NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
417162 |
2dmc   |
10326 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2dmc
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 1952
_Distance_constraint_stats_list.Viol_count 411
_Distance_constraint_stats_list.Viol_total 88.578
_Distance_constraint_stats_list.Viol_max 0.175
_Distance_constraint_stats_list.Viol_rms 0.0024
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0108
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ILE 0.009 0.009 10 0 "[ . 1 . 2]"
1 9 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 LYS 0.227 0.084 8 0 "[ . 1 . 2]"
1 17 ILE 0.464 0.175 20 0 "[ . 1 . 2]"
1 18 THR 0.124 0.084 13 0 "[ . 1 . 2]"
1 19 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 ASP 0.008 0.007 2 0 "[ . 1 . 2]"
1 21 SER 0.164 0.051 2 0 "[ . 1 . 2]"
1 22 ARG 0.434 0.062 14 0 "[ . 1 . 2]"
1 23 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 SER 0.001 0.001 6 0 "[ . 1 . 2]"
1 26 GLN 0.019 0.007 2 0 "[ . 1 . 2]"
1 27 VAL 0.183 0.119 12 0 "[ . 1 . 2]"
1 28 LYS 0.264 0.119 12 0 "[ . 1 . 2]"
1 29 LEU 0.082 0.053 12 0 "[ . 1 . 2]"
1 30 GLY 0.003 0.003 17 0 "[ . 1 . 2]"
1 31 SER 0.003 0.002 16 0 "[ . 1 . 2]"
1 32 ALA 0.016 0.004 12 0 "[ . 1 . 2]"
1 33 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 PHE 0.007 0.006 10 0 "[ . 1 . 2]"
1 36 LEU 0.007 0.006 10 0 "[ . 1 . 2]"
1 37 LEU 0.003 0.002 19 0 "[ . 1 . 2]"
1 38 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ILE 0.000 0.000 17 0 "[ . 1 . 2]"
1 40 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 GLU 0.004 0.003 15 0 "[ . 1 . 2]"
1 42 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 LEU 0.726 0.105 16 0 "[ . 1 . 2]"
1 45 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 SER 0.004 0.003 4 0 "[ . 1 . 2]"
1 47 LEU 0.016 0.002 12 0 "[ . 1 . 2]"
1 48 THR 0.026 0.013 15 0 "[ . 1 . 2]"
1 49 ALA 0.011 0.009 9 0 "[ . 1 . 2]"
1 50 SER 0.043 0.013 13 0 "[ . 1 . 2]"
1 51 ILE 0.049 0.015 13 0 "[ . 1 . 2]"
1 52 LYS 0.402 0.031 9 0 "[ . 1 . 2]"
1 53 ALA 0.045 0.027 13 0 "[ . 1 . 2]"
1 54 PRO 0.354 0.036 18 0 "[ . 1 . 2]"
1 55 SER 0.008 0.007 3 0 "[ . 1 . 2]"
1 56 GLY 0.713 0.036 18 0 "[ . 1 . 2]"
1 57 ARG 0.021 0.008 9 0 "[ . 1 . 2]"
1 58 ASP 0.052 0.018 13 0 "[ . 1 . 2]"
1 59 GLU 0.054 0.027 13 0 "[ . 1 . 2]"
1 60 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 CYS 0.006 0.002 2 0 "[ . 1 . 2]"
1 62 LEU 0.020 0.007 18 0 "[ . 1 . 2]"
1 63 LEU 0.040 0.018 15 0 "[ . 1 . 2]"
1 64 LYS 0.249 0.035 19 0 "[ . 1 . 2]"
1 65 ARG 0.185 0.028 19 0 "[ . 1 . 2]"
1 66 LEU 0.190 0.093 19 0 "[ . 1 . 2]"
1 67 PRO 0.008 0.008 19 0 "[ . 1 . 2]"
1 68 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 HIS 0.185 0.039 19 0 "[ . 1 . 2]"
1 71 ILE 0.217 0.093 19 0 "[ . 1 . 2]"
1 72 GLY 0.014 0.004 13 0 "[ . 1 . 2]"
1 73 ILE 0.050 0.021 18 0 "[ . 1 . 2]"
1 74 SER 0.053 0.021 18 0 "[ . 1 . 2]"
1 75 PHE 0.030 0.009 8 0 "[ . 1 . 2]"
1 76 ILE 0.055 0.014 1 0 "[ . 1 . 2]"
1 77 PRO 0.019 0.014 1 0 "[ . 1 . 2]"
1 78 ARG 0.051 0.017 11 0 "[ . 1 . 2]"
1 79 GLU 0.073 0.063 8 0 "[ . 1 . 2]"
1 80 VAL 0.103 0.063 8 0 "[ . 1 . 2]"
1 81 GLY 0.024 0.008 4 0 "[ . 1 . 2]"
1 82 GLU 0.023 0.008 4 0 "[ . 1 . 2]"
1 83 HIS 0.010 0.005 4 0 "[ . 1 . 2]"
1 84 LEU 0.034 0.008 9 0 "[ . 1 . 2]"
1 85 VAL 0.031 0.010 20 0 "[ . 1 . 2]"
1 86 SER 0.063 0.015 16 0 "[ . 1 . 2]"
1 87 ILE 0.057 0.015 16 0 "[ . 1 . 2]"
1 88 LYS 0.076 0.020 16 0 "[ . 1 . 2]"
1 89 LYS 0.020 0.005 18 0 "[ . 1 . 2]"
1 90 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 ASN 0.007 0.004 11 0 "[ . 1 . 2]"
1 93 HIS 0.009 0.004 11 0 "[ . 1 . 2]"
1 94 VAL 0.025 0.006 12 0 "[ . 1 . 2]"
1 95 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 SER 0.053 0.015 16 0 "[ . 1 . 2]"
1 98 PRO 0.018 0.006 16 0 "[ . 1 . 2]"
1 99 VAL 0.029 0.010 20 0 "[ . 1 . 2]"
1 100 SER 0.000 0.000 6 0 "[ . 1 . 2]"
1 101 ILE 0.003 0.003 6 0 "[ . 1 . 2]"
1 102 MET 0.020 0.006 4 0 "[ . 1 . 2]"
1 103 VAL 0.040 0.007 13 0 "[ . 1 . 2]"
1 104 VAL 0.003 0.003 14 0 "[ . 1 . 2]"
1 105 GLN 0.022 0.007 12 0 "[ . 1 . 2]"
1 106 SER 0.007 0.007 12 0 "[ . 1 . 2]"
1 107 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 ILE 0.127 0.070 10 0 "[ . 1 . 2]"
1 109 GLY 0.070 0.070 10 0 "[ . 1 . 2]"
1 110 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 7 GLY QA 1 8 ILE H . . 3.220 2.268 2.110 2.575 . 0 0 "[ . 1 . 2]" 1
2 1 7 GLY QA 1 8 ILE MG . . 4.630 3.821 3.576 4.156 . 0 0 "[ . 1 . 2]" 1
3 1 8 ILE H 1 8 ILE HB . . 3.660 3.619 3.593 3.669 0.009 10 0 "[ . 1 . 2]" 1
4 1 8 ILE H 1 8 ILE MD . . 5.170 3.322 1.819 3.954 . 0 0 "[ . 1 . 2]" 1
5 1 8 ILE H 1 8 ILE HG12 . . 3.970 2.791 1.922 3.816 . 0 0 "[ . 1 . 2]" 1
6 1 8 ILE H 1 8 ILE HG13 . . 3.970 2.786 1.901 3.842 . 0 0 "[ . 1 . 2]" 1
7 1 8 ILE H 1 8 ILE MG . . 4.690 2.282 1.877 2.586 . 0 0 "[ . 1 . 2]" 1
8 1 8 ILE HA 1 8 ILE QG . . 3.590 3.362 3.261 3.482 . 0 0 "[ . 1 . 2]" 1
9 1 8 ILE HA 1 8 ILE MG . . 3.690 2.308 2.146 2.452 . 0 0 "[ . 1 . 2]" 1
10 1 8 ILE HA 1 9 PRO HD2 . . 3.270 2.296 2.226 2.359 . 0 0 "[ . 1 . 2]" 1
11 1 8 ILE HA 1 9 PRO QD . . 2.730 2.033 1.996 2.067 . 0 0 "[ . 1 . 2]" 1
12 1 8 ILE HA 1 9 PRO HD3 . . 3.270 2.269 2.256 2.285 . 0 0 "[ . 1 . 2]" 1
13 1 8 ILE HB 1 8 ILE MD . . 3.560 2.418 2.084 3.229 . 0 0 "[ . 1 . 2]" 1
14 1 8 ILE HB 1 9 PRO HD2 . . 4.270 2.181 2.027 2.437 . 0 0 "[ . 1 . 2]" 1
15 1 8 ILE HB 1 9 PRO QD . . 3.570 2.163 2.014 2.410 . 0 0 "[ . 1 . 2]" 1
16 1 8 ILE HB 1 9 PRO HD3 . . 4.270 3.604 3.471 3.809 . 0 0 "[ . 1 . 2]" 1
17 1 8 ILE MG 1 9 PRO QD . . 3.670 3.026 2.528 3.307 . 0 0 "[ . 1 . 2]" 1
18 1 9 PRO QB 1 10 GLY QA . . 5.120 3.915 3.508 4.399 . 0 0 "[ . 1 . 2]" 1
19 1 13 PHE H 1 13 PHE QB . . 3.680 2.480 2.157 3.022 . 0 0 "[ . 1 . 2]" 1
20 1 13 PHE HA 1 13 PHE QD . . 4.130 2.731 2.064 3.712 . 0 0 "[ . 1 . 2]" 1
21 1 14 THR HA 1 14 THR MG . . 3.530 2.469 2.210 3.205 . 0 0 "[ . 1 . 2]" 1
22 1 14 THR HB 1 15 ALA H . . 4.940 3.545 1.914 4.446 . 0 0 "[ . 1 . 2]" 1
23 1 14 THR MG 1 15 ALA H . . 4.480 3.305 2.035 4.217 . 0 0 "[ . 1 . 2]" 1
24 1 15 ALA HA 1 16 LYS H . . 3.310 2.292 2.140 3.302 . 0 0 "[ . 1 . 2]" 1
25 1 15 ALA MB 1 16 LYS H . . 4.230 3.005 2.282 3.552 . 0 0 "[ . 1 . 2]" 1
26 1 15 ALA MB 1 17 ILE H . . 5.500 4.431 2.704 5.499 . 0 0 "[ . 1 . 2]" 1
27 1 16 LYS H 1 16 LYS QB . . 3.580 2.548 2.287 3.147 . 0 0 "[ . 1 . 2]" 1
28 1 16 LYS H 1 16 LYS QG . . 4.350 3.140 1.888 4.339 . 0 0 "[ . 1 . 2]" 1
