASN HB3 1 91 VAL H . . 4.850 4.474 4.367 4.559 . 0 0 "[ . 1 . 2]" 1
1862 1 91 VAL H 1 91 VAL HB . . 3.890 3.346 3.198 3.493 . 0 0 "[ . 1 . 2]" 1
1863 1 91 VAL H 1 91 VAL MG1 . . 3.030 2.504 2.240 2.657 . 0 0 "[ . 1 . 2]" 1
1864 1 91 VAL H 1 91 VAL MG2 . . 4.200 4.012 3.958 4.078 . 0 0 "[ . 1 . 2]" 1
1865 1 91 VAL H 1 92 ASP H . . 4.350 4.373 4.332 4.417 0.067 8 0 "[ . 1 . 2]" 1
1866 1 91 VAL H 1 94 PRO HB3 . . 5.210 3.709 3.412 3.954 . 0 0 "[ . 1 . 2]" 1
1867 1 91 VAL H 1 94 PRO HD3 . . 4.780 3.431 3.254 3.595 . 0 0 "[ . 1 . 2]" 1
1868 1 91 VAL H 1 94 PRO HG3 . . 4.450 3.763 3.498 4.165 . 0 0 "[ . 1 . 2]" 1
1869 1 91 VAL HA 1 91 VAL MG1 . . 3.730 3.191 3.182 3.202 . 0 0 "[ . 1 . 2]" 1
1870 1 91 VAL HA 1 91 VAL MG2 . . 3.170 2.236 2.136 2.357 . 0 0 "[ . 1 . 2]" 1
1871 1 91 VAL HA 1 93 GLN H . . 4.750 4.666 4.543 4.763 0.013 19 0 "[ . 1 . 2]" 1
1872 1 91 VAL HB 1 92 ASP H . . 4.110 3.849 3.729 4.014 . 0 0 "[ . 1 . 2]" 1
1873 1 91 VAL HB 1 93 GLN H . . 4.830 4.837 4.796 4.868 0.038 14 0 "[ . 1 . 2]" 1
1874 1 91 VAL MG1 1 92 ASP H . . 4.100 3.342 3.101 3.502 . 0 0 "[ . 1 . 2]" 1
1875 1 91 VAL MG1 1 93 GLN H . . 3.230 2.622 2.276 2.897 . 0 0 "[ . 1 . 2]" 1
1876 1 91 VAL MG1 1 94 PRO HA . . 3.220 2.065 1.983 2.143 . 0 0 "[ . 1 . 2]" 1
1877 1 91 VAL MG1 1 94 PRO HB2 . . 3.980 3.362 3.221 3.539 . 0 0 "[ . 1 . 2]" 1
1878 1 91 VAL MG1 1 94 PRO HB3 . . 3.730 1.986 1.869 2.193 . 0 0 "[ . 1 . 2]" 1
1879 1 91 VAL MG1 1 94 PRO HD2 . . 4.490 3.422 3.316 3.577 . 0 0 "[ . 1 . 2]" 1
1880 1 91 VAL MG1 1 94 PRO HD3 . . 4.080 2.086 1.962 2.353 . 0 0 "[ . 1 . 2]" 1
1881 1 91 VAL MG1 1 94 PRO HG2 . . 4.460 3.872 3.677 4.129 . 0 0 "[ . 1 . 2]" 1
1882 1 91 VAL MG1 1 94 PRO HG3 . . 3.800 3.121 2.810 3.543 . 0 0 "[ . 1 . 2]" 1
1883 1 91 VAL MG1 1 95 ASP H . . 4.620 3.893 3.720 4.071 . 0 0 "[ . 1 . 2]" 1
1884 1 91 VAL MG2 1 92 ASP H . . 4.100 1.833 1.759 1.981 . 0 0 "[ . 1 . 2]" 1
1885 1 91 VAL MG2 1 93 GLN H . . 4.090 2.278 1.951 2.535 . 0 0 "[ . 1 . 2]" 1
1886 1 91 VAL MG2 1 94 PRO HA . . 4.660 4.032 3.847 4.222 . 0 0 "[ . 1 . 2]" 1
1887 1 91 VAL MG2 1 94 PRO HB3 . . 5.390 4.619 4.432 4.895 . 0 0 "[ . 1 . 2]" 1
1888 1 92 ASP H 1 92 ASP HB2 . . 3.870 2.400 2.175 2.737 . 0 0 "[ . 1 . 2]" 1
1889 1 92 ASP H 1 92 ASP HB3 . . 3.870 3.541 2.992 3.603 . 0 0 "[ . 1 . 2]" 1
1890 1 92 ASP H 1 93 GLN H . . 3.510 2.957 2.864 3.090 . 0 0 "[ . 1 . 2]" 1
1891 1 92 ASP QB 1 93 GLN H . . 3.160 2.355 2.229 2.472 . 0 0 "[ . 1 . 2]" 1
1892 1 92 ASP QB 1 93 GLN QG . . 3.580 2.620 2.315 2.863 . 0 0 "[ . 1 . 2]" 1
1893 1 92 ASP HB2 1 93 GLN H . . 3.640 2.487 2.254 3.416 . 0 0 "[ . 1 . 2]" 1
1894 1 92 ASP HB2 1 93 GLN QG . . 4.120 3.357 2.377 4.055 . 0 0 "[ . 1 . 2]" 1
1895 1 92 ASP HB3 1 93 GLN H . . 3.640 3.162 2.302 3.524 . 0 0 "[ . 1 . 2]" 1
1896 1 92 ASP HB3 1 93 GLN QG . . 4.120 2.892 2.455 3.641 . 0 0 "[ . 1 . 2]" 1
1897 1 93 GLN H 1 93 GLN HB2 . . 4.060 3.121 2.646 3.795 . 0 0 "[ . 1 . 2]" 1
1898 1 93 GLN H 1 93 GLN QB . . 3.330 2.855 2.596 3.207 . 0 0 "[ . 1 . 2]" 1
1899 1 93 GLN H 1 93 GLN HB3 . . 4.060 3.652 3.356 3.851 . 0 0 "[ . 1 . 2]" 1
1900 1 93 GLN H 1 93 GLN QG . . 3.320 2.715 1.955 3.281 . 0 0 "[ . 1 . 2]" 1
1901 1 93 GLN H 1 94 PRO HD2 . . 4.480 4.186 4.094 4.322 . 0 0 "[ . 1 . 2]" 1
1902 1 93 GLN H 1 94 PRO HD3 . . 4.060 3.489 3.356 3.692 . 0 0 "[ . 1 . 2]" 1
1903 1 93 GLN HA 1 93 GLN QG . . 3.470 2.858 2.356 3.363 . 0 0 "[ . 1 . 2]" 1
1904 1 93 GLN HA 1 94 PRO HD2 . . 3.410 1.968 1.930 2.000 . 0 0 "[ . 1 . 2]" 1
1905 1 93 GLN HA 1 94 PRO HD3 . . 3.430 2.718 2.615 2.785 . 0 0 "[ . 1 . 2]" 1
1906 1 94 PRO HA 1 95 ASP H . . 3.190 2.468 2.160 2.725 . 0 0 "[ . 1 . 2]" 1
1907 1 94 PRO HA 1 99 ILE MD . . 4.560 4.480 4.373 4.561 0.001 10 0 "[ . 1 . 2]" 1
1908 1 94 PRO HB2 1 95 ASP H . . 4.240 2.486 1.897 3.463 . 0 0 "[ . 1 . 2]" 1
1909 1 94 PRO HB2 1 96 GLU H . . 5.500 4.721 4.387 5.017 . 0 0 "[ . 1 . 2]" 1
1910 1 94 PRO HB2 1 99 ILE MD . . 3.150 2.035 1.961 2.137 . 0 0 "[ . 1 . 2]" 1
1911 1 94 PRO HB3 1 95 ASP H . . 4.190 3.407 3.145 3.953 . 0 0 "[ . 1 . 2]" 1
1912 1 94 PRO HB3 1 99 ILE MD . . 3.520 3.304 3.068 3.513 . 0 0 "[ . 1 . 2]" 1
1913 1 94 PRO HG2 1 96 GLU H . . 5.500 4.635 4.168 4.972 . 0 0 "[ . 1 . 2]" 1
1914 1 94 PRO HG3 1 99 ILE MD . . 4.110 3.077 2.840 3.350 . 0 0 "[ . 1 . 2]" 1