29 1 16 LYS HA 1 16 LYS QD . . 4.830 3.701 2.340 4.379 . 0 0 "[ . 1 . 2]" 1
30 1 16 LYS HA 1 16 LYS HG2 . . 4.090 3.003 2.190 4.149 0.059 15 0 "[ . 1 . 2]" 1
31 1 16 LYS HA 1 16 LYS QG . . 3.560 2.628 2.142 3.380 . 0 0 "[ . 1 . 2]" 1
32 1 16 LYS HA 1 16 LYS HG3 . . 4.090 3.201 2.178 4.174 0.084 8 0 "[ . 1 . 2]" 1
33 1 16 LYS QB 1 17 ILE H . . 3.700 3.097 2.206 3.689 . 0 0 "[ . 1 . 2]" 1
34 1 16 LYS HB2 1 17 ILE H . . 4.510 3.621 2.416 4.500 . 0 0 "[ . 1 . 2]" 1
35 1 16 LYS HB3 1 17 ILE H . . 4.510 3.654 2.228 4.340 . 0 0 "[ . 1 . 2]" 1
36 1 16 LYS QE 1 16 LYS QG . . 3.300 2.270 2.062 2.630 . 0 0 "[ . 1 . 2]" 1
37 1 16 LYS QG 1 17 ILE H . . 4.540 3.580 2.082 4.532 . 0 0 "[ . 1 . 2]" 1
38 1 17 ILE H 1 17 ILE HB . . 3.720 3.102 2.341 3.686 . 0 0 "[ . 1 . 2]" 1
39 1 17 ILE H 1 17 ILE HG12 . . 4.380 3.129 1.927 4.270 . 0 0 "[ . 1 . 2]" 1
40 1 17 ILE H 1 17 ILE QG . . 3.810 2.623 1.889 3.870 0.060 16 0 "[ . 1 . 2]" 1
41 1 17 ILE H 1 17 ILE HG13 . . 4.380 3.215 1.934 4.431 0.051 16 0 "[ . 1 . 2]" 1
42 1 17 ILE H 1 17 ILE MG . . 4.110 2.929 1.819 3.930 . 0 0 "[ . 1 . 2]" 1
43 1 17 ILE H 1 18 THR H . . 4.970 3.895 2.082 4.632 . 0 0 "[ . 1 . 2]" 1
44 1 17 ILE HA 1 17 ILE HG12 . . 4.020 3.390 2.478 4.195 0.175 20 0 "[ . 1 . 2]" 1
45 1 17 ILE HA 1 17 ILE QG . . 3.460 2.867 2.208 3.375 . 0 0 "[ . 1 . 2]" 1
46 1 17 ILE HA 1 17 ILE HG13 . . 4.020 3.229 2.231 3.680 . 0 0 "[ . 1 . 2]" 1
47 1 17 ILE HA 1 17 ILE MG . . 3.410 2.436 2.228 3.160 . 0 0 "[ . 1 . 2]" 1
48 1 17 ILE HA 1 18 THR H . . 3.440 2.565 2.140 3.524 0.084 13 0 "[ . 1 . 2]" 1
49 1 17 ILE HB 1 18 THR H . . 4.790 3.611 2.229 4.439 . 0 0 "[ . 1 . 2]" 1
50 1 17 ILE QG 1 17 ILE MG . . 3.090 2.191 2.056 2.350 . 0 0 "[ . 1 . 2]" 1
51 1 17 ILE QG 1 18 THR H . . 4.390 3.631 2.350 4.375 . 0 0 "[ . 1 . 2]" 1
52 1 17 ILE HG12 1 17 ILE MG . . 3.570 2.340 2.085 3.196 . 0 0 "[ . 1 . 2]" 1
53 1 17 ILE HG12 1 18 THR H . . 5.030 4.425 3.012 5.045 0.015 13 0 "[ . 1 . 2]" 1
54 1 17 ILE HG13 1 17 ILE MG . . 3.570 3.001 2.238 3.202 . 0 0 "[ . 1 . 2]" 1
55 1 17 ILE HG13 1 18 THR H . . 5.030 3.967 2.403 5.002 . 0 0 "[ . 1 . 2]" 1
56 1 17 ILE MG 1 18 THR H . . 4.500 3.369 2.010 4.356 . 0 0 "[ . 1 . 2]" 1
57 1 18 THR H 1 18 THR MG . . 4.740 3.123 2.013 4.024 . 0 0 "[ . 1 . 2]" 1
58 1 18 THR H 1 19 ASP H . . 5.330 4.194 2.824 4.644 . 0 0 "[ . 1 . 2]" 1
59 1 18 THR HA 1 18 THR MG . . 3.200 2.463 2.063 3.200 0.000 11 0 "[ . 1 . 2]" 1
60 1 18 THR HA 1 19 ASP HA . . 4.560 4.407 4.299 4.483 . 0 0 "[ . 1 . 2]" 1
61 1 18 THR HB 1 19 ASP H . . 4.240 3.770 2.532 4.237 . 0 0 "[ . 1 . 2]" 1
62 1 18 THR MG 1 19 ASP H . . 4.640 3.458 2.080 4.215 . 0 0 "[ . 1 . 2]" 1
63 1 19 ASP QB 1 20 ASP H . . 4.200 2.925 2.045 3.893 . 0 0 "[ . 1 . 2]" 1
64 1 20 ASP H 1 20 ASP QB . . 3.640 2.597 2.208 2.875 . 0 0 "[ . 1 . 2]" 1
65 1 20 ASP HA 1 22 ARG H . . 4.750 4.302 3.336 4.757 0.007 2 0 "[ . 1 . 2]" 1
66 1 20 ASP QB 1 22 ARG QB . . 4.170 3.360 2.757 4.168 . 0 0 "[ . 1 . 2]" 1
67 1 20 ASP QB 1 22 ARG QG . . 4.010 2.441 1.917 3.783 . 0 0 "[ . 1 . 2]" 1
68 1 20 ASP HB2 1 21 SER H . . 4.710 3.354 2.281 4.362 . 0 0 "[ . 1 . 2]" 1
69 1 20 ASP HB2 1 22 ARG H . . 5.440 3.127 2.483 4.015 . 0 0 "[ . 1 . 2]" 1
70 1 20 ASP HB2 1 22 ARG HB2 . . 5.500 4.270 3.192 5.499 . 0 0 "[ . 1 . 2]" 1
71 1 20 ASP HB2 1 22 ARG HB3 . . 5.500 4.878 3.682 5.493 . 0 0 "[ . 1 . 2]" 1
72 1 20 ASP HB2 1 22 ARG HG2 . . 5.150 3.578 2.240 4.824 . 0 0 "[ . 1 . 2]" 1
73 1 20 ASP HB2 1 22 ARG HG3 . . 5.150 3.610 2.709 4.566 . 0 0 "[ . 1 . 2]" 1
74 1 20 ASP HB3 1 21 SER H . . 4.710 3.172 2.092 4.109 . 0 0 "[ . 1 . 2]" 1
75 1 20 ASP HB3 1 22 ARG H . . 5.440 3.301 2.576 4.625 . 0 0 "[ . 1 . 2]" 1
76 1 20 ASP HB3 1 22 ARG HB2 . . 5.500 4.399 3.022 5.501 0.001 17 0 "[ . 1 . 2]" 1
77 1 20 ASP HB3 1 22 ARG HB3 . . 5.500 4.666 3.236 5.411 . 0 0 "[ . 1 . 2]" 1
78 1 20 ASP HB3 1 22 ARG HG2 . . 5.150 3.272 2.016 4.982 . 0 0 "[ . 1 . 2]" 1
79 1 20 ASP HB3 1 22 ARG HG3 . . 5.150 3.466 2.003 5.128 . 0 0 "[ . 1 . 2]" 1
80 1 21 SER H 1 21 SER QB . . 3.620 2.611 2.216 3.292 . 0 0 "[ . 1 . 2]" 1
81 1 21 SER H 1 22 ARG H . . 4.540 2.955 2.507 3.976 . 0 0 "[ . 1 . 2]" 1
82 1 21 SER HB2 1 22 ARG H . . 4.510 4.269 3.059 4.561 0.051 2 0 "[ . 1 . 2]" 1
83 1 21 SER HB3 1 22 ARG H . . 4.510 4.186 2.524 4.548 0.038 2 0 "[ . 1 . 2]" 1
84 1 22 ARG H 1 22 ARG HB2 . . 3.900 2.884 2.236 3.777 . 0 0 "[ . 1 . 2]" 1
85 1 22 ARG H 1 22 ARG QB . . 3.310 2.530 2.212 3.018 . 0 0 "[ . 1 . 2]" 1
86 1 22 ARG H 1 22 ARG HB3 . . 3.900 3.331 2.508 3.752 . 0 0 "[ . 1 . 2]" 1
87 1 22 ARG H 1 22 ARG HG2 . . 3.940 2.748 1.927 3.942 0.002 19 0 "[ . 1 . 2]" 1
88 1 22 ARG H 1 22 ARG HG3 . . 3.940 3.221 2.220 3.941 0.001 6 0 "[ . 1 . 2]" 1
89 1 22 ARG HA 1 22 ARG QD . . 4.580 3.493 2.091 4.557 . 0 0 "[ . 1 . 2]" 1
90 1 22 ARG HA 1 22 ARG QG . . 3.350 2.822 2.223 3.412 0.062 14 0 "[ . 1 . 2]" 1
91 1 22 ARG QB 1 23 ARG H . . 4.070 2.525 2.016 4.043 . 0 0 "[ . 1 . 2]" 1
92 1 22 ARG HB2 1 22 ARG QD . . 3.350 2.846 2.246 3.398 0.048 10 0 "[ . 1 . 2]" 1
93 1 22 ARG HB3 1 22 ARG QD . . 3.350 2.483 2.118 3.368 0.018 17 0 "[ . 1 . 2]" 1
94 1 22 ARG QG 1 23 ARG H . . 4.560 3.774 2.085 4.302 . 0 0 "[ . 1 . 2]" 1
95 1 22 ARG HG2 1 23 ARG H . . 5.200 4.240 2.228 4.918 . 0 0 "[ . 1 . 2]" 1
96 1 22 ARG HG3 1 23 ARG H . . 5.200 4.382 2.509 5.152 . 0 0 "[ . 1 . 2]" 1
97 1 23 ARG H 1 23 ARG QB . . 3.270 2.470 2.242 3.074 . 0 0 "[ . 1 . 2]" 1
98 1 23 ARG H 1 23 ARG HG2 . . 5.480 3.841 1.975 4.844 . 0 0 "[ . 1 . 2]" 1
99 1 23 ARG H 1 23 ARG QG . . 4.830 3.319 1.962 4.219 . 0 0 "[ . 1 . 2]" 1
100 1 23 ARG H 1 23 ARG HG3 . . 5.480 3.892 2.717 4.826 . 0 0 "[ . 1 . 2]" 1
101 1 23 ARG HA 1 23 ARG QD . . 4.940 3.201 2.033 4.411 . 0 0 "[ . 1 . 2]" 1
102 1 23 ARG HA 1 23 ARG QG . . 3.500 2.675 2.220 3.434 . 0 0 "[ . 1 . 2]" 1
103 1 23 ARG QB 1 23 ARG QD . . 3.160 2.238 2.028 2.559 . 0 0 "[ . 1 . 2]" 1
104 1 24 CYS HA 1 102 MET HB2 . . 5.040 4.208 2.687 5.013 . 0 0 "[ . 1 . 2]" 1
105 1 24 CYS HA 1 102 MET HB3 . . 5.040 3.657 2.268 4.824 . 0 0 "[ . 1 . 2]" 1
106 1 24 CYS QB 1 25 SER H . . 5.070 2.928 2.256 3.871 . 0 0 "[ . 1 . 2]" 1
107 1 24 CYS QB 1 102 MET HB2 . . 5.160 4.362 3.388 5.086 . 0 0 "[ . 1 . 2]" 1
108 1 24 CYS QB 1 102 MET QB . . 4.300 3.497 2.406 4.151 . 0 0 "[ . 1 . 2]" 1
109 1 24 CYS QB 1 102 MET HB3 . . 5.160 3.689 2.462 4.401 . 0 0 "[ . 1 . 2]" 1
110 1 24 CYS QB 1 102 MET HG2 . . 4.900 2.625 2.000 3.475 . 0 0 "[ . 1 . 2]" 1
111 1 24 CYS QB 1 102 MET QG . . 4.050 2.570 1.990 3.335 . 0 0 "[ . 1 . 2]" 1
112 1 24 CYS QB 1 102 MET HG3 . . 4.900 3.889 3.205 4.872 . 0 0 "[ . 1 . 2]" 1
113 1 25 SER H 1 26 GLN H . . 5.070 4.472 4.038 4.614 . 0 0 "[ . 1 . 2]" 1
114 1 25 SER HA 1 26 GLN H . . 3.140 2.210 2.140 2.362 . 0 0 "[ . 1 . 2]" 1
115 1 25 SER HA 1 26 GLN HA . . 4.590 4.391 4.355 4.449 . 0 0 "[ . 1 . 2]" 1
116 1 25 SER HA 1 26 GLN QB . . 4.520 4.017 3.911 4.165 . 0 0 "[ . 1 . 2]" 1
117 1 25 SER QB 1 26 GLN H . . 3.960 3.129 2.575 3.958 . 0 0 "[ . 1 . 2]" 1
118 1 25 SER QB 1 27 VAL MG2 . . 3.810 3.082 2.852 3.404 . 0 0 "[ . 1 . 2]" 1
119 1 25 SER QB 1 35 PHE QE . . 4.840 3.911 3.278 4.574 . 0 0 "[ . 1 . 2]" 1
120 1 25 SER QB 1 101 ILE MG . . 4.490 3.412 2.882 3.861 . 0 0 "[ . 1 . 2]" 1
121 1 25 SER QB 1 103 VAL MG2 . . 5.500 5.120 4.644 5.501 0.001 6 0 "[ . 1 . 2]" 1
122 1 26 GLN H 1 26 GLN QB . . 3.390 2.361 2.178 2.570 . 0 0 "[ . 1 . 2]" 1
123 1 26 GLN H 1 26 GLN HG2 . . 4.800 4.553 4.360 4.707 . 0 0 "[ . 1 . 2]" 1
124 1 26 GLN H 1 26 GLN QG . . 4.130 3.993 3.191 4.137 0.007 2 0 "[ . 1 . 2]" 1
125 1 26 GLN H 1 26 GLN HG3 . . 4.800 4.455 3.277 4.782 . 0 0 "[ . 1 . 2]" 1
126 1 26 GLN H 1 27 VAL H . . 4.670 4.432 4.207 4.586 . 0 0 "[ . 1 . 2]" 1
127 1 26 GLN HA 1 26 GLN HG2 . . 4.210 2.893 2.213 3.419 . 0 0 "[ . 1 . 2]" 1
128 1 26 GLN HA 1 26 GLN QG . . 3.700 2.291 2.147 2.474 . 0 0 "[ . 1 . 2]" 1
129 1 26 GLN HA 1 26 GLN HG3 . . 4.210 2.639 2.184 3.656 . 0 0 "[ . 1 . 2]" 1
130 1 26 GLN HA 1 27 VAL H . . 3.080 2.155 2.139 2.193 . 0 0 "[ . 1 . 2]" 1
131 1 26 GLN HA 1 27 VAL MG2 . . 4.460 3.422 3.216 3.645 . 0 0 "[ . 1 . 2]" 1
132 1 26 GLN HA 1 104 VAL H . . 4.550 3.830 3.384 4.264 . 0 0 "[ . 1 . 2]" 1
133 1 26 GLN HA 1 104 VAL MG2 . . 4.390 2.154 1.810 2.661 . 0 0 "[ . 1 . 2]" 1
134 1 26 GLN QB 1 26 GLN HE22 . . 4.900 4.002 3.326 4.390 . 0 0 "[ . 1 . 2]" 1
135 1 26 GLN QB 1 27 VAL H . . 3.840 3.697 3.357 3.843 0.003 16 0 "[ . 1 . 2]" 1
136 1 26 GLN QB 1 104 VAL MG2 . . 3.700 3.347 2.789 3.607 . 0 0 "[ . 1 . 2]" 1
137 1 26 GLN HE21 1 104 VAL MG2 . . 4.840 3.136 2.244 3.947 . 0 0 "[ . 1 . 2]" 1
138 1 26 GLN HE21 1 106 SER HA . . 5.430 3.125 2.050 4.835 . 0 0 "[ . 1 . 2]" 1
139 1 26 GLN HE22 1 104 VAL MG2 . . 4.840 4.344 3.724 4.831 . 0 0 "[ . 1 . 2]" 1
140 1 26 GLN HE22 1 106 SER HA . . 5.430 3.894 2.971 4.824 . 0 0 "[ . 1 . 2]" 1
141 1 26 GLN QG 1 104 VAL MG1 . . 4.510 4.330 4.018 4.509 . 0 0 "[ . 1 . 2]" 1
142 1 26 GLN QG 1 104 VAL MG2 . . 3.150 2.133 1.880 2.422 . 0 0 "[ . 1 . 2]" 1
143 1 26 GLN QG 1 106 SER HA . . 4.470 3.787 2.998 4.412 . 0 0 "[ . 1 . 2]" 1
144 1 26 GLN QG 1 106 SER QB . . 5.180 3.323 1.883 5.042 . 0 0 "[ . 1 . 2]" 1
145 1 26 GLN HG2 1 27 VAL H . . 4.630 3.257 2.505 4.172 . 0 0 "[ . 1 . 2]" 1
146 1 26 GLN HG2 1 104 VAL MG2 . . 3.800 2.988 2.121 3.738 . 0 0 "[ . 1 . 2]" 1
147 1 26 GLN HG2 1 106 SER HA . . 5.160 4.256 3.029 4.918 . 0 0 "[ . 1 . 2]" 1
148 1 26 GLN HG3 1 27 VAL H . . 4.630 3.581 2.697 4.622 . 0 0 "[ . 1 . 2]" 1
149 1 26 GLN HG3 1 104 VAL MG2 . . 3.800 2.453 1.898 3.792 . 0 0 "[ . 1 . 2]" 1
150 1 26 GLN HG3 1 106 SER HA . . 5.160 4.351 3.561 5.067 . 0 0 "[ . 1 . 2]" 1
151 1 27 VAL H 1 27 VAL HB . . 3.580 2.898 2.733 3.041 . 0 0 "[ . 1 . 2]" 1
152 1 27 VAL H 1 27 VAL MG1 . . 4.390 3.944 3.890 4.002 . 0 0 "[ . 1 . 2]" 1
153 1 27 VAL H 1 27 VAL MG2 . . 3.450 2.631 2.210 2.959 . 0 0 "[ . 1 . 2]" 1
154 1 27 VAL H 1 28 LYS H . . 4.510 4.445 4.374 4.500 . 0 0 "[ . 1 . 2]" 1
155 1 27 VAL H 1 103 VAL HA . . 4.110 3.726 3.205 4.106 . 0 0 "[ . 1 . 2]" 1
156 1 27 VAL H 1 104 VAL H . . 3.980 2.767 2.525 3.000 . 0 0 "[ . 1 . 2]" 1
157 1 27 VAL H 1 104 VAL MG2 . . 3.690 2.399 1.870 3.247 . 0 0 "[ . 1 . 2]" 1
158 1 27 VAL HA 1 27 VAL MG1 . . 3.240 2.197 2.040 2.338 . 0 0 "[ . 1 . 2]" 1
159 1 27 VAL HA 1 27 VAL MG2 . . 3.460 2.514 2.356 2.654 . 0 0 "[ . 1 . 2]" 1
160 1 27 VAL HA 1 28 LYS H . . 2.840 2.329 2.262 2.437 . 0 0 "[ . 1 . 2]" 1
161 1 27 VAL HA 1 28 LYS QD . . 4.530 4.128 2.610 4.590 0.060 16 0 "[ . 1 . 2]" 1
162 1 27 VAL HA 1 28 LYS QG . . 4.700 3.662 3.198 4.819 0.119 12 0 "[ . 1 . 2]" 1
163 1 27 VAL HA 1 33 ALA MB . . 3.830 3.611 3.402 3.801 . 0 0 "[ . 1 . 2]" 1
164 1 27 VAL HB 1 28 LYS H . . 3.650 3.522 3.282 3.638 . 0 0 "[ . 1 . 2]" 1
165 1 27 VAL HB 1 33 ALA MB . . 4.630 4.194 3.982 4.405 . 0 0 "[ . 1 . 2]" 1
166 1 27 VAL HB 1 77 PRO HG3 . . 4.560 3.538 2.849 3.959 . 0 0 "[ . 1 . 2]" 1
167 1 27 VAL HB 1 103 VAL HA . . 4.710 3.109 2.616 3.549 . 0 0 "[ . 1 . 2]" 1
168 1 27 VAL HB 1 103 VAL MG1 . . 4.130 2.443 2.080 2.677 . 0 0 "[ . 1 . 2]" 1
169 1 27 VAL HB 1 103 VAL MG2 . . 4.070 3.232 2.629 3.578 . 0 0 "[ . 1 . 2]" 1
170 1 27 VAL HB 1 104 VAL H . . 4.480 3.341 2.732 3.802 . 0 0 "[ . 1 . 2]" 1
171 1 27 VAL MG1 1 28 LYS H . . 3.430 1.960 1.814 2.215 . 0 0 "[ . 1 . 2]" 1
172 1 27 VAL MG1 1 31 SER H . . 5.240 4.809 4.501 5.129 . 0 0 "[ . 1 . 2]" 1
173 1 27 VAL MG1 1 33 ALA H . . 4.570 4.022 3.549 4.428 . 0 0 "[ . 1 . 2]" 1
174 1 27 VAL MG1 1 33 ALA HA . . 4.640 4.135 3.901 4.335 . 0 0 "[ . 1 . 2]" 1
175 1 27 VAL MG1 1 33 ALA MB . . 3.200 1.863 1.725 1.992 . 0 0 "[ . 1 . 2]" 1
176 1 27 VAL MG1 1 34 ASP H . . 5.250 4.863 4.579 5.056 . 0 0 "[ . 1 . 2]" 1
177 1 27 VAL MG1 1 35 PHE QE . . 4.250 3.024 2.720 3.327 . 0 0 "[ . 1 . 2]" 1
178 1 27 VAL MG1 1 35 PHE HZ . . 3.810 2.156 1.892 2.580 . 0 0 "[ . 1 . 2]" 1
179 1 27 VAL MG1 1 75 PHE QE . . 4.990 4.491 4.272 4.708 . 0 0 "[ . 1 . 2]" 1
180 1 27 VAL MG1 1 75 PHE HZ . . 4.710 4.560 4.251 4.709 . 0 0 "[ . 1 . 2]" 1
181 1 27 VAL MG1 1 77 PRO HD2 . . 4.680 3.731 3.389 4.035 . 0 0 "[ . 1 . 2]" 1
182 1 27 VAL MG1 1 77 PRO QD . . 4.090 3.274 3.019 3.556 . 0 0 "[ . 1 . 2]" 1
183 1 27 VAL MG1 1 77 PRO HD3 . . 4.680 3.630 3.338 3.973 . 0 0 "[ . 1 . 2]" 1
184 1 27 VAL MG1 1 77 PRO HG2 . . 3.600 3.192 2.868 3.586 . 0 0 "[ . 1 . 2]" 1
185 1 27 VAL MG1 1 77 PRO HG3 . . 2.860 2.386 2.048 2.780 . 0 0 "[ . 1 . 2]" 1
186 1 27 VAL MG2 1 28 LYS H . . 4.140 3.978 3.824 4.128 . 0 0 "[ . 1 . 2]" 1
187 1 27 VAL MG2 1 35 PHE QD . . 4.340 3.883 3.447 4.184 . 0 0 "[ . 1 . 2]" 1
188 1 27 VAL MG2 1 35 PHE QE . . 4.070 2.134 1.852 2.436 . 0 0 "[ . 1 . 2]" 1
189 1 27 VAL MG2 1 35 PHE HZ . . 4.100 2.486 2.067 3.371 . 0 0 "[ . 1 . 2]" 1
190 1 27 VAL MG2 1 75 PHE QE . . 5.500 4.841 4.484 5.167 . 0 0 "[ . 1 . 2]" 1
191 1 27 VAL MG2 1 101 ILE MG . . 3.480 3.056 2.716 3.395 . 0 0 "[ . 1 . 2]" 1