1915 1 95 ASP H 1 95 ASP HB2 . . 3.650 2.443 2.194 3.514 . 0 0 "[ . 1 . 2]" 1
1916 1 95 ASP H 1 95 ASP HB3 . . 3.650 3.422 2.810 3.615 . 0 0 "[ . 1 . 2]" 1
1917 1 95 ASP H 1 96 GLU H . . 4.450 4.154 3.939 4.306 . 0 0 "[ . 1 . 2]" 1
1918 1 95 ASP H 1 99 ILE MD . . 4.600 3.705 3.215 4.536 . 0 0 "[ . 1 . 2]" 1
1919 1 95 ASP HA 1 96 GLU H . . 2.750 2.214 2.165 2.278 . 0 0 "[ . 1 . 2]" 1
1920 1 95 ASP HA 1 96 GLU QB . . 5.400 4.516 4.308 4.717 . 0 0 "[ . 1 . 2]" 1
1921 1 95 ASP HA 1 97 LYS H . . 4.100 3.575 3.378 3.904 . 0 0 "[ . 1 . 2]" 1
1922 1 95 ASP QB 1 96 GLU H . . 3.840 3.740 3.630 3.900 0.060 11 0 "[ . 1 . 2]" 1
1923 1 95 ASP QB 1 98 SER H . . 3.890 2.277 1.994 2.662 . 0 0 "[ . 1 . 2]" 1
1924 1 95 ASP QB 1 98 SER QB . . 4.200 2.076 1.802 2.662 . 0 0 "[ . 1 . 2]" 1
1925 1 95 ASP HB2 1 98 SER H . . 4.540 3.273 2.254 4.251 . 0 0 "[ . 1 . 2]" 1
1926 1 95 ASP HB3 1 98 SER H . . 4.540 2.494 2.009 4.134 . 0 0 "[ . 1 . 2]" 1
1927 1 96 GLU H 1 96 GLU QB . . 2.940 2.485 2.250 2.678 . 0 0 "[ . 1 . 2]" 1
1928 1 96 GLU H 1 96 GLU HG2 . . 4.060 2.516 1.898 3.433 . 0 0 "[ . 1 . 2]" 1
1929 1 96 GLU H 1 96 GLU HG3 . . 4.060 3.519 2.633 4.072 0.012 13 0 "[ . 1 . 2]" 1
1930 1 96 GLU H 1 97 LYS H . . 3.380 2.824 2.706 2.942 . 0 0 "[ . 1 . 2]" 1
1931 1 96 GLU H 1 97 LYS HA . . 5.500 5.398 5.300 5.498 . 0 0 "[ . 1 . 2]" 1
1932 1 96 GLU H 1 98 SER H . . 4.850 4.272 4.102 4.473 . 0 0 "[ . 1 . 2]" 1
1933 1 96 GLU H 1 99 ILE HG13 . . 5.500 5.052 4.808 5.339 . 0 0 "[ . 1 . 2]" 1
1934 1 96 GLU HA 1 96 GLU QG . . 3.680 3.373 3.296 3.505 . 0 0 "[ . 1 . 2]" 1
1935 1 96 GLU HA 1 99 ILE H . . 4.460 3.432 3.331 3.669 . 0 0 "[ . 1 . 2]" 1
1936 1 96 GLU HA 1 99 ILE HB . . 3.360 2.711 2.422 2.954 . 0 0 "[ . 1 . 2]" 1
1937 1 96 GLU HA 1 99 ILE MD . . 3.590 2.528 2.058 2.907 . 0 0 "[ . 1 . 2]" 1
1938 1 96 GLU HA 1 99 ILE MG . . 4.400 4.064 3.762 4.278 . 0 0 "[ . 1 . 2]" 1
1939 1 96 GLU QB 1 97 LYS H . . 3.910 3.429 3.226 3.542 . 0 0 "[ . 1 . 2]" 1
1940 1 96 GLU QG 1 97 LYS H . . 3.620 2.080 1.870 2.384 . 0 0 "[ . 1 . 2]" 1
1941 1 96 GLU QG 1 100 ILE MD . . 3.360 2.750 1.978 3.374 0.014 9 0 "[ . 1 . 2]" 1
1942 1 96 GLU HG2 1 97 LYS H . . 4.200 2.376 1.889 3.409 . 0 0 "[ . 1 . 2]" 1
1943 1 96 GLU HG3 1 97 LYS H . . 4.200 2.927 2.170 3.808 . 0 0 "[ . 1 . 2]" 1
1944 1 97 LYS H 1 97 LYS HB2 . . 2.840 2.414 2.154 2.579 . 0 0 "[ . 1 . 2]" 1
1945 1 97 LYS H 1 97 LYS HB3 . . 3.690 3.568 3.468 3.599 . 0 0 "[ . 1 . 2]" 1
1946 1 97 LYS H 1 97 LYS QD . . 4.160 3.532 1.911 4.168 0.008 10 0 "[ . 1 . 2]" 1
1947 1 97 LYS H 1 97 LYS HG2 . . 4.140 2.710 2.080 4.142 0.002 12 0 "[ . 1 . 2]" 1
1948 1 97 LYS H 1 97 LYS QG . . 3.640 2.523 2.058 3.613 . 0 0 "[ . 1 . 2]" 1
1949 1 97 LYS H 1 97 LYS HG3 . . 4.140 3.508 3.237 4.002 . 0 0 "[ . 1 . 2]" 1
1950 1 97 LYS H 1 98 SER H . . 3.170 2.607 2.519 2.829 . 0 0 "[ . 1 . 2]" 1
1951 1 97 LYS H 1 99 ILE H . . 4.350 3.870 3.788 3.973 . 0 0 "[ . 1 . 2]" 1
1952 1 97 LYS H 1 100 ILE MD . . 4.440 3.625 3.382 3.891 . 0 0 "[ . 1 . 2]" 1
1953 1 97 LYS HA 1 97 LYS QD . . 4.290 2.732 1.988 3.308 . 0 0 "[ . 1 . 2]" 1
1954 1 97 LYS HA 1 97 LYS QG . . 3.700 2.632 2.183 2.837 . 0 0 "[ . 1 . 2]" 1
1955 1 97 LYS HA 1 99 ILE H . . 3.860 3.804 3.672 3.864 0.004 4 0 "[ . 1 . 2]" 1
1956 1 97 LYS HA 1 100 ILE H . . 4.040 3.581 3.253 3.852 . 0 0 "[ . 1 . 2]" 1
1957 1 97 LYS HA 1 100 ILE HB . . 3.500 2.930 2.635 3.226 . 0 0 "[ . 1 . 2]" 1
1958 1 97 LYS HA 1 100 ILE MD . . 3.660 2.308 2.014 2.614 . 0 0 "[ . 1 . 2]" 1
1959 1 97 LYS HA 1 100 ILE MG . . 4.520 4.272 4.002 4.518 . 0 0 "[ . 1 . 2]" 1
1960 1 97 LYS HA 1 101 THR H . . 4.730 4.276 4.033 4.545 . 0 0 "[ . 1 . 2]" 1
1961 1 97 LYS HB2 1 97 LYS QD . . 3.810 3.015 2.196 3.296 . 0 0 "[ . 1 . 2]" 1
1962 1 97 LYS HB2 1 98 SER H . . 4.040 2.775 2.510 2.976 . 0 0 "[ . 1 . 2]" 1
1963 1 97 LYS HB3 1 97 LYS QD . . 3.830 2.481 2.057 3.365 . 0 0 "[ . 1 . 2]" 1
1964 1 97 LYS HB3 1 98 SER H . . 3.880 3.657 3.066 3.894 0.014 18 0 "[ . 1 . 2]" 1
1965 1 97 LYS QE 1 100 ILE MD . . 3.930 2.435 1.816 3.203 . 0 0 "[ . 1 . 2]" 1
1966 1 97 LYS QG 1 98 SER H . . 4.470 4.183 3.950 4.511 0.041 9 0 "[ . 1 . 2]" 1
1967 1 97 LYS HG2 1 98 SER H . . 5.170 4.555 4.216 5.178 0.008 14 0 "[ . 1 . 2]" 1
1968 1 97 LYS HG3 1 98 SER H . . 5.170 4.921 4.715 5.170 0.000 1 0 "[ . 1 . 2]" 1
1969 1 98 SER H 1 98 SER HB2 . . 4.050 2.451 2.214 3.531 . 0 0 "[ . 1 . 2]" 1
1970 1 98 SER H 1 98 SER QB . . 3.230 2.271 2.153 2.442 . 0 0 "[ . 1 . 2]" 1
1971 1 98 SER H 1 98 SER HB3 . . 4.050 3.219 2.219 3.612 . 0 0 "[ . 1 . 2]" 1
1972 1 98 SER H 1 99 ILE H . . 3.240 2.485 2.353 2.655 . 0 0 "[ . 1 . 2]" 1
1973 1 98 SER H 1 99 ILE HA . . 5.410 5.099 4.976 5.241 . 0 0 "[ . 1 . 2]" 1
1974 1 98 SER H 1 99 ILE HB . . 4.850 4.701 4.560 4.871 0.021 14 0 "[ . 1 . 2]" 1
1975 1 98 SER H 1 100 ILE H . . 4.460 4.351 4.142 4.473 0.013 9 0 "[ . 1 . 2]" 1
1976 1 98 SER H 1 100 ILE MD . . 5.050 4.826 4.701 5.059 0.009 17 0 "[ . 1 . 2]" 1
1977 1 98 SER QB 1 99 ILE H . . 3.530 3.207 3.089 3.593 0.063 14 0 "[ . 1 . 2]" 1
1978 1 99 ILE H 1 99 ILE HB . . 3.050 2.502 2.444 2.530 . 0 0 "[ . 1 . 2]" 1
1979 1 99 ILE H 1 99 ILE MD . . 3.890 3.716 3.502 3.858 . 0 0 "[ . 1 . 2]" 1
1980 1 99 ILE H 1 99 ILE HG12 . . 4.150 3.859 3.697 3.973 . 0 0 "[ . 1 . 2]" 1
1981 1 99 ILE H 1 99 ILE HG13 . . 3.240 2.586 2.472 2.753 . 0 0 "[ . 1 . 2]" 1
1982 1 99 ILE H 1 99 ILE MG . . 3.940 3.786 3.754 3.800 . 0 0 "[ . 1 . 2]" 1
1983 1 99 ILE H 1 100 ILE H . . 3.340 2.319 2.155 2.431 . 0 0 "[ . 1 . 2]" 1
1984 1 99 ILE H 1 100 ILE HB . . 4.330 4.329 4.291 4.385 0.055 14 0 "[ . 1 . 2]" 1
1985 1 99 ILE H 1 100 ILE MD . . 4.340 4.280 4.155 4.347 0.007 17 0 "[ . 1 . 2]" 1
1986 1 99 ILE H 1 100 ILE HG13 . . 4.530 4.081 3.913 4.314 . 0 0 "[ . 1 . 2]" 1
1987 1 99 ILE HA 1 99 ILE MD . . 3.950 3.849 3.809 3.883 . 0 0 "[ . 1 . 2]" 1
1988 1 99 ILE HA 1 99 ILE HG12 . . 3.660 2.590 2.489 2.720 . 0 0 "[ . 1 . 2]" 1
1989 1 99 ILE HA 1 99 ILE HG13 . . 3.790 2.894 2.767 3.021 . 0 0 "[ . 1 . 2]" 1
1990 1 99 ILE HA 1 99 ILE MG . . 3.450 2.464 2.419 2.492 . 0 0 "[ . 1 . 2]" 1
1991 1 99 ILE HA 1 102 TYR H . . 3.810 3.261 3.126 3.481 . 0 0 "[ . 1 . 2]" 1
1992 1 99 ILE HA 1 102 TYR HB3 . . 4.320 2.911 2.433 3.385 . 0 0 "[ . 1 . 2]" 1
1993 1 99 ILE HA 1 103 VAL H . . 4.560 3.900 3.651 4.166 . 0 0 "[ . 1 . 2]" 1
1994 1 99 ILE HA 1 103 VAL MG1 . . 4.590 4.311 4.106 4.476 . 0 0 "[ . 1 . 2]" 1
1995 1 99 ILE HB 1 99 ILE MD . . 3.400 2.293 2.223 2.372 . 0 0 "[ . 1 . 2]" 1
1996 1 99 ILE HB 1 100 ILE H . . 3.450 2.427 2.208 2.776 . 0 0 "[ . 1 . 2]" 1
1997 1 99 ILE HB 1 100 ILE HG13 . . 4.500 3.360 3.273 3.498 . 0 0 "[ . 1 . 2]" 1
1998 1 99 ILE MD 1 99 ILE MG . . 2.970 2.214 2.032 2.359 . 0 0 "[ . 1 . 2]" 1
1999 1 99 ILE MD 1 100 ILE H . . 4.670 4.338 4.090 4.670 0.000 11 0 "[ . 1 . 2]" 1
2000 1 99 ILE HG13 1 99 ILE MG . . 3.610 3.188 3.162 3.201 . 0 0 "[ . 1 . 2]" 1
2001 1 99 ILE MG 1 100 ILE H . . 3.910 3.249 3.067 3.520 . 0 0 "[ . 1 . 2]" 1
2002 1 99 ILE MG 1 100 ILE HA . . 4.170 3.347 3.255 3.503 . 0 0 "[ . 1 . 2]" 1
2003 1 99 ILE MG 1 100 ILE HG13 . . 4.230 3.873 3.522 4.053 . 0 0 "[ . 1 . 2]" 1
2004 1 99 ILE MG 1 102 TYR HB3 . . 4.570 3.464 3.247 3.730 . 0 0 "[ . 1 . 2]" 1
2005 1 99 ILE MG 1 103 VAL H . . 4.550 3.211 3.009 3.509 . 0 0 "[ . 1 . 2]" 1
2006 1 100 ILE H 1 100 ILE HB . . 3.110 2.571 2.486 2.648 . 0 0 "[ . 1 . 2]" 1
2007 1 100 ILE H 1 100 ILE MD . . 3.600 3.125 3.044 3.177 . 0 0 "[ . 1 . 2]" 1
2008 1 100 ILE H 1 100 ILE HG12 . . 3.920 3.593 3.491 3.704 . 0 0 "[ . 1 . 2]" 1
2009 1 100 ILE H 1 100 ILE HG13 . . 3.280 2.090 1.969 2.230 . 0 0 "[ . 1 . 2]" 1
2010 1 100 ILE H 1 100 ILE MG . . 3.810 3.769 3.756 3.784 . 0 0 "[ . 1 . 2]" 1
2011 1 100 ILE H 1 101 THR H . . 3.490 2.836 2.625 3.013 . 0 0 "[ . 1 . 2]" 1
2012 1 100 ILE HA 1 100 ILE MD . . 3.910 3.857 3.827 3.874 . 0 0 "[ . 1 . 2]" 1
2013 1 100 ILE HA 1 100 ILE HG12 . . 3.670 2.770 2.736 2.812 . 0 0 "[ . 1 . 2]" 1
2014 1 100 ILE HA 1 100 ILE HG13 . . 3.900 2.655 2.570 2.736 . 0 0 "[ . 1 . 2]" 1
2015 1 100 ILE HA 1 100 ILE MG . . 3.350 2.477 2.455 2.503 . 0 0 "[ . 1 . 2]" 1
2016 1 100 ILE HA 1 103 VAL H . . 4.470 3.953 3.781 4.064 . 0 0 "[ . 1 . 2]" 1
2017 1 100 ILE HA 1 103 VAL HB . . 4.420 4.270 4.086 4.429 0.009 14 0 "[ . 1 . 2]" 1
2018 1 100 ILE HA 1 103 VAL MG1 . . 3.980 1.958 1.871 2.037 . 0 0 "[ . 1 . 2]" 1
2019 1 100 ILE HA 1 103 VAL MG2 . . 4.440 4.394 4.220 4.443 0.003 7 0 "[ . 1 . 2]" 1
2020 1 100 ILE HA 1 104 ALA H . . 4.150 4.094 3.971 4.159 0.009 13 0 "[ . 1 . 2]" 1