192 1 27 VAL MG2 1 103 VAL HA . . 4.040 2.666 1.991 3.104 . 0 0 "[ . 1 . 2]" 1
193 1 27 VAL MG2 1 104 VAL H . . 4.240 3.535 2.792 4.212 . 0 0 "[ . 1 . 2]" 1
194 1 28 LYS H 1 28 LYS HB2 . . 3.320 2.541 2.384 2.837 . 0 0 "[ . 1 . 2]" 1
195 1 28 LYS H 1 28 LYS HB3 . . 3.660 3.649 3.615 3.664 0.004 20 0 "[ . 1 . 2]" 1
196 1 28 LYS H 1 28 LYS QD . . 4.350 3.395 2.031 3.833 . 0 0 "[ . 1 . 2]" 1
197 1 28 LYS H 1 28 LYS QG . . 3.720 2.490 1.886 3.699 . 0 0 "[ . 1 . 2]" 1
198 1 28 LYS H 1 33 ALA MB . . 5.060 3.005 2.750 3.215 . 0 0 "[ . 1 . 2]" 1
199 1 28 LYS HA 1 28 LYS QD . . 4.130 2.319 2.011 2.967 . 0 0 "[ . 1 . 2]" 1
200 1 28 LYS HA 1 28 LYS QG . . 3.940 2.904 2.458 3.115 . 0 0 "[ . 1 . 2]" 1
201 1 28 LYS HA 1 29 LEU H . . 2.890 2.157 2.140 2.196 . 0 0 "[ . 1 . 2]" 1
202 1 28 LYS HA 1 29 LEU QB . . 4.170 4.045 3.985 4.085 . 0 0 "[ . 1 . 2]" 1
203 1 28 LYS HB2 1 28 LYS QE . . 4.740 4.047 2.092 4.509 . 0 0 "[ . 1 . 2]" 1
204 1 28 LYS HB2 1 29 LEU H . . 4.430 4.264 3.775 4.423 . 0 0 "[ . 1 . 2]" 1
205 1 28 LYS HB2 1 31 SER H . . 4.640 4.226 3.490 4.504 . 0 0 "[ . 1 . 2]" 1
206 1 28 LYS HB2 1 31 SER QB . . 3.440 2.358 2.063 3.441 0.001 10 0 "[ . 1 . 2]" 1
207 1 28 LYS HB3 1 28 LYS QE . . 4.890 3.544 2.011 4.478 . 0 0 "[ . 1 . 2]" 1
208 1 28 LYS HB3 1 29 LEU H . . 3.930 3.526 3.073 3.875 . 0 0 "[ . 1 . 2]" 1
209 1 28 LYS HB3 1 31 SER H . . 5.050 4.646 4.094 4.933 . 0 0 "[ . 1 . 2]" 1
210 1 28 LYS HB3 1 31 SER QB . . 3.320 2.826 2.494 3.322 0.002 16 0 "[ . 1 . 2]" 1
211 1 28 LYS QD 1 29 LEU H . . 4.480 4.034 3.675 4.533 0.053 12 0 "[ . 1 . 2]" 1
212 1 28 LYS QD 1 106 SER H . . 4.470 4.041 3.571 4.470 . 12 0 "[ . 1 . 2]" 1
213 1 28 LYS QD 1 106 SER HB2 . . 5.170 3.352 2.193 4.562 . 0 0 "[ . 1 . 2]" 1
214 1 28 LYS QD 1 106 SER QB . . 4.350 2.760 2.023 3.876 . 0 0 "[ . 1 . 2]" 1
215 1 28 LYS QD 1 106 SER HB3 . . 5.170 3.176 2.081 4.613 . 0 0 "[ . 1 . 2]" 1
216 1 28 LYS QE 1 28 LYS QG . . 3.330 2.309 2.115 2.671 . 0 0 "[ . 1 . 2]" 1
217 1 29 LEU H 1 29 LEU QB . . 2.890 2.192 2.135 2.267 . 0 0 "[ . 1 . 2]" 1
218 1 29 LEU H 1 29 LEU MD1 . . 4.140 3.779 3.554 4.062 . 0 0 "[ . 1 . 2]" 1
219 1 29 LEU H 1 29 LEU MD2 . . 4.510 4.241 4.175 4.320 . 0 0 "[ . 1 . 2]" 1
220 1 29 LEU H 1 30 GLY H . . 4.650 4.547 4.409 4.640 . 0 0 "[ . 1 . 2]" 1
221 1 29 LEU H 1 105 GLN QB . . 5.500 5.097 4.317 5.463 . 0 0 "[ . 1 . 2]" 1
222 1 29 LEU HA 1 29 LEU MD1 . . 3.540 2.195 1.965 2.534 . 0 0 "[ . 1 . 2]" 1
223 1 29 LEU HA 1 29 LEU MD2 . . 3.940 3.852 3.825 3.907 . 0 0 "[ . 1 . 2]" 1
224 1 29 LEU HA 1 29 LEU HG . . 3.970 2.792 2.583 2.990 . 0 0 "[ . 1 . 2]" 1
225 1 29 LEU HA 1 30 GLY H . . 3.250 2.185 2.143 2.289 . 0 0 "[ . 1 . 2]" 1
226 1 29 LEU HA 1 30 GLY QA . . 4.810 3.944 3.899 4.008 . 0 0 "[ . 1 . 2]" 1
227 1 29 LEU HA 1 31 SER H . . 4.990 3.428 3.233 3.586 . 0 0 "[ . 1 . 2]" 1
228 1 29 LEU HA 1 77 PRO HB2 . . 4.330 3.543 3.287 3.746 . 0 0 "[ . 1 . 2]" 1
229 1 29 LEU HA 1 77 PRO HG2 . . 3.940 2.357 2.069 2.613 . 0 0 "[ . 1 . 2]" 1
230 1 29 LEU HA 1 77 PRO HG3 . . 4.440 3.956 3.626 4.239 . 0 0 "[ . 1 . 2]" 1
231 1 29 LEU HA 1 78 ARG HA . . 5.050 4.655 4.276 5.029 . 0 0 "[ . 1 . 2]" 1
232 1 29 LEU HA 1 103 VAL MG1 . . 3.930 3.630 3.418 3.918 . 0 0 "[ . 1 . 2]" 1
233 1 29 LEU HA 1 103 VAL MG2 . . 5.500 5.382 5.115 5.502 0.002 9 0 "[ . 1 . 2]" 1
234 1 29 LEU QB 1 29 LEU MD1 . . 3.190 2.186 2.031 2.279 . 0 0 "[ . 1 . 2]" 1
235 1 29 LEU QB 1 29 LEU MD2 . . 2.930 2.077 1.979 2.101 . 0 0 "[ . 1 . 2]" 1
236 1 29 LEU QB 1 30 GLY H . . 4.370 3.639 3.340 3.869 . 0 0 "[ . 1 . 2]" 1
237 1 29 LEU QB 1 30 GLY HA2 . . 5.500 4.998 4.840 5.162 . 0 0 "[ . 1 . 2]" 1
238 1 29 LEU QB 1 30 GLY QA . . 4.830 4.033 3.872 4.220 . 0 0 "[ . 1 . 2]" 1
239 1 29 LEU QB 1 30 GLY HA3 . . 5.500 4.257 4.073 4.477 . 0 0 "[ . 1 . 2]" 1
240 1 29 LEU QB 1 31 SER H . . 5.500 4.888 4.615 5.147 . 0 0 "[ . 1 . 2]" 1
241 1 29 LEU QB 1 105 GLN HA . . 4.220 3.151 2.768 3.666 . 0 0 "[ . 1 . 2]" 1
242 1 29 LEU QB 1 105 GLN QB . . 4.550 4.014 3.018 4.443 . 0 0 "[ . 1 . 2]" 1
243 1 29 LEU QB 1 105 GLN QE . . 4.540 3.902 1.939 4.518 . 0 0 "[ . 1 . 2]" 1
244 1 29 LEU MD1 1 30 GLY H . . 4.480 3.158 2.858 3.541 . 0 0 "[ . 1 . 2]" 1
245 1 29 LEU MD1 1 77 PRO HB2 . . 3.740 2.358 2.122 2.738 . 0 0 "[ . 1 . 2]" 1
246 1 29 LEU MD1 1 77 PRO HG2 . . 3.980 2.957 2.442 3.419 . 0 0 "[ . 1 . 2]" 1
247 1 29 LEU MD1 1 78 ARG H . . 5.110 3.589 3.104 4.081 . 0 0 "[ . 1 . 2]" 1
248 1 29 LEU MD1 1 78 ARG HA . . 4.100 3.019 2.453 3.728 . 0 0 "[ . 1 . 2]" 1
249 1 29 LEU MD1 1 79 GLU H . . 4.300 2.719 2.324 3.118 . 0 0 "[ . 1 . 2]" 1
250 1 29 LEU MD1 1 79 GLU HA . . 4.440 2.564 2.248 3.097 . 0 0 "[ . 1 . 2]" 1
251 1 29 LEU MD1 1 80 VAL H . . 4.390 3.360 2.938 3.856 . 0 0 "[ . 1 . 2]" 1
252 1 29 LEU MD1 1 80 VAL HA . . 4.230 3.200 2.851 3.457 . 0 0 "[ . 1 . 2]" 1
253 1 29 LEU MD1 1 80 VAL MG1 . . 3.560 1.966 1.675 2.261 . 0 0 "[ . 1 . 2]" 1
254 1 29 LEU MD1 1 103 VAL MG1 . . 3.410 2.206 1.844 2.417 . 0 0 "[ . 1 . 2]" 1
255 1 29 LEU MD2 1 30 GLY H . . 4.840 4.360 3.907 4.841 0.001 12 0 "[ . 1 . 2]" 1
256 1 29 LEU MD2 1 78 ARG HA . . 4.290 3.861 3.419 4.236 . 0 0 "[ . 1 . 2]" 1
257 1 29 LEU MD2 1 79 GLU H . . 4.580 4.309 3.815 4.574 . 0 0 "[ . 1 . 2]" 1
258 1 29 LEU MD2 1 79 GLU HA . . 3.850 2.665 2.350 3.120 . 0 0 "[ . 1 . 2]" 1
259 1 29 LEU MD2 1 80 VAL H . . 4.110 3.733 3.114 4.091 . 0 0 "[ . 1 . 2]" 1
260 1 29 LEU MD2 1 80 VAL MG1 . . 3.460 2.332 1.903 2.884 . 0 0 "[ . 1 . 2]" 1
261 1 29 LEU MD2 1 105 GLN H . . 5.500 5.055 4.483 5.487 . 0 0 "[ . 1 . 2]" 1
262 1 29 LEU MD2 1 105 GLN QB . . 4.190 3.816 2.755 4.194 0.004 19 0 "[ . 1 . 2]" 1
263 1 29 LEU MD2 1 105 GLN HE21 . . 4.980 2.965 1.817 3.983 . 0 0 "[ . 1 . 2]" 1
264 1 29 LEU MD2 1 105 GLN QE . . 4.240 2.810 1.807 3.734 . 0 0 "[ . 1 . 2]" 1
265 1 29 LEU MD2 1 105 GLN HE22 . . 4.980 3.688 2.575 4.510 . 0 0 "[ . 1 . 2]" 1
266 1 29 LEU HG 1 30 GLY H . . 3.920 2.815 2.257 3.443 . 0 0 "[ . 1 . 2]" 1
267 1 29 LEU HG 1 30 GLY QA . . 4.340 3.629 3.352 3.966 . 0 0 "[ . 1 . 2]" 1
268 1 29 LEU HG 1 31 SER H . . 5.500 5.073 4.768 5.436 . 0 0 "[ . 1 . 2]" 1
269 1 29 LEU HG 1 78 ARG HA . . 4.310 2.966 2.649 3.318 . 0 0 "[ . 1 . 2]" 1
270 1 30 GLY H 1 31 SER H . . 3.510 2.424 2.092 2.691 . 0 0 "[ . 1 . 2]" 1
271 1 30 GLY H 1 76 ILE MG . . 3.990 2.950 2.645 3.192 . 0 0 "[ . 1 . 2]" 1
272 1 30 GLY H 1 77 PRO HB2 . . 4.840 4.246 3.893 4.588 . 0 0 "[ . 1 . 2]" 1