2021 1 100 ILE HB 1 100 ILE MD . . 3.680 2.273 2.153 2.318 . 0 0 "[ . 1 . 2]" 1
2022 1 100 ILE HB 1 101 THR H . . 3.270 2.763 2.464 2.968 . 0 0 "[ . 1 . 2]" 1
2023 1 100 ILE HB 1 102 TYR H . . 5.440 5.185 5.014 5.360 . 0 0 "[ . 1 . 2]" 1
2024 1 100 ILE MD 1 101 THR H . . 4.730 4.457 4.282 4.606 . 0 0 "[ . 1 . 2]" 1
2025 1 100 ILE HG12 1 101 THR H . . 5.300 5.184 5.040 5.272 . 0 0 "[ . 1 . 2]" 1
2026 1 100 ILE HG13 1 100 ILE MG . . 3.700 3.146 3.133 3.157 . 0 0 "[ . 1 . 2]" 1
2027 1 100 ILE HG13 1 101 THR H . . 4.510 4.382 4.308 4.503 . 0 0 "[ . 1 . 2]" 1
2028 1 100 ILE MG 1 101 THR H . . 3.630 3.452 3.080 3.592 . 0 0 "[ . 1 . 2]" 1
2029 1 100 ILE MG 1 101 THR HA . . 3.970 3.362 3.106 3.469 . 0 0 "[ . 1 . 2]" 1
2030 1 100 ILE MG 1 102 TYR H . . 5.060 5.027 4.884 5.068 0.008 13 0 "[ . 1 . 2]" 1
2031 1 101 THR H 1 101 THR HB . . 2.990 2.646 2.583 2.729 . 0 0 "[ . 1 . 2]" 1
2032 1 101 THR H 1 101 THR MG . . 3.970 3.768 3.748 3.777 . 0 0 "[ . 1 . 2]" 1
2033 1 101 THR H 1 102 TYR H . . 3.470 2.613 2.504 2.852 . 0 0 "[ . 1 . 2]" 1
2034 1 101 THR H 1 103 VAL H . . 4.850 4.480 4.239 4.752 . 0 0 "[ . 1 . 2]" 1
2035 1 101 THR HA 1 101 THR MG . . 3.270 2.293 2.171 2.386 . 0 0 "[ . 1 . 2]" 1
2036 1 101 THR HA 1 104 ALA H . . 4.170 3.770 3.636 3.927 . 0 0 "[ . 1 . 2]" 1
2037 1 101 THR HA 1 104 ALA MB . . 3.610 2.607 2.372 2.757 . 0 0 "[ . 1 . 2]" 1
2038 1 101 THR HB 1 102 TYR H . . 3.270 2.569 2.414 2.703 . 0 0 "[ . 1 . 2]" 1
2039 1 101 THR HB 1 103 VAL H . . 5.500 5.316 5.220 5.394 . 0 0 "[ . 1 . 2]" 1
2040 1 101 THR HB 1 104 ALA H . . 5.500 5.486 5.445 5.518 0.018 13 0 "[ . 1 . 2]" 1
2041 1 101 THR MG 1 102 TYR H . . 3.880 3.633 3.514 3.811 . 0 0 "[ . 1 . 2]" 1
2042 1 101 THR MG 1 102 TYR HA . . 4.210 3.758 3.565 3.988 . 0 0 "[ . 1 . 2]" 1
2043 1 101 THR MG 1 104 ALA MB . . 4.310 3.490 3.325 3.620 . 0 0 "[ . 1 . 2]" 1
2044 1 101 THR MG 1 105 THR H . . 5.150 5.045 4.837 5.153 0.003 13 0 "[ . 1 . 2]" 1
2045 1 102 TYR H 1 102 TYR HB2 . . 3.290 2.589 2.363 2.791 . 0 0 "[ . 1 . 2]" 1
2046 1 102 TYR H 1 102 TYR HB3 . . 3.230 2.492 2.316 2.706 . 0 0 "[ . 1 . 2]" 1
2047 1 102 TYR H 1 102 TYR QD . . 4.250 4.175 4.107 4.203 . 0 0 "[ . 1 . 2]" 1
2048 1 102 TYR H 1 103 VAL H . . 3.370 2.815 2.661 2.997 . 0 0 "[ . 1 . 2]" 1
2049 1 102 TYR H 1 103 VAL HB . . 5.500 5.236 5.033 5.435 . 0 0 "[ . 1 . 2]" 1
2050 1 102 TYR H 1 103 VAL MG1 . . 4.420 3.754 3.552 3.873 . 0 0 "[ . 1 . 2]" 1
2051 1 102 TYR H 1 104 ALA H . . 4.590 3.846 3.686 3.981 . 0 0 "[ . 1 . 2]" 1
2052 1 102 TYR HA 1 102 TYR QD . . 3.730 3.004 2.403 3.198 . 0 0 "[ . 1 . 2]" 1
2053 1 102 TYR HA 1 104 ALA H . . 4.440 4.068 3.879 4.263 . 0 0 "[ . 1 . 2]" 1
2054 1 102 TYR HA 1 104 ALA MB . . 5.160 4.418 4.211 4.559 . 0 0 "[ . 1 . 2]" 1
2055 1 102 TYR HA 1 105 THR HG1 . . 4.400 3.811 3.427 4.075 . 0 0 "[ . 1 . 2]" 1
2056 1 102 TYR HA 1 105 THR MG . . 3.820 2.712 2.317 3.013 . 0 0 "[ . 1 . 2]" 1
2057 1 102 TYR HB2 1 103 VAL H . . 3.890 3.667 3.491 3.869 . 0 0 "[ . 1 . 2]" 1
2058 1 102 TYR HB3 1 103 VAL H . . 3.400 2.214 2.025 2.464 . 0 0 "[ . 1 . 2]" 1
2059 1 102 TYR HB3 1 103 VAL HB . . 4.960 4.196 4.027 4.371 . 0 0 "[ . 1 . 2]" 1
2060 1 102 TYR QD 1 103 VAL H . . 4.280 2.841 2.522 3.381 . 0 0 "[ . 1 . 2]" 1
2061 1 102 TYR QD 1 103 VAL MG1 . . 4.540 4.295 3.858 4.541 0.001 11 0 "[ . 1 . 2]" 1
2062 1 102 TYR QD 1 105 THR MG . . 4.570 3.990 3.373 4.366 . 0 0 "[ . 1 . 2]" 1
2063 1 103 VAL H 1 103 VAL HB . . 3.150 2.535 2.460 2.645 . 0 0 "[ . 1 . 2]" 1
2064 1 103 VAL H 1 103 VAL MG1 . . 3.120 2.179 1.918 2.431 . 0 0 "[ . 1 . 2]" 1
2065 1 103 VAL H 1 103 VAL MG2 . . 3.850 3.762 3.755 3.767 . 0 0 "[ . 1 . 2]" 1
2066 1 103 VAL H 1 104 ALA H . . 3.290 2.768 2.658 2.848 . 0 0 "[ . 1 . 2]" 1
2067 1 103 VAL H 1 104 ALA HA . . 5.500 5.318 5.213 5.387 . 0 0 "[ . 1 . 2]" 1
2068 1 103 VAL H 1 104 ALA MB . . 4.640 4.366 4.224 4.456 . 0 0 "[ . 1 . 2]" 1
2069 1 103 VAL H 1 105 THR H . . 4.720 4.415 4.312 4.560 . 0 0 "[ . 1 . 2]" 1
2070 1 103 VAL HA 1 103 VAL MG1 . . 3.280 3.198 3.186 3.204 . 0 0 "[ . 1 . 2]" 1
2071 1 103 VAL HA 1 103 VAL MG2 . . 3.380 2.379 2.302 2.465 . 0 0 "[ . 1 . 2]" 1
2072 1 103 VAL HA 1 105 THR H . . 4.210 3.939 3.773 4.090 . 0 0 "[ . 1 . 2]" 1