273 1 30 GLY H 1 77 PRO HG2 . . 4.430 3.030 2.730 3.372 . 0 0 "[ . 1 . 2]" 1
274 1 30 GLY H 1 77 PRO HG3 . . 5.370 4.769 4.474 5.117 . 0 0 "[ . 1 . 2]" 1
275 1 30 GLY H 1 78 ARG HA . . 4.640 3.490 2.847 3.959 . 0 0 "[ . 1 . 2]" 1
276 1 30 GLY QA 1 76 ILE MG . . 3.320 2.392 2.126 2.597 . 0 0 "[ . 1 . 2]" 1
277 1 30 GLY HA2 1 76 ILE MG . . 3.850 2.424 2.147 2.642 . 0 0 "[ . 1 . 2]" 1
278 1 30 GLY HA3 1 76 ILE MG . . 3.850 3.683 3.410 3.853 0.003 17 0 "[ . 1 . 2]" 1
279 1 31 SER H 1 31 SER HB2 . . 4.060 2.932 2.630 3.931 . 0 0 "[ . 1 . 2]" 1
280 1 31 SER H 1 31 SER QB . . 3.330 2.734 2.546 2.901 . 0 0 "[ . 1 . 2]" 1
281 1 31 SER H 1 31 SER HB3 . . 4.060 3.631 2.940 3.963 . 0 0 "[ . 1 . 2]" 1
282 1 31 SER H 1 32 ALA H . . 4.570 4.245 4.032 4.477 . 0 0 "[ . 1 . 2]" 1
283 1 31 SER H 1 76 ILE HA . . 4.860 3.928 3.623 4.251 . 0 0 "[ . 1 . 2]" 1
284 1 31 SER H 1 76 ILE MD . . 5.500 5.243 4.988 5.431 . 0 0 "[ . 1 . 2]" 1
285 1 31 SER H 1 76 ILE MG . . 3.900 2.623 2.331 2.958 . 0 0 "[ . 1 . 2]" 1
286 1 31 SER H 1 77 PRO QD . . 4.050 3.067 2.766 3.376 . 0 0 "[ . 1 . 2]" 1
287 1 31 SER H 1 77 PRO HG2 . . 4.810 3.612 3.199 3.857 . 0 0 "[ . 1 . 2]" 1
288 1 31 SER H 1 77 PRO HG3 . . 5.200 4.953 4.552 5.197 . 0 0 "[ . 1 . 2]" 1
289 1 31 SER HA 1 32 ALA H . . 2.930 2.189 2.137 2.392 . 0 0 "[ . 1 . 2]" 1
290 1 31 SER HA 1 32 ALA HA . . 5.010 4.349 4.313 4.382 . 0 0 "[ . 1 . 2]" 1
291 1 31 SER HA 1 76 ILE QG . . 3.980 3.368 2.991 3.701 . 0 0 "[ . 1 . 2]" 1
292 1 31 SER HA 1 76 ILE MG . . 4.420 2.913 2.442 3.339 . 0 0 "[ . 1 . 2]" 1
293 1 31 SER QB 1 32 ALA H . . 3.480 3.190 2.821 3.473 . 0 0 "[ . 1 . 2]" 1
294 1 31 SER QB 1 32 ALA MB . . 4.590 4.373 4.127 4.590 . 0 0 "[ . 1 . 2]" 1
295 1 32 ALA H 1 32 ALA MB . . 2.970 2.144 2.027 2.246 . 0 0 "[ . 1 . 2]" 1
296 1 32 ALA H 1 76 ILE MD . . 4.290 3.517 3.296 3.950 . 0 0 "[ . 1 . 2]" 1
297 1 32 ALA H 1 76 ILE HG12 . . 4.320 2.492 2.244 2.969 . 0 0 "[ . 1 . 2]" 1
298 1 32 ALA H 1 76 ILE QG . . 3.790 2.464 2.217 2.915 . 0 0 "[ . 1 . 2]" 1
299 1 32 ALA H 1 76 ILE HG13 . . 4.320 3.914 3.451 4.303 . 0 0 "[ . 1 . 2]" 1
300 1 32 ALA H 1 76 ILE MG . . 4.610 3.409 2.960 4.284 . 0 0 "[ . 1 . 2]" 1
301 1 32 ALA HA 1 33 ALA H . . 2.900 2.149 2.142 2.162 . 0 0 "[ . 1 . 2]" 1
302 1 32 ALA HA 1 75 PHE H . . 4.620 4.068 3.805 4.324 . 0 0 "[ . 1 . 2]" 1
303 1 32 ALA HA 1 76 ILE H . . 5.090 4.283 3.941 4.582 . 0 0 "[ . 1 . 2]" 1
304 1 32 ALA HA 1 76 ILE HA . . 3.500 2.646 2.392 2.877 . 0 0 "[ . 1 . 2]" 1
305 1 32 ALA HA 1 76 ILE HB . . 4.790 4.663 4.496 4.789 . 0 0 "[ . 1 . 2]" 1
306 1 32 ALA HA 1 76 ILE MD . . 3.920 3.878 3.746 3.924 0.004 12 0 "[ . 1 . 2]" 1
307 1 32 ALA HA 1 76 ILE HG12 . . 4.010 2.502 2.314 2.850 . 0 0 "[ . 1 . 2]" 1
308 1 32 ALA HA 1 76 ILE QG . . 3.450 2.288 2.172 2.403 . 0 0 "[ . 1 . 2]" 1
309 1 32 ALA HA 1 76 ILE HG13 . . 4.010 2.708 2.497 2.997 . 0 0 "[ . 1 . 2]" 1
310 1 32 ALA HA 1 76 ILE MG . . 4.320 3.691 3.432 4.088 . 0 0 "[ . 1 . 2]" 1
311 1 32 ALA HA 1 77 PRO HD2 . . 4.430 3.655 3.405 3.896 . 0 0 "[ . 1 . 2]" 1
312 1 32 ALA HA 1 77 PRO HD3 . . 4.430 4.143 3.904 4.408 . 0 0 "[ . 1 . 2]" 1
313 1 32 ALA MB 1 33 ALA H . . 3.430 3.280 3.076 3.412 . 0 0 "[ . 1 . 2]" 1
314 1 32 ALA MB 1 75 PHE H . . 4.460 4.188 3.845 4.435 . 0 0 "[ . 1 . 2]" 1
315 1 32 ALA MB 1 76 ILE HA . . 4.530 4.006 3.766 4.220 . 0 0 "[ . 1 . 2]" 1
316 1 32 ALA MB 1 76 ILE HG12 . . 3.790 2.513 2.116 2.921 . 0 0 "[ . 1 . 2]" 1
317 1 32 ALA MB 1 76 ILE HG13 . . 3.790 2.620 2.176 3.046 . 0 0 "[ . 1 . 2]" 1
318 1 33 ALA H 1 33 ALA MB . . 3.350 2.440 2.300 2.639 . 0 0 "[ . 1 . 2]" 1
319 1 33 ALA H 1 34 ASP H . . 4.670 4.432 4.275 4.511 . 0 0 "[ . 1 . 2]" 1
320 1 33 ALA H 1 74 SER HA . . 4.930 4.412 4.122 4.752 . 0 0 "[ . 1 . 2]" 1
321 1 33 ALA H 1 75 PHE H . . 3.460 3.293 3.067 3.430 . 0 0 "[ . 1 . 2]" 1
322 1 33 ALA H 1 76 ILE HA . . 4.100 3.541 3.122 3.718 . 0 0 "[ . 1 . 2]" 1
323 1 33 ALA H 1 76 ILE HG12 . . 4.870 4.552 4.397 4.802 . 0 0 "[ . 1 . 2]" 1
324 1 33 ALA H 1 76 ILE QG . . 4.230 4.048 3.890 4.140 . 0 0 "[ . 1 . 2]" 1
325 1 33 ALA H 1 76 ILE HG13 . . 4.870 4.552 4.316 4.777 . 0 0 "[ . 1 . 2]" 1
326 1 33 ALA H 1 77 PRO HD2 . . 4.420 3.681 3.215 4.100 . 0 0 "[ . 1 . 2]" 1
327 1 33 ALA H 1 77 PRO QD . . 3.800 3.235 2.854 3.590 . 0 0 "[ . 1 . 2]" 1
328 1 33 ALA H 1 77 PRO HD3 . . 4.420 3.589 3.193 3.986 . 0 0 "[ . 1 . 2]" 1
329 1 33 ALA HA 1 34 ASP H . . 2.940 2.226 2.153 2.395 . 0 0 "[ . 1 . 2]" 1
330 1 33 ALA HA 1 34 ASP HA . . 4.920 4.355 4.335 4.372 . 0 0 "[ . 1 . 2]" 1
331 1 33 ALA MB 1 34 ASP H . . 3.590 2.874 2.450 3.108 . 0 0 "[ . 1 . 2]" 1
332 1 33 ALA MB 1 35 PHE QD . . 4.620 4.100 3.749 4.325 . 0 0 "[ . 1 . 2]" 1
333 1 33 ALA MB 1 35 PHE QE . . 3.840 2.968 2.443 3.357 . 0 0 "[ . 1 . 2]" 1
334 1 33 ALA MB 1 35 PHE HZ . . 4.070 3.205 2.781 3.594 . 0 0 "[ . 1 . 2]" 1
335 1 33 ALA MB 1 75 PHE H . . 4.710 4.528 4.264 4.706 . 0 0 "[ . 1 . 2]" 1
336 1 33 ALA MB 1 75 PHE QE . . 5.500 4.871 4.410 5.272 . 0 0 "[ . 1 . 2]" 1
337 1 33 ALA MB 1 77 PRO HD2 . . 4.390 3.791 3.157 4.085 . 0 0 "[ . 1 . 2]" 1
338 1 33 ALA MB 1 77 PRO QD . . 3.770 3.352 2.830 3.561 . 0 0 "[ . 1 . 2]" 1
339 1 33 ALA MB 1 77 PRO HD3 . . 4.390 3.744 3.196 3.996 . 0 0 "[ . 1 . 2]" 1
340 1 34 ASP H 1 34 ASP HB2 . . 3.860 2.835 2.246 3.656 . 0 0 "[ . 1 . 2]" 1
341 1 34 ASP H 1 34 ASP QB . . 3.270 2.483 2.222 2.894 . 0 0 "[ . 1 . 2]" 1
342 1 34 ASP H 1 34 ASP HB3 . . 3.860 3.124 2.381 3.686 . 0 0 "[ . 1 . 2]" 1
343 1 34 ASP H 1 35 PHE H . . 4.660 4.589 4.550 4.622 . 0 0 "[ . 1 . 2]" 1
344 1 34 ASP HA 1 35 PHE H . . 3.110 2.281 2.179 2.350 . 0 0 "[ . 1 . 2]" 1
345 1 34 ASP HA 1 35 PHE HA . . 4.540 4.433 4.394 4.464 . 0 0 "[ . 1 . 2]" 1
346 1 34 ASP HA 1 35 PHE QD . . 4.850 3.265 2.868 3.654 . 0 0 "[ . 1 . 2]" 1
347 1 34 ASP HA 1 73 ILE H . . 5.080 4.776 4.199 5.033 . 0 0 "[ . 1 . 2]" 1
348 1 34 ASP HA 1 74 SER HA . . 3.620 2.933 2.572 3.232 . 0 0 "[ . 1 . 2]" 1
349 1 34 ASP HA 1 75 PHE H . . 4.480 4.382 4.236 4.479 . 0 0 "[ . 1 . 2]" 1
350 1 34 ASP QB 1 35 PHE H . . 3.840 2.914 2.538 3.468 . 0 0 "[ . 1 . 2]" 1
351 1 34 ASP QB 1 66 LEU MD1 . . 4.420 3.463 2.736 4.244 . 0 0 "[ . 1 . 2]" 1
352 1 34 ASP QB 1 66 LEU MD2 . . 3.940 3.203 2.543 3.827 . 0 0 "[ . 1 . 2]" 1
353 1 34 ASP HB2 1 35 PHE H . . 4.410 3.590 2.596 4.143 . 0 0 "[ . 1 . 2]" 1
354 1 34 ASP HB2 1 66 LEU MD1 . . 5.270 4.215 3.256 5.098 . 0 0 "[ . 1 . 2]" 1