2073 1 103 VAL HA 1 106 TYR H . . 3.570 3.324 3.227 3.478 . 0 0 "[ . 1 . 2]" 1
2074 1 103 VAL HA 1 106 TYR HB2 . . 3.990 3.210 3.005 3.421 . 0 0 "[ . 1 . 2]" 1
2075 1 103 VAL HA 1 106 TYR HB3 . . 5.000 4.815 4.640 4.997 . 0 0 "[ . 1 . 2]" 1
2076 1 103 VAL HA 1 106 TYR QE . . 4.840 4.594 4.267 4.834 . 0 0 "[ . 1 . 2]" 1
2077 1 103 VAL HB 1 104 ALA H . . 4.120 4.051 3.988 4.118 . 0 0 "[ . 1 . 2]" 1
2078 1 103 VAL MG1 1 104 ALA H . . 4.060 2.096 1.936 2.270 . 0 0 "[ . 1 . 2]" 1
2079 1 103 VAL MG1 1 105 THR H . . 4.490 4.341 4.243 4.483 . 0 0 "[ . 1 . 2]" 1
2080 1 103 VAL MG1 1 106 TYR H . . 5.150 4.949 4.783 5.126 . 0 0 "[ . 1 . 2]" 1
2081 1 103 VAL MG2 1 104 ALA H . . 3.930 3.710 3.503 3.927 . 0 0 "[ . 1 . 2]" 1
2082 1 103 VAL MG2 1 104 ALA HA . . 4.270 3.768 3.420 4.004 . 0 0 "[ . 1 . 2]" 1
2083 1 103 VAL MG2 1 104 ALA MB . . 4.650 4.495 4.279 4.652 0.002 7 0 "[ . 1 . 2]" 1
2084 1 103 VAL MG2 1 106 TYR H . . 4.710 3.891 3.634 4.087 . 0 0 "[ . 1 . 2]" 1
2085 1 103 VAL MG2 1 106 TYR HB2 . . 4.380 2.743 2.520 2.978 . 0 0 "[ . 1 . 2]" 1
2086 1 103 VAL MG2 1 107 TYR H . . 4.570 4.003 3.817 4.239 . 0 0 "[ . 1 . 2]" 1
2087 1 103 VAL MG2 1 107 TYR HB2 . . 5.220 4.491 4.199 4.747 . 0 0 "[ . 1 . 2]" 1
2088 1 104 ALA H 1 104 ALA MB . . 2.790 2.122 2.026 2.236 . 0 0 "[ . 1 . 2]" 1
2089 1 104 ALA H 1 105 THR H . . 3.410 2.757 2.601 2.861 . 0 0 "[ . 1 . 2]" 1
2090 1 104 ALA H 1 105 THR HG1 . . 4.810 4.383 4.134 4.739 . 0 0 "[ . 1 . 2]" 1
2091 1 104 ALA H 1 105 THR MG . . 4.840 4.016 3.779 4.322 . 0 0 "[ . 1 . 2]" 1
2092 1 104 ALA H 1 106 TYR H . . 4.430 4.352 4.189 4.434 0.004 14 0 "[ . 1 . 2]" 1
2093 1 104 ALA H 1 107 TYR H . . 5.290 5.193 5.115 5.258 . 0 0 "[ . 1 . 2]" 1
2094 1 104 ALA HA 1 106 TYR H . . 4.740 4.298 3.915 4.479 . 0 0 "[ . 1 . 2]" 1
2095 1 104 ALA HA 1 107 TYR H . . 3.720 3.526 3.377 3.612 . 0 0 "[ . 1 . 2]" 1
2096 1 104 ALA HA 1 107 TYR HB2 . . 4.520 4.258 4.102 4.333 . 0 0 "[ . 1 . 2]" 1
2097 1 104 ALA HA 1 107 TYR HB3 . . 3.700 3.060 2.885 3.211 . 0 0 "[ . 1 . 2]" 1
2098 1 104 ALA HA 1 107 TYR QD . . 4.450 4.113 3.757 4.448 . 0 0 "[ . 1 . 2]" 1
2099 1 104 ALA HA 1 108 HIS H . . 4.540 4.188 3.860 4.445 . 0 0 "[ . 1 . 2]" 1
2100 1 104 ALA MB 1 105 THR H . . 3.390 2.725 2.600 2.906 . 0 0 "[ . 1 . 2]" 1
2101 1 104 ALA MB 1 105 THR HA . . 5.350 3.780 3.706 3.880 . 0 0 "[ . 1 . 2]" 1
2102 1 104 ALA MB 1 107 TYR H . . 4.880 4.589 4.483 4.677 . 0 0 "[ . 1 . 2]" 1
2103 1 104 ALA MB 1 107 TYR HB2 . . 5.500 5.431 5.291 5.510 0.010 14 0 "[ . 1 . 2]" 1
2104 1 104 ALA MB 1 107 TYR HB3 . . 4.550 4.183 4.016 4.281 . 0 0 "[ . 1 . 2]" 1
2105 1 104 ALA MB 1 107 TYR QD . . 4.540 4.235 3.878 4.525 . 0 0 "[ . 1 . 2]" 1
2106 1 104 ALA MB 1 108 HIS H . . 4.610 4.368 4.116 4.516 . 0 0 "[ . 1 . 2]" 1
2107 1 104 ALA MB 1 108 HIS QB . . 4.540 4.332 3.523 4.551 0.011 17 0 "[ . 1 . 2]" 1
2108 1 104 ALA MB 1 108 HIS HD2 . . 4.320 2.843 2.340 4.315 . 0 0 "[ . 1 . 2]" 1
2109 1 105 THR H 1 105 THR HB . . 3.900 3.612 3.592 3.620 . 0 0 "[ . 1 . 2]" 1
2110 1 105 THR H 1 105 THR HG1 . . 3.120 2.282 2.083 2.605 . 0 0 "[ . 1 . 2]" 1
2111 1 105 THR H 1 105 THR MG . . 2.920 2.040 1.886 2.319 . 0 0 "[ . 1 . 2]" 1
2112 1 105 THR H 1 106 TYR H . . 3.190 2.685 2.590 2.791 . 0 0 "[ . 1 . 2]" 1
2113 1 105 THR H 1 106 TYR QD . . 4.980 4.152 3.959 4.351 . 0 0 "[ . 1 . 2]" 1
2114 1 105 THR H 1 107 TYR H . . 4.590 4.210 4.045 4.480 . 0 0 "[ . 1 . 2]" 1
2115 1 105 THR H 1 108 HIS H . . 5.180 4.907 4.655 5.139 . 0 0 "[ . 1 . 2]" 1
2116 1 105 THR HA 1 105 THR MG . . 3.000 2.441 2.285 2.518 . 0 0 "[ . 1 . 2]" 1
2117 1 105 THR HA 1 108 HIS H . . 3.800 3.537 3.236 3.786 . 0 0 "[ . 1 . 2]" 1
2118 1 105 THR HA 1 108 HIS QB . . 3.850 2.594 2.435 2.738 . 0 0 "[ . 1 . 2]" 1
2119 1 105 THR HA 1 109 TYR H . . 3.820 3.344 3.121 3.666 . 0 0 "[ . 1 . 2]" 1
2120 1 105 THR HA 1 109 TYR HB2 . . 5.120 4.475 4.215 4.846 . 0 0 "[ . 1 . 2]" 1
2121 1 105 THR HB 1 108 HIS QB . . 5.410 4.474 4.216 4.678 . 0 0 "[ . 1 . 2]" 1
2122 1 105 THR HB 1 109 TYR H . . 5.260 4.363 4.148 4.852 . 0 0 "[ . 1 . 2]" 1
2123 1 105 THR HB 1 109 TYR HB2 . . 5.500 3.970 3.546 4.287 . 0 0 "[ . 1 . 2]" 1
2124 1 105 THR HG1 1 105 THR MG . . 3.410 2.347 1.977 2.559 . 0 0 "[ . 1 . 2]" 1
2125 1 105 THR HG1 1 106 TYR H . . 3.560 2.215 1.924 2.826 . 0 0 "[ . 1 . 2]" 1