355 1 34 ASP HB3 1 35 PHE H . . 4.410 3.354 2.665 4.061 . 0 0 "[ . 1 . 2]" 1
356 1 34 ASP HB3 1 66 LEU MD1 . . 5.270 3.978 2.780 4.800 . 0 0 "[ . 1 . 2]" 1
357 1 35 PHE H 1 35 PHE HB2 . . 4.030 2.687 2.550 2.806 . 0 0 "[ . 1 . 2]" 1
358 1 35 PHE H 1 35 PHE HB3 . . 4.030 3.802 3.727 3.859 . 0 0 "[ . 1 . 2]" 1
359 1 35 PHE H 1 35 PHE QD . . 3.930 2.930 2.557 3.335 . 0 0 "[ . 1 . 2]" 1
360 1 35 PHE H 1 36 LEU H . . 4.760 4.200 4.066 4.444 . 0 0 "[ . 1 . 2]" 1
361 1 35 PHE H 1 36 LEU QB . . 5.330 5.230 5.059 5.331 0.001 6 0 "[ . 1 . 2]" 1
362 1 35 PHE H 1 66 LEU MD1 . . 4.750 3.982 3.699 4.667 . 0 0 "[ . 1 . 2]" 1
363 1 35 PHE H 1 72 GLY HA3 . . 5.420 3.512 3.263 3.889 . 0 0 "[ . 1 . 2]" 1
364 1 35 PHE H 1 73 ILE H . . 3.660 3.026 2.563 3.341 . 0 0 "[ . 1 . 2]" 1
365 1 35 PHE H 1 73 ILE MG . . 4.220 3.331 3.120 3.674 . 0 0 "[ . 1 . 2]" 1
366 1 35 PHE H 1 74 SER HA . . 4.510 4.177 3.901 4.501 . 0 0 "[ . 1 . 2]" 1
367 1 35 PHE HA 1 35 PHE QD . . 4.160 2.970 2.786 3.142 . 0 0 "[ . 1 . 2]" 1
368 1 35 PHE HA 1 36 LEU H . . 3.160 2.150 2.139 2.261 . 0 0 "[ . 1 . 2]" 1
369 1 35 PHE HA 1 36 LEU QB . . 4.100 4.030 3.927 4.106 0.006 10 0 "[ . 1 . 2]" 1
370 1 35 PHE QB 1 36 LEU H . . 3.850 3.309 2.751 3.508 . 0 0 "[ . 1 . 2]" 1
371 1 35 PHE QB 1 37 LEU MD2 . . 4.170 3.966 3.756 4.148 . 0 0 "[ . 1 . 2]" 1
372 1 35 PHE QB 1 73 ILE H . . 4.450 2.735 2.559 2.945 . 0 0 "[ . 1 . 2]" 1
373 1 35 PHE QB 1 73 ILE MG . . 3.550 2.005 1.772 2.391 . 0 0 "[ . 1 . 2]" 1
374 1 35 PHE HB2 1 36 LEU H . . 4.430 4.301 3.910 4.417 . 0 0 "[ . 1 . 2]" 1
375 1 35 PHE HB2 1 37 LEU MD2 . . 4.810 4.360 4.045 4.634 . 0 0 "[ . 1 . 2]" 1
376 1 35 PHE HB2 1 73 ILE H . . 5.260 2.774 2.597 2.985 . 0 0 "[ . 1 . 2]" 1
377 1 35 PHE HB2 1 73 ILE MG . . 4.190 2.022 1.792 2.418 . 0 0 "[ . 1 . 2]" 1
378 1 35 PHE HB2 1 101 ILE MD . . 4.390 3.330 2.932 3.666 . 0 0 "[ . 1 . 2]" 1
379 1 35 PHE HB3 1 36 LEU H . . 4.430 3.442 2.811 3.702 . 0 0 "[ . 1 . 2]" 1
380 1 35 PHE HB3 1 37 LEU MD2 . . 4.810 4.573 4.278 4.787 . 0 0 "[ . 1 . 2]" 1
381 1 35 PHE HB3 1 73 ILE H . . 5.260 4.161 3.864 4.521 . 0 0 "[ . 1 . 2]" 1
382 1 35 PHE HB3 1 73 ILE MG . . 4.190 3.321 2.799 3.762 . 0 0 "[ . 1 . 2]" 1
383 1 35 PHE HB3 1 101 ILE MD . . 4.390 3.085 2.477 3.445 . 0 0 "[ . 1 . 2]" 1
384 1 35 PHE QD 1 36 LEU H . . 4.870 4.284 3.902 4.671 . 0 0 "[ . 1 . 2]" 1
385 1 35 PHE QD 1 73 ILE HG12 . . 5.500 4.469 3.927 5.127 . 0 0 "[ . 1 . 2]" 1
386 1 35 PHE QD 1 73 ILE MG . . 4.050 2.397 1.969 2.914 . 0 0 "[ . 1 . 2]" 1
387 1 35 PHE QD 1 101 ILE MD . . 4.420 2.870 2.084 3.322 . 0 0 "[ . 1 . 2]" 1
388 1 35 PHE QD 1 101 ILE MG . . 4.480 2.606 2.081 3.107 . 0 0 "[ . 1 . 2]" 1
389 1 35 PHE QE 1 101 ILE MD . . 4.690 3.271 2.820 3.724 . 0 0 "[ . 1 . 2]" 1
390 1 35 PHE QE 1 101 ILE MG . . 4.490 2.092 1.809 2.455 . 0 0 "[ . 1 . 2]" 1
391 1 35 PHE QE 1 103 VAL MG2 . . 4.660 3.649 3.295 4.124 . 0 0 "[ . 1 . 2]" 1
392 1 35 PHE HZ 1 77 PRO HB3 . . 4.850 4.379 4.011 4.825 . 0 0 "[ . 1 . 2]" 1
393 1 35 PHE HZ 1 77 PRO HG2 . . 5.500 5.078 4.716 5.445 . 0 0 "[ . 1 . 2]" 1
394 1 35 PHE HZ 1 77 PRO HG3 . . 4.720 3.353 3.002 3.678 . 0 0 "[ . 1 . 2]" 1
395 1 35 PHE HZ 1 101 ILE MG . . 4.880 3.175 2.617 3.964 . 0 0 "[ . 1 . 2]" 1
396 1 35 PHE HZ 1 103 VAL MG2 . . 4.300 3.314 2.792 3.725 . 0 0 "[ . 1 . 2]" 1
397 1 36 LEU H 1 36 LEU QB . . 3.160 2.293 2.226 2.449 . 0 0 "[ . 1 . 2]" 1
398 1 36 LEU H 1 36 LEU MD2 . . 5.220 4.341 4.264 4.443 . 0 0 "[ . 1 . 2]" 1
399 1 36 LEU H 1 36 LEU HG . . 4.640 4.549 4.482 4.604 . 0 0 "[ . 1 . 2]" 1
400 1 36 LEU HA 1 36 LEU MD1 . . 3.770 2.405 2.109 2.563 . 0 0 "[ . 1 . 2]" 1
401 1 36 LEU HA 1 36 LEU MD2 . . 3.970 3.841 3.787 3.905 . 0 0 "[ . 1 . 2]" 1
402 1 36 LEU HA 1 36 LEU HG . . 3.890 2.663 2.480 2.865 . 0 0 "[ . 1 . 2]" 1
403 1 36 LEU HA 1 37 LEU H . . 3.040 2.148 2.140 2.173 . 0 0 "[ . 1 . 2]" 1
404 1 36 LEU HA 1 66 LEU MD1 . . 3.650 2.914 2.526 3.121 . 0 0 "[ . 1 . 2]" 1
405 1 36 LEU HA 1 72 GLY HA2 . . 4.050 3.553 3.100 3.959 . 0 0 "[ . 1 . 2]" 1
406 1 36 LEU HA 1 72 GLY HA3 . . 4.210 3.152 2.870 3.403 . 0 0 "[ . 1 . 2]" 1
407 1 36 LEU HA 1 73 ILE H . . 5.140 4.708 4.286 4.964 . 0 0 "[ . 1 . 2]" 1
408 1 36 LEU QB 1 36 LEU MD1 . . 3.250 2.086 2.005 2.218 . 0 0 "[ . 1 . 2]" 1
409 1 36 LEU QB 1 37 LEU H . . 3.970 3.830 3.708 3.909 . 0 0 "[ . 1 . 2]" 1
410 1 36 LEU MD1 1 37 LEU H . . 3.930 3.651 3.155 3.928 . 0 0 "[ . 1 . 2]" 1
411 1 36 LEU MD1 1 66 LEU HB3 . . 3.820 3.477 3.244 3.748 . 0 0 "[ . 1 . 2]" 1
412 1 36 LEU MD1 1 70 HIS HB2 . . 3.750 2.797 2.340 3.259 . 0 0 "[ . 1 . 2]" 1
413 1 36 LEU MD1 1 70 HIS HB3 . . 3.560 2.222 1.826 2.764 . 0 0 "[ . 1 . 2]" 1
414 1 36 LEU MD1 1 70 HIS HD2 . . 4.530 2.956 2.273 3.571 . 0 0 "[ . 1 . 2]" 1
415 1 36 LEU MD2 1 37 LEU H . . 5.350 4.661 4.282 4.844 . 0 0 "[ . 1 . 2]" 1
416 1 36 LEU MD2 1 70 HIS HB2 . . 5.000 4.394 4.086 4.708 . 0 0 "[ . 1 . 2]" 1
417 1 36 LEU MD2 1 70 HIS HB3 . . 3.970 3.696 3.389 3.970 . 0 0 "[ . 1 . 2]" 1
418 1 36 LEU MD2 1 70 HIS HD2 . . 4.850 3.349 2.808 4.142 . 0 0 "[ . 1 . 2]" 1
419 1 36 LEU HG 1 37 LEU H . . 4.200 3.254 2.924 3.506 . 0 0 "[ . 1 . 2]" 1
420 1 36 LEU HG 1 70 HIS HB2 . . 5.340 4.918 4.408 5.206 . 0 0 "[ . 1 . 2]" 1
421 1 36 LEU HG 1 70 HIS HB3 . . 4.120 3.557 3.301 3.821 . 0 0 "[ . 1 . 2]" 1
422 1 36 LEU HG 1 71 ILE H . . 4.970 4.454 3.887 4.865 . 0 0 "[ . 1 . 2]" 1
423 1 37 LEU H 1 37 LEU HB2 . . 3.980 3.812 3.715 3.888 . 0 0 "[ . 1 . 2]" 1
424 1 37 LEU H 1 37 LEU HB3 . . 3.250 2.847 2.685 3.020 . 0 0 "[ . 1 . 2]" 1
425 1 37 LEU H 1 37 LEU MD1 . . 4.360 4.102 3.880 4.268 . 0 0 "[ . 1 . 2]" 1
426 1 37 LEU H 1 37 LEU MD2 . . 4.000 1.875 1.773 2.000 . 0 0 "[ . 1 . 2]" 1
427 1 37 LEU H 1 37 LEU HG . . 3.770 3.530 3.410 3.642 . 0 0 "[ . 1 . 2]" 1
428 1 37 LEU H 1 38 ASP H . . 4.520 4.407 4.324 4.504 . 0 0 "[ . 1 . 2]" 1
429 1 37 LEU H 1 66 LEU MD1 . . 4.440 4.034 3.657 4.301 . 0 0 "[ . 1 . 2]" 1
430 1 37 LEU H 1 71 ILE H . . 5.270 4.592 4.198 4.969 . 0 0 "[ . 1 . 2]" 1
431 1 37 LEU H 1 72 GLY HA2 . . 3.830 3.158 2.764 3.393 . 0 0 "[ . 1 . 2]" 1
432 1 37 LEU H 1 72 GLY HA3 . . 4.250 3.838 3.704 4.026 . 0 0 "[ . 1 . 2]" 1
433 1 37 LEU H 1 73 ILE H . . 5.030 4.816 4.328 5.025 . 0 0 "[ . 1 . 2]" 1
434 1 37 LEU HA 1 37 LEU MD1 . . 4.210 4.081 4.004 4.121 . 0 0 "[ . 1 . 2]" 1
435 1 37 LEU HA 1 37 LEU MD2 . . 3.720 3.568 3.483 3.648 . 0 0 "[ . 1 . 2]" 1
436 1 37 LEU HA 1 37 LEU HG . . 4.120 3.654 3.571 3.727 . 0 0 "[ . 1 . 2]" 1
437 1 37 LEU HA 1 38 ASP H . . 3.530 2.200 2.153 2.349 . 0 0 "[ . 1 . 2]" 1
438 1 37 LEU HB2 1 37 LEU MD1 . . 3.420 2.270 2.154 2.364 . 0 0 "[ . 1 . 2]" 1
439 1 37 LEU HB2 1 37 LEU MD2 . . 3.300 3.183 3.157 3.192 . 0 0 "[ . 1 . 2]" 1
440 1 37 LEU HB2 1 38 ASP H . . 4.360 3.102 2.681 3.304 . 0 0 "[ . 1 . 2]" 1
441 1 37 LEU HB2 1 39 ILE H . . 5.500 5.364 5.233 5.486 . 0 0 "[ . 1 . 2]" 1
442 1 37 LEU HB2 1 39 ILE HG12 . . 4.540 4.507 4.431 4.539 . 0 0 "[ . 1 . 2]" 1
443 1 37 LEU HB2 1 39 ILE MG . . 3.730 3.427 3.216 3.636 . 0 0 "[ . 1 . 2]" 1
444 1 37 LEU HB3 1 37 LEU MD1 . . 3.000 2.434 2.337 2.574 . 0 0 "[ . 1 . 2]" 1
445 1 37 LEU HB3 1 37 LEU MD2 . . 3.190 2.262 2.207 2.318 . 0 0 "[ . 1 . 2]" 1
446 1 37 LEU HB3 1 38 ASP H . . 4.870 4.239 4.011 4.337 . 0 0 "[ . 1 . 2]" 1
447 1 37 LEU HB3 1 39 ILE HG12 . . 5.070 4.954 4.840 5.063 . 0 0 "[ . 1 . 2]" 1
448 1 37 LEU HB3 1 72 GLY HA2 . . 4.950 4.322 3.974 4.651 . 0 0 "[ . 1 . 2]" 1
449 1 37 LEU HB3 1 73 ILE H . . 5.430 4.928 4.522 5.378 . 0 0 "[ . 1 . 2]" 1
450 1 37 LEU MD1 1 39 ILE HB . . 4.970 4.234 3.982 4.485 . 0 0 "[ . 1 . 2]" 1
451 1 37 LEU MD1 1 73 ILE H . . 4.860 4.615 4.204 4.862 0.002 19 0 "[ . 1 . 2]" 1
452 1 37 LEU MD2 1 38 ASP H . . 4.760 4.452 4.182 4.595 . 0 0 "[ . 1 . 2]" 1
453 1 37 LEU MD2 1 39 ILE HB . . 4.950 4.906 4.740 4.950 0.000 17 0 "[ . 1 . 2]" 1
454 1 37 LEU HG 1 38 ASP H . . 5.200 3.765 3.271 4.065 . 0 0 "[ . 1 . 2]" 1
455 1 37 LEU HG 1 39 ILE H . . 4.390 3.544 3.325 3.742 . 0 0 "[ . 1 . 2]" 1
456 1 37 LEU HG 1 39 ILE HG12 . . 4.100 2.055 2.005 2.196 . 0 0 "[ . 1 . 2]" 1
457 1 37 LEU HG 1 39 ILE HG13 . . 4.250 3.775 3.644 3.946 . 0 0 "[ . 1 . 2]" 1
458 1 37 LEU HG 1 39 ILE MG . . 3.630 2.122 1.953 2.323 . 0 0 "[ . 1 . 2]" 1
459 1 37 LEU HG 1 72 GLY HA2 . . 4.800 4.721 4.482 4.796 . 0 0 "[ . 1 . 2]" 1
460 1 38 ASP H 1 38 ASP HB2 . . 3.770 2.834 2.426 3.623 . 0 0 "[ . 1 . 2]" 1
461 1 38 ASP H 1 38 ASP HB3 . . 3.770 2.856 2.248 3.654 . 0 0 "[ . 1 . 2]" 1
462 1 38 ASP H 1 39 ILE H . . 4.550 4.223 4.102 4.281 . 0 0 "[ . 1 . 2]" 1
463 1 38 ASP H 1 39 ILE MG . . 4.250 4.109 3.887 4.243 . 0 0 "[ . 1 . 2]" 1
464 1 38 ASP HA 1 39 ILE H . . 3.130 2.189 2.171 2.205 . 0 0 "[ . 1 . 2]" 1
465 1 38 ASP HA 1 39 ILE HA . . 4.410 4.386 4.377 4.397 . 0 0 "[ . 1 . 2]" 1
466 1 38 ASP HA 1 39 ILE HG12 . . 4.810 4.105 3.885 4.327 . 0 0 "[ . 1 . 2]" 1
467 1 38 ASP HA 1 39 ILE HG13 . . 4.600 4.412 4.231 4.567 . 0 0 "[ . 1 . 2]" 1
468 1 38 ASP HB2 1 39 ILE H . . 4.570 4.352 3.885 4.507 . 0 0 "[ . 1 . 2]" 1
469 1 38 ASP HB3 1 39 ILE H . . 4.570 4.282 3.808 4.565 . 0 0 "[ . 1 . 2]" 1
470 1 39 ILE H 1 39 ILE HB . . 3.860 3.738 3.659 3.816 . 0 0 "[ . 1 . 2]" 1
471 1 39 ILE H 1 39 ILE MD . . 4.360 3.828 3.726 3.941 . 0 0 "[ . 1 . 2]" 1
472 1 39 ILE H 1 39 ILE HG12 . . 3.540 2.497 2.280 2.694 . 0 0 "[ . 1 . 2]" 1
473 1 39 ILE H 1 39 ILE HG13 . . 3.790 2.339 2.146 2.482 . 0 0 "[ . 1 . 2]" 1
474 1 39 ILE H 1 39 ILE MG . . 3.720 3.196 3.082 3.317 . 0 0 "[ . 1 . 2]" 1
475 1 39 ILE HA 1 39 ILE MD . . 4.320 4.157 4.116 4.179 . 0 0 "[ . 1 . 2]" 1
476 1 39 ILE HA 1 39 ILE MG . . 3.280 2.222 2.097 2.345 . 0 0 "[ . 1 . 2]" 1
477 1 39 ILE HA 1 95 ALA MB . . 5.340 4.371 3.843 5.013 . 0 0 "[ . 1 . 2]" 1
478 1 39 ILE HA 1 96 ASN HD21 . . 4.890 3.019 2.594 3.861 . 0 0 "[ . 1 . 2]" 1
479 1 39 ILE HA 1 96 ASN QD . . 4.270 2.861 2.483 3.576 . 0 0 "[ . 1 . 2]" 1
480 1 39 ILE HA 1 96 ASN HD22 . . 4.890 3.578 3.040 4.224 . 0 0 "[ . 1 . 2]" 1
481 1 39 ILE HB 1 39 ILE MD . . 3.280 2.218 2.098 2.388 . 0 0 "[ . 1 . 2]" 1
482 1 39 ILE HB 1 40 SER H . . 4.480 3.029 2.322 3.438 . 0 0 "[ . 1 . 2]" 1
483 1 39 ILE HB 1 41 GLU H . . 4.460 2.699 2.298 3.089 . 0 0 "[ . 1 . 2]" 1
484 1 39 ILE HB 1 41 GLU QB . . 4.320 2.969 2.761 3.369 . 0 0 "[ . 1 . 2]" 1
485 1 39 ILE HB 1 95 ALA MB . . 5.500 4.833 4.061 5.381 . 0 0 "[ . 1 . 2]" 1
486 1 39 ILE MD 1 41 GLU H . . 4.290 3.222 2.721 3.492 . 0 0 "[ . 1 . 2]" 1
487 1 39 ILE MD 1 41 GLU HB2 . . 4.090 2.623 2.124 3.321 . 0 0 "[ . 1 . 2]" 1
488 1 39 ILE MD 1 41 GLU QB . . 3.210 2.574 2.106 3.161 . 0 0 "[ . 1 . 2]" 1
489 1 39 ILE MD 1 41 GLU HB3 . . 4.090 3.850 3.139 4.089 . 0 0 "[ . 1 . 2]" 1
490 1 39 ILE MD 1 41 GLU QG . . 5.340 4.026 3.372 4.810 . 0 0 "[ . 1 . 2]" 1
491 1 39 ILE MD 1 47 LEU MD1 . . 5.310 2.783 2.464 3.398 . 0 0 "[ . 1 . 2]" 1
492 1 39 ILE HG13 1 39 ILE MG . . 3.380 3.167 3.145 3.197 . 0 0 "[ . 1 . 2]" 1
493 1 39 ILE HG13 1 41 GLU H . . 4.630 3.134 2.808 3.781 . 0 0 "[ . 1 . 2]" 1
494 1 39 ILE MG 1 40 SER H . . 4.680 3.635 3.264 3.832 . 0 0 "[ . 1 . 2]" 1
495 1 39 ILE MG 1 41 GLU H . . 4.560 4.269 3.854 4.547 . 0 0 "[ . 1 . 2]" 1
496 1 39 ILE MG 1 96 ASN HB2 . . 4.080 2.519 2.075 2.749 . 0 0 "[ . 1 . 2]" 1
497 1 39 ILE MG 1 96 ASN HB3 . . 4.290 3.570 3.202 3.929 . 0 0 "[ . 1 . 2]" 1
498 1 39 ILE MG 1 96 ASN HD21 . . 4.780 2.681 1.864 3.694 . 0 0 "[ . 1 . 2]" 1
499 1 39 ILE MG 1 96 ASN QD . . 4.090 2.631 1.851 3.546 . 0 0 "[ . 1 . 2]" 1
500 1 39 ILE MG 1 96 ASN HD22 . . 4.780 3.916 3.150 4.573 . 0 0 "[ . 1 . 2]" 1
501 1 40 SER H 1 41 GLU H . . 4.800 3.055 2.654 3.342 . 0 0 "[ . 1 . 2]" 1
502 1 40 SER HA 1 41 GLU HA . . 5.070 4.436 4.384 4.594 . 0 0 "[ . 1 . 2]" 1
503 1 40 SER QB 1 41 GLU H . . 4.350 3.828 3.235 4.032 . 0 0 "[ . 1 . 2]" 1
504 1 41 GLU H 1 41 GLU HB2 . . 4.000 2.642 2.366 2.771 . 0 0 "[ . 1 . 2]" 1
505 1 41 GLU H 1 41 GLU QB . . 3.480 2.592 2.336 2.710 . 0 0 "[ . 1 . 2]" 1
506 1 41 GLU H 1 41 GLU HB3 . . 4.000 3.767 3.604 3.848 . 0 0 "[ . 1 . 2]" 1
507 1 41 GLU H 1 41 GLU HG2 . . 4.830 3.747 2.641 4.615 . 0 0 "[ . 1 . 2]" 1
508 1 41 GLU H 1 41 GLU QG . . 4.040 3.310 2.602 4.036 . 0 0 "[ . 1 . 2]" 1
509 1 41 GLU H 1 41 GLU HG3 . . 4.830 4.076 2.820 4.566 . 0 0 "[ . 1 . 2]" 1
510 1 41 GLU HA 1 41 GLU HG2 . . 3.860 3.273 2.600 3.781 . 0 0 "[ . 1 . 2]" 1
511 1 41 GLU HA 1 41 GLU HG3 . . 3.860 3.139 2.461 3.863 0.003 15 0 "[ . 1 . 2]" 1
512 1 41 GLU QB 1 47 LEU MD1 . . 3.150 1.863 1.755 2.082 . 0 0 "[ . 1 . 2]" 1
513 1 41 GLU HB2 1 42 THR H . . 5.310 4.295 4.129 4.478 . 0 0 "[ . 1 . 2]" 1
514 1 41 GLU HB2 1 47 LEU MD1 . . 3.980 2.246 1.980 3.076 . 0 0 "[ . 1 . 2]" 1
515 1 41 GLU HB2 1 94 VAL HB . . 5.500 4.789 4.117 5.185 . 0 0 "[ . 1 . 2]" 1
516 1 41 GLU HB3 1 42 THR H . . 5.310 3.419 3.153 3.596 . 0 0 "[ . 1 . 2]" 1
517 1 41 GLU HB3 1 47 LEU MD1 . . 3.980 2.039 1.916 2.300 . 0 0 "[ . 1 . 2]" 1