2126 1 105 THR MG 1 106 TYR H . . 4.010 3.762 3.599 3.867 . 0 0 "[ . 1 . 2]" 1
2127 1 105 THR MG 1 108 HIS QB . . 4.480 4.293 4.112 4.462 . 0 0 "[ . 1 . 2]" 1
2128 1 106 TYR H 1 106 TYR HB2 . . 3.600 2.299 2.227 2.347 . 0 0 "[ . 1 . 2]" 1
2129 1 106 TYR H 1 106 TYR HB3 . . 3.670 3.551 3.520 3.567 . 0 0 "[ . 1 . 2]" 1
2130 1 106 TYR H 1 106 TYR QD . . 3.560 2.151 1.922 2.401 . 0 0 "[ . 1 . 2]" 1
2131 1 106 TYR H 1 106 TYR QE . . 4.690 4.401 4.232 4.637 . 0 0 "[ . 1 . 2]" 1
2132 1 106 TYR H 1 107 TYR H . . 3.330 2.724 2.592 2.854 . 0 0 "[ . 1 . 2]" 1
2133 1 106 TYR H 1 107 TYR HB3 . . 4.970 4.750 4.603 4.848 . 0 0 "[ . 1 . 2]" 1
2134 1 106 TYR H 1 108 HIS H . . 4.800 4.480 4.124 4.748 . 0 0 "[ . 1 . 2]" 1
2135 1 106 TYR HA 1 106 TYR QD . . 3.880 2.493 2.241 2.763 . 0 0 "[ . 1 . 2]" 1
2136 1 106 TYR HA 1 106 TYR QE . . 4.540 4.374 4.290 4.467 . 0 0 "[ . 1 . 2]" 1
2137 1 106 TYR HA 1 107 TYR HA . . 5.290 4.716 4.649 4.762 . 0 0 "[ . 1 . 2]" 1
2138 1 106 TYR HA 1 109 TYR H . . 4.650 4.260 3.962 4.516 . 0 0 "[ . 1 . 2]" 1
2139 1 106 TYR HA 1 109 TYR HB2 . . 5.440 4.367 4.061 4.635 . 0 0 "[ . 1 . 2]" 1
2140 1 106 TYR HA 1 109 TYR HB3 . . 4.550 3.082 2.843 3.360 . 0 0 "[ . 1 . 2]" 1
2141 1 106 TYR HA 1 110 PHE H . . 4.140 3.934 3.688 4.093 . 0 0 "[ . 1 . 2]" 1
2142 1 106 TYR HA 1 110 PHE QD . . 4.020 3.401 3.070 3.758 . 0 0 "[ . 1 . 2]" 1
2143 1 106 TYR HB2 1 107 TYR H . . 3.390 2.813 2.574 3.021 . 0 0 "[ . 1 . 2]" 1
2144 1 106 TYR HB2 1 107 TYR HA . . 5.500 4.632 4.528 4.732 . 0 0 "[ . 1 . 2]" 1
2145 1 106 TYR HB3 1 107 TYR H . . 3.810 3.493 3.292 3.751 . 0 0 "[ . 1 . 2]" 1
2146 1 106 TYR HB3 1 110 PHE QD . . 3.950 3.539 3.201 3.773 . 0 0 "[ . 1 . 2]" 1
2147 1 107 TYR H 1 107 TYR HB2 . . 3.350 2.895 2.788 3.052 . 0 0 "[ . 1 . 2]" 1
2148 1 107 TYR H 1 107 TYR HB3 . . 3.280 2.272 2.222 2.331 . 0 0 "[ . 1 . 2]" 1
2149 1 107 TYR H 1 107 TYR QD . . 4.290 4.072 3.958 4.143 . 0 0 "[ . 1 . 2]" 1
2150 1 107 TYR H 1 108 HIS H . . 3.580 2.636 2.295 2.862 . 0 0 "[ . 1 . 2]" 1
2151 1 107 TYR H 1 109 TYR H . . 5.350 4.247 3.700 4.558 . 0 0 "[ . 1 . 2]" 1
2152 1 107 TYR HA 1 107 TYR QD . . 3.770 2.738 2.495 3.004 . 0 0 "[ . 1 . 2]" 1
2153 1 107 TYR HA 1 107 TYR QE . . 5.240 4.782 4.658 4.907 . 0 0 "[ . 1 . 2]" 1
2154 1 107 TYR HA 1 110 PHE H . . 5.250 4.227 3.897 4.411 . 0 0 "[ . 1 . 2]" 1
2155 1 107 TYR HA 1 111 SER H . . 4.090 3.934 3.733 4.086 . 0 0 "[ . 1 . 2]" 1
2156 1 107 TYR HB2 1 108 HIS H . . 4.090 3.858 3.748 4.088 . 0 0 "[ . 1 . 2]" 1
2157 1 107 TYR HB3 1 108 HIS H . . 3.520 2.461 2.324 2.806 . 0 0 "[ . 1 . 2]" 1
2158 1 107 TYR QD 1 108 HIS H . . 3.760 2.848 2.278 3.270 . 0 0 "[ . 1 . 2]" 1
2159 1 107 TYR QD 1 108 HIS HA . . 4.290 3.474 3.111 3.851 . 0 0 "[ . 1 . 2]" 1
2160 1 107 TYR QD 1 108 HIS QB . . 5.300 4.077 3.679 4.478 . 0 0 "[ . 1 . 2]" 1
2161 1 107 TYR QD 1 111 SER QB . . 4.930 3.782 3.402 4.237 . 0 0 "[ . 1 . 2]" 1
2162 1 107 TYR QE 1 108 HIS HA . . 4.470 4.053 3.619 4.406 . 0 0 "[ . 1 . 2]" 1
2163 1 107 TYR QE 1 108 HIS QB . . 5.500 5.180 4.691 5.500 . 7 0 "[ . 1 . 2]" 1
2164 1 107 TYR QE 1 111 SER QB . . 4.780 3.689 3.322 4.104 . 0 0 "[ . 1 . 2]" 1
2165 1 108 HIS H 1 108 HIS QB . . 2.920 2.309 2.119 2.446 . 0 0 "[ . 1 . 2]" 1
2166 1 108 HIS H 1 108 HIS HD2 . . 4.430 3.132 2.072 4.438 0.008 14 0 "[ . 1 . 2]" 1
2167 1 108 HIS H 1 109 TYR H . . 3.470 2.929 2.729 3.062 . 0 0 "[ . 1 . 2]" 1
2168 1 108 HIS H 1 110 PHE H . . 4.980 4.821 4.583 4.980 0.000 2 0 "[ . 1 . 2]" 1
2169 1 108 HIS HA 1 108 HIS HD2 . . 4.790 4.194 3.384 4.740 . 0 0 "[ . 1 . 2]" 1
2170 1 108 HIS HA 1 111 SER H . . 4.280 3.675 3.494 3.906 . 0 0 "[ . 1 . 2]" 1
2171 1 108 HIS QB 1 109 TYR H . . 3.040 2.326 2.218 2.797 . 0 0 "[ . 1 . 2]" 1
2172 1 109 TYR H 1 109 TYR HB2 . . 3.410 2.658 2.595 2.836 . 0 0 "[ . 1 . 2]" 1
2173 1 109 TYR H 1 109 TYR HB3 . . 3.190 2.441 2.271 2.535 . 0 0 "[ . 1 . 2]" 1
2174 1 109 TYR H 1 109 TYR QD . . 4.360 4.183 4.068 4.219 . 0 0 "[ . 1 . 2]" 1
2175 1 109 TYR H 1 110 PHE H . . 3.370 3.179 2.912 3.330 . 0 0 "[ . 1 . 2]" 1
2176 1 109 TYR H 1 110 PHE HB2 . . 5.120 4.962 4.651 5.109 . 0 0 "[ . 1 . 2]" 1
2177 1 109 TYR H 1 111 SER H . . 4.190 4.130 3.934 4.189 . 0 0 "[ . 1 . 2]" 1
2178 1 109 TYR HA 1 109 TYR QD . . 3.770 2.908 2.541 3.104 . 0 0 "[ . 1 . 2]" 1
2179 1 109 TYR HB2 1 110 PHE H . . 3.770 3.654 3.584 3.742 . 0 0 "[ . 1 . 2]" 1
2180 1 109 TYR HB3 1 110 PHE H . . 3.400 2.175 2.079 2.294 . 0 0 "[ . 1 . 2]" 1
2181 1 109 TYR HB3 1 111 SER H . . 4.720 4.628 4.508 4.711 . 0 0 "[ . 1 . 2]" 1
2182 1 109 TYR QD 1 110 PHE H . . 3.670 2.249 1.995 2.870 . 0 0 "[ . 1 . 2]" 1
2183 1 109 TYR QD 1 110 PHE HA . . 4.170 2.972 2.596 3.771 . 0 0 "[ . 1 . 2]" 1
2184 1 109 TYR QD 1 110 PHE QD . . 4.170 2.967 2.308 3.427 . 0 0 "[ . 1 . 2]" 1
2185 1 109 TYR QD 1 110 PHE QE . . 4.300 3.808 3.361 4.096 . 0 0 "[ . 1 . 2]" 1
2186 1 109 TYR QE 1 110 PHE H . . 4.970 4.418 4.078 4.706 . 0 0 "[ . 1 . 2]" 1
2187 1 109 TYR QE 1 110 PHE QD . . 4.210 3.757 3.361 4.105 . 0 0 "[ . 1 . 2]" 1
2188 1 109 TYR QE 1 110 PHE QE . . 3.790 3.529 3.033 3.763 . 0 0 "[ . 1 . 2]" 1
2189 1 109 TYR QE 1 113 MET ME . . 4.550 3.490 2.074 4.497 . 0 0 "[ . 1 . 2]" 1
2190 1 109 TYR QE 1 113 MET HG2 . . 5.440 4.859 4.244 5.357 . 0 0 "[ . 1 . 2]" 1
2191 1 109 TYR QE 1 113 MET QG . . 4.680 4.206 3.775 4.649 . 0 0 "[ . 1 . 2]" 1
2192 1 109 TYR QE 1 113 MET HG3 . . 5.440 4.691 4.065 5.393 . 0 0 "[ . 1 . 2]" 1
2193 1 110 PHE H 1 110 PHE HB2 . . 3.410 2.231 2.199 2.266 . 0 0 "[ . 1 . 2]" 1
2194 1 110 PHE H 1 110 PHE HB3 . . 3.560 3.523 3.504 3.543 . 0 0 "[ . 1 . 2]" 1
2195 1 110 PHE H 1 110 PHE QD . . 3.590 2.994 2.761 3.334 . 0 0 "[ . 1 . 2]" 1
2196 1 110 PHE H 1 110 PHE QE . . 5.100 4.856 4.724 4.943 . 0 0 "[ . 1 . 2]" 1
2197 1 110 PHE H 1 111 SER H . . 3.300 2.814 2.737 2.879 . 0 0 "[ . 1 . 2]" 1
2198 1 110 PHE H 1 112 LYS H . . 5.050 4.527 4.261 4.794 . 0 0 "[ . 1 . 2]" 1
2199 1 110 PHE H 1 112 LYS QG . . 5.340 5.142 4.877 5.331 . 0 0 "[ . 1 . 2]" 1
2200 1 110 PHE HA 1 110 PHE QD . . 3.320 2.497 2.072 2.697 . 0 0 "[ . 1 . 2]" 1
2201 1 110 PHE HA 1 110 PHE QE . . 4.940 4.317 4.157 4.396 . 0 0 "[ . 1 . 2]" 1
2202 1 110 PHE HA 1 112 LYS H . . 5.320 4.496 4.180 4.923 . 0 0 "[ . 1 . 2]" 1
2203 1 110 PHE HB2 1 111 SER H . . 3.960 2.832 2.758 2.981 . 0 0 "[ . 1 . 2]" 1
2204 1 110 PHE HB3 1 111 SER H . . 4.100 3.301 3.222 3.465 . 0 0 "[ . 1 . 2]" 1
2205 1 110 PHE QD 1 111 SER H . . 4.770 4.552 4.489 4.658 . 0 0 "[ . 1 . 2]" 1
2206 1 111 SER H 1 111 SER HB2 . . 3.650 2.550 2.230 3.541 . 0 0 "[ . 1 . 2]" 1
2207 1 111 SER H 1 111 SER QB . . 3.120 2.223 2.168 2.267 . 0 0 "[ . 1 . 2]" 1
2208 1 111 SER H 1 111 SER HB3 . . 3.650 2.754 2.190 3.554 . 0 0 "[ . 1 . 2]" 1
2209 1 111 SER H 1 112 LYS H . . 3.340 2.874 2.752 3.062 . 0 0 "[ . 1 . 2]" 1
2210 1 111 SER H 1 112 LYS HB2 . . 5.260 4.934 4.709 5.145 . 0 0 "[ . 1 . 2]" 1
2211 1 111 SER H 1 113 MET H . . 5.010 4.457 4.247 4.731 . 0 0 "[ . 1 . 2]" 1
2212 1 111 SER QB 1 112 LYS H . . 3.570 2.524 2.140 3.381 . 0 0 "[ . 1 . 2]" 1
2213 1 111 SER HB2 1 112 LYS H . . 4.160 3.558 2.569 3.926 . 0 0 "[ . 1 . 2]" 1
2214 1 111 SER HB3 1 112 LYS H . . 4.160 2.680 2.160 3.690 . 0 0 "[ . 1 . 2]" 1
2215 1 112 LYS H 1 112 LYS HB2 . . 3.480 2.583 2.383 2.722 . 0 0 "[ . 1 . 2]" 1
2216 1 112 LYS H 1 112 LYS HB3 . . 3.650 3.603 3.574 3.623 . 0 0 "[ . 1 . 2]" 1
2217 1 112 LYS H 1 112 LYS QD . . 4.380 3.964 3.462 4.381 0.001 12 0 "[ . 1 . 2]" 1
2218 1 112 LYS H 1 112 LYS QG . . 3.630 2.150 1.881 2.436 . 0 0 "[ . 1 . 2]" 1
2219 1 112 LYS H 1 113 MET H . . 3.510 2.994 2.809 3.112 . 0 0 "[ . 1 . 2]" 1
2220 1 112 LYS HA 1 112 LYS QD . . 4.020 3.206 1.989 4.021 0.001 20 0 "[ . 1 . 2]" 1
2221 1 112 LYS HA 1 112 LYS HG2 . . 4.080 2.584 2.318 2.933 . 0 0 "[ . 1 . 2]" 1
2222 1 112 LYS HA 1 112 LYS QG . . 3.440 2.523 2.265 2.835 . 0 0 "[ . 1 . 2]" 1
2223 1 112 LYS HA 1 112 LYS HG3 . . 4.080 3.549 3.190 3.814 . 0 0 "[ . 1 . 2]" 1
2224 1 112 LYS HB2 1 113 MET H . . 4.270 2.464 2.227 2.625 . 0 0 "[ . 1 . 2]" 1
2225 1 112 LYS HB2 1 113 MET HA . . 4.390 4.291 4.153 4.391 0.001 7 0 "[ . 1 . 2]" 1
2226 1 112 LYS HB3 1 113 MET H . . 4.140 3.466 3.233 3.703 . 0 0 "[ . 1 . 2]" 1
2227 1 112 LYS QG 1 113 MET H . . 4.420 4.004 3.880 4.146 . 0 0 "[ . 1 . 2]" 1
2228 1 113 MET H 1 113 MET HB2 . . 3.690 2.541 2.293 3.624 . 0 0 "[ . 1 . 2]" 1
2229 1 113 MET H 1 113 MET QB . . 3.150 2.453 2.266 2.705 . 0 0 "[ . 1 . 2]" 1
2230 1 113 MET H 1 113 MET HB3 . . 3.690 3.548 2.792 3.627 . 0 0 "[ . 1 . 2]" 1
2231 1 113 MET H 1 113 MET QG . . 3.650 2.305 1.933 3.477 . 0 0 "[ . 1 . 2]" 1
2232 1 113 MET H 1 114 LYS H . . 4.850 4.574 4.377 4.646 . 0 0 "[ . 1 . 2]" 1
2233 1 113 MET HA 1 113 MET QG . . 3.630 2.649 2.232 3.336 . 0 0 "[ . 1 . 2]" 1
2234 1 113 MET HA 1 114 LYS H . . 3.550 2.358 2.140 2.586 . 0 0 "[ . 1 . 2]" 1
2235 1 113 MET QB 1 114 LYS H . . 4.420 2.621 2.035 3.561 . 0 0 "[ . 1 . 2]" 1
2236 1 114 LYS H 1 114 LYS QB . . 3.580 2.757 2.142 3.315 . 0 0 "[ . 1 . 2]" 1
2237 1 114 LYS H 1 114 LYS QG . . 4.670 3.186 2.154 4.370 . 0 0 "[ . 1 . 2]" 1
2238 1 114 LYS HA 1 114 LYS QD . . 4.130 3.400 2.010 4.142 0.012 10 0 "[ . 1 . 2]" 1
2239 1 114 LYS HA 1 114 LYS QG . . 3.500 2.506 2.163 3.429 . 0 0 "[ . 1 . 2]" 1
2240 1 114 LYS HA 1 115 ALA H . . 3.470 2.530 2.145 2.884 . 0 0 "[ . 1 . 2]" 1
2241 1 114 LYS QB 1 115 ALA H . . 4.310 3.706 2.215 3.922 . 0 0 "[ . 1 . 2]" 1
2242 1 115 ALA H 1 115 ALA MB . . 3.380 2.555 2.038 2.892 . 0 0 "[ . 1 . 2]" 1
2243 1 115 ALA HA 1 116 LEU H . . 3.010 2.371 2.143 2.691 . 0 0 "[ . 1 . 2]" 1
2244 1 115 ALA HA 1 116 LEU QD . . 4.020 3.372 2.397 4.039 0.019 19 0 "[ . 1 . 2]" 1
2245 1 115 ALA MB 1 116 LEU H . . 3.560 2.718 2.098 3.712 0.152 19 0 "[ . 1 . 2]" 1
2246 1 115 ALA MB 1 116 LEU HA . . 4.770 4.261 3.777 4.715 . 0 0 "[ . 1 . 2]" 1
2247 1 115 ALA MB 1 116 LEU QD . . 4.160 3.527 2.389 4.160 . 0 0 "[ . 1 . 2]" 1
2248 1 116 LEU H 1 116 LEU HB2 . . 4.080 3.140 2.163 3.996 . 0 0 "[ . 1 . 2]" 1
2249 1 116 LEU H 1 116 LEU QB . . 3.540 2.551 2.143 3.341 . 0 0 "[ . 1 . 2]" 1
2250 1 116 LEU H 1 116 LEU HB3 . . 4.080 3.092 2.306 3.582 . 0 0 "[ . 1 . 2]" 1
2251 1 116 LEU H 1 116 LEU MD1 . . 5.480 3.477 1.886 4.128 . 0 0 "[ . 1 . 2]" 1
2252 1 116 LEU H 1 116 LEU QD . . 4.240 2.132 1.671 2.920 . 0 0 "[ . 1 . 2]" 1
2253 1 116 LEU H 1 116 LEU MD2 . . 5.480 2.408 1.827 4.316 . 0 0 "[ . 1 . 2]" 1
2254 1 116 LEU H 1 116 LEU HG . . 4.360 3.224 1.901 4.252 . 0 0 "[ . 1 . 2]" 1
2255 1 116 LEU HA 1 116 LEU QD . . 4.210 2.869 1.884 3.442 . 0 0 "[ . 1 . 2]" 1
2256 1 116 LEU HA 1 116 LEU HG . . 4.130 3.673 2.361 4.243 0.113 11 0 "[ . 1 . 2]" 1
2257 1 116 LEU HA 1 117 ALA MB . . 5.060 4.117 3.673 5.018 . 0 0 "[ . 1 . 2]" 1
2258 1 116 LEU HB2 1 117 ALA H . . 4.440 3.252 1.997 4.451 0.011 14 0 "[ . 1 . 2]" 1
2259 1 116 LEU HB3 1 117 ALA H . . 4.440 3.610 2.408 4.334 . 0 0 "[ . 1 . 2]" 1
2260 1 116 LEU QD 1 117 ALA H . . 4.770 3.424 1.910 4.520 . 0 0 "[ . 1 . 2]" 1
2261 1 116 LEU MD1 1 117 ALA H . . 5.500 3.891 1.914 5.152 . 0 0 "[ . 1 . 2]" 1
2262 1 116 LEU MD2 1 117 ALA H . . 5.500 4.291 2.431 5.003 . 0 0 "[ . 1 . 2]" 1
2263 1 117 ALA HA 1 118 VAL H . . 3.000 2.368 2.144 2.939 . 0 0 "[ . 1 . 2]" 1
2264 1 117 ALA MB 1 118 VAL H . . 3.610 2.841 2.055 3.652 0.042 8 0 "[ . 1 . 2]" 1
2265 1 117 ALA MB 1 118 VAL HA . . 4.580 4.173 3.816 4.507 . 0 0 "[ . 1 . 2]" 1
2266 1 118 VAL H 1 118 VAL HB . . 3.500 2.999 2.445 3.610 0.110 12 0 "[ . 1 . 2]" 1
2267 1 118 VAL H 1 118 VAL MG1 . . 3.970 2.696 1.881 3.950 . 0 0 "[ . 1 . 2]" 1
2268 1 118 VAL H 1 118 VAL QG . . 3.470 2.187 1.799 2.961 . 0 0 "[ . 1 . 2]" 1
2269 1 118 VAL H 1 118 VAL MG2 . . 3.970 3.101 1.868 3.951 . 0 0 "[ . 1 . 2]" 1
2270 1 118 VAL H 1 119 GLU H . . 4.580 4.365 3.335 4.591 0.011 8 0 "[ . 1 . 2]" 1
2271 1 118 VAL HA 1 118 VAL MG1 . . 3.700 2.753 2.053 3.203 . 0 0 "[ . 1 . 2]" 1
2272 1 118 VAL HA 1 118 VAL MG2 . . 3.700 2.536 2.198 3.189 . 0 0 "[ . 1 . 2]" 1
2273 1 118 VAL HA 1 119 GLU H . . 3.320 2.228 2.141 2.701 . 0 0 "[ . 1 . 2]" 1
2274 1 118 VAL QG 1 119 GLU H . . 4.190 2.522 1.905 3.743 . 0 0 "[ . 1 . 2]" 1
2275 1 118 VAL MG1 1 119 GLU H . . 4.970 3.438 1.910 4.331 . 0 0 "[ . 1 . 2]" 1
2276 1 118 VAL MG2 1 119 GLU H . . 4.970 3.119 1.954 4.234 . 0 0 "[ . 1 . 2]" 1
2277 1 119 GLU H 1 119 GLU HB2 . . 4.090 3.068 2.227 3.783 . 0 0 "[ . 1 . 2]" 1
2278 1 119 GLU H 1 119 GLU QB . . 3.510 2.631 2.203 3.305 . 0 0 "[ . 1 . 2]" 1
2279 1 119 GLU H 1 119 GLU HB3 . . 4.090 3.229 2.385 4.079 . 0 0 "[ . 1 . 2]" 1
2280 1 119 GLU H 1 119 GLU QG . . 4.610 2.919 1.973 4.352 . 0 0 "[ . 1 . 2]" 1
2281 1 121 LYS HA 1 121 LYS QD . . 4.480 3.545 2.013 4.439 . 0 0 "[ . 1 . 2]" 1
2282 1 121 LYS QB 1 121 LYS QE . . 3.860 2.836 1.972 3.732 . 0 0 "[ . 1 . 2]" 1
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