518 1 41 GLU HB3 1 94 VAL HB . . 5.500 5.214 4.356 5.489 . 0 0 "[ . 1 . 2]" 1
519 1 41 GLU QG 1 47 LEU MD2 . . 3.500 2.480 2.112 3.391 . 0 0 "[ . 1 . 2]" 1
520 1 41 GLU QG 1 87 ILE MG . . 5.340 4.731 4.199 5.298 . 0 0 "[ . 1 . 2]" 1
521 1 41 GLU QG 1 94 VAL HB . . 4.560 2.985 2.477 3.633 . 0 0 "[ . 1 . 2]" 1
522 1 41 GLU QG 1 94 VAL MG1 . . 3.750 2.819 2.346 3.751 0.001 18 0 "[ . 1 . 2]" 1
523 1 41 GLU QG 1 94 VAL MG2 . . 4.660 3.514 3.033 4.087 . 0 0 "[ . 1 . 2]" 1
524 1 41 GLU HG2 1 47 LEU MD1 . . 4.250 3.543 2.848 4.152 . 0 0 "[ . 1 . 2]" 1
525 1 41 GLU HG2 1 47 LEU MD2 . . 4.020 3.179 2.138 3.950 . 0 0 "[ . 1 . 2]" 1
526 1 41 GLU HG2 1 94 VAL HB . . 5.220 3.411 2.513 4.361 . 0 0 "[ . 1 . 2]" 1
527 1 41 GLU HG2 1 94 VAL MG1 . . 4.270 3.472 2.612 4.263 . 0 0 "[ . 1 . 2]" 1
528 1 41 GLU HG3 1 47 LEU MD1 . . 4.250 3.504 2.741 4.137 . 0 0 "[ . 1 . 2]" 1
529 1 41 GLU HG3 1 47 LEU MD2 . . 4.020 3.037 2.134 4.018 . 0 0 "[ . 1 . 2]" 1
530 1 41 GLU HG3 1 94 VAL HB . . 5.220 3.678 2.867 4.933 . 0 0 "[ . 1 . 2]" 1
531 1 41 GLU HG3 1 94 VAL MG1 . . 4.270 3.415 2.374 4.268 . 0 0 "[ . 1 . 2]" 1
532 1 42 THR H 1 42 THR MG . . 4.530 2.666 1.882 3.817 . 0 0 "[ . 1 . 2]" 1
533 1 42 THR H 1 43 ASP H . . 5.070 2.600 2.112 4.458 . 0 0 "[ . 1 . 2]" 1
534 1 42 THR HA 1 42 THR MG . . 3.340 2.731 2.148 3.206 . 0 0 "[ . 1 . 2]" 1
535 1 42 THR HA 1 71 ILE MD . . 4.000 2.272 1.877 2.916 . 0 0 "[ . 1 . 2]" 1
536 1 42 THR HA 1 71 ILE QG . . 4.870 4.258 3.809 4.842 . 0 0 "[ . 1 . 2]" 1
537 1 43 ASP HA 1 45 SER H . . 4.500 4.239 3.481 4.461 . 0 0 "[ . 1 . 2]" 1
538 1 43 ASP QB 1 46 SER H . . 5.100 2.894 2.621 3.467 . 0 0 "[ . 1 . 2]" 1
539 1 43 ASP QB 1 46 SER QB . . 3.990 2.019 1.774 2.598 . 0 0 "[ . 1 . 2]" 1
540 1 44 LEU H 1 44 LEU QB . . 3.620 2.259 2.130 2.717 . 0 0 "[ . 1 . 2]" 1
541 1 44 LEU H 1 44 LEU HG . . 4.270 3.500 2.449 4.271 0.001 15 0 "[ . 1 . 2]" 1
542 1 44 LEU H 1 45 SER H . . 3.990 2.696 1.940 3.306 . 0 0 "[ . 1 . 2]" 1
543 1 44 LEU HA 1 44 LEU MD1 . . 3.660 3.367 3.033 3.765 0.105 16 0 "[ . 1 . 2]" 1
544 1 44 LEU HA 1 44 LEU MD2 . . 3.730 3.237 2.537 3.607 . 0 0 "[ . 1 . 2]" 1
545 1 44 LEU HA 1 44 LEU HG . . 3.570 2.357 2.241 2.622 . 0 0 "[ . 1 . 2]" 1
546 1 44 LEU HA 1 47 LEU H . . 3.870 3.591 3.383 3.792 . 0 0 "[ . 1 . 2]" 1
547 1 44 LEU HA 1 47 LEU HB2 . . 4.880 2.977 2.503 3.212 . 0 0 "[ . 1 . 2]" 1
548 1 44 LEU HA 1 47 LEU QB . . 4.180 2.943 2.484 3.170 . 0 0 "[ . 1 . 2]" 1
549 1 44 LEU HA 1 47 LEU HB3 . . 4.880 4.636 4.155 4.873 . 0 0 "[ . 1 . 2]" 1
550 1 44 LEU HA 1 47 LEU MD1 . . 3.380 2.971 2.606 3.289 . 0 0 "[ . 1 . 2]" 1
551 1 44 LEU HA 1 47 LEU HG . . 4.240 3.762 3.313 4.053 . 0 0 "[ . 1 . 2]" 1
552 1 44 LEU HA 1 63 LEU MD1 . . 4.190 3.575 3.053 4.095 . 0 0 "[ . 1 . 2]" 1
553 1 44 LEU QB 1 44 LEU MD1 . . 2.880 2.014 1.975 2.120 . 0 0 "[ . 1 . 2]" 1
554 1 44 LEU QB 1 44 LEU MD2 . . 2.840 2.016 1.927 2.131 . 0 0 "[ . 1 . 2]" 1
555 1 44 LEU QB 1 45 SER H . . 3.580 2.335 2.103 2.603 . 0 0 "[ . 1 . 2]" 1
556 1 44 LEU QB 1 45 SER HA . . 4.310 3.706 3.611 3.819 . 0 0 "[ . 1 . 2]" 1
557 1 44 LEU MD1 1 64 LYS H . . 5.240 4.781 4.506 5.197 . 0 0 "[ . 1 . 2]" 1
558 1 44 LEU MD1 1 64 LYS HA . . 3.880 3.489 2.787 3.877 . 0 0 "[ . 1 . 2]" 1
559 1 44 LEU MD1 1 65 ARG H . . 3.690 3.367 2.576 3.689 . 0 0 "[ . 1 . 2]" 1
560 1 44 LEU MD1 1 65 ARG HA . . 4.080 3.136 2.370 3.614 . 0 0 "[ . 1 . 2]" 1
561 1 44 LEU MD1 1 65 ARG QB . . 4.110 2.281 1.849 2.957 . 0 0 "[ . 1 . 2]" 1
562 1 44 LEU MD1 1 65 ARG HD2 . . 5.500 4.401 3.292 5.241 . 0 0 "[ . 1 . 2]" 1
563 1 44 LEU MD1 1 65 ARG HD3 . . 5.500 3.596 2.099 4.764 . 0 0 "[ . 1 . 2]" 1
564 1 44 LEU MD2 1 45 SER H . . 4.790 4.412 4.115 4.732 . 0 0 "[ . 1 . 2]" 1
565 1 44 LEU MD2 1 63 LEU HA . . 4.080 3.687 3.200 3.891 . 0 0 "[ . 1 . 2]" 1
566 1 44 LEU MD2 1 63 LEU HB3 . . 3.340 2.098 1.862 2.502 . 0 0 "[ . 1 . 2]" 1
567 1 44 LEU MD2 1 64 LYS H . . 4.570 2.956 2.578 3.314 . 0 0 "[ . 1 . 2]" 1
568 1 44 LEU MD2 1 64 LYS HA . . 3.830 2.163 1.842 2.583 . 0 0 "[ . 1 . 2]" 1
569 1 44 LEU MD2 1 64 LYS HB2 . . 4.560 4.095 3.667 4.538 . 0 0 "[ . 1 . 2]" 1
570 1 44 LEU MD2 1 64 LYS HB3 . . 4.540 4.102 3.792 4.527 . 0 0 "[ . 1 . 2]" 1
571 1 44 LEU MD2 1 65 ARG H . . 3.500 3.157 2.323 3.504 0.004 13 0 "[ . 1 . 2]" 1
572 1 44 LEU MD2 1 65 ARG HA . . 4.920 3.589 2.602 4.199 . 0 0 "[ . 1 . 2]" 1
573 1 45 SER H 1 45 SER QB . . 3.150 2.393 2.187 2.632 . 0 0 "[ . 1 . 2]" 1
574 1 45 SER H 1 46 SER H . . 3.860 2.902 2.518 3.176 . 0 0 "[ . 1 . 2]" 1
575 1 45 SER H 1 47 LEU H . . 4.490 4.060 3.855 4.256 . 0 0 "[ . 1 . 2]" 1
576 1 45 SER HA 1 46 SER HA . . 4.990 4.830 4.745 4.876 . 0 0 "[ . 1 . 2]" 1
577 1 45 SER HA 1 47 LEU H . . 4.190 3.898 3.589 4.169 . 0 0 "[ . 1 . 2]" 1
578 1 45 SER QB 1 46 SER H . . 5.150 2.573 2.153 3.453 . 0 0 "[ . 1 . 2]" 1
579 1 46 SER H 1 46 SER HB2 . . 3.740 2.441 2.197 2.655 . 0 0 "[ . 1 . 2]" 1
580 1 46 SER H 1 46 SER HB3 . . 3.740 3.550 2.948 3.601 . 0 0 "[ . 1 . 2]" 1
581 1 46 SER H 1 47 LEU H . . 3.380 2.736 2.563 2.872 . 0 0 "[ . 1 . 2]" 1
582 1 46 SER H 1 47 LEU MD1 . . 5.500 5.392 5.140 5.502 0.002 16 0 "[ . 1 . 2]" 1
583 1 46 SER H 1 47 LEU MD2 . . 5.500 5.293 4.877 5.499 . 0 0 "[ . 1 . 2]" 1
584 1 46 SER H 1 47 LEU HG . . 5.030 4.452 4.124 4.640 . 0 0 "[ . 1 . 2]" 1
585 1 46 SER HA 1 46 SER QB . . 2.640 2.412 2.339 2.485 . 0 0 "[ . 1 . 2]" 1
586 1 46 SER HA 1 47 LEU HA . . 5.160 4.621 4.579 4.656 . 0 0 "[ . 1 . 2]" 1
587 1 46 SER QB 1 47 LEU H . . 4.060 2.902 2.632 3.247 . 0 0 "[ . 1 . 2]" 1
588 1 46 SER QB 1 47 LEU MD2 . . 4.350 3.373 3.064 3.592 . 0 0 "[ . 1 . 2]" 1
589 1 46 SER QB 1 89 LYS QE . . 3.530 2.545 1.919 3.157 . 0 0 "[ . 1 . 2]" 1
590 1 46 SER QB 1 89 LYS HG2 . . 4.070 3.437 2.895 3.930 . 0 0 "[ . 1 . 2]" 1
591 1 46 SER HB2 1 47 LEU H . . 4.710 3.050 2.694 3.694 . 0 0 "[ . 1 . 2]" 1
592 1 46 SER HB2 1 47 LEU HG . . 4.730 3.341 2.950 4.615 . 0 0 "[ . 1 . 2]" 1
593 1 46 SER HB2 1 89 LYS QE . . 4.060 3.174 2.444 3.925 . 0 0 "[ . 1 . 2]" 1
594 1 46 SER HB2 1 89 LYS HG3 . . 4.080 3.661 3.316 4.083 0.003 4 0 "[ . 1 . 2]" 1
595 1 46 SER HB3 1 47 LEU H . . 4.710 3.802 2.823 4.178 . 0 0 "[ . 1 . 2]" 1
596 1 46 SER HB3 1 47 LEU HG . . 4.730 4.106 3.084 4.568 . 0 0 "[ . 1 . 2]" 1
597 1 46 SER HB3 1 89 LYS QE . . 4.060 2.721 2.000 3.675 . 0 0 "[ . 1 . 2]" 1
598 1 46 SER HB3 1 89 LYS HG3 . . 4.080 2.521 2.105 3.122 . 0 0 "[ . 1 . 2]" 1
599 1 47 LEU H 1 47 LEU HB2 . . 3.730 2.492 2.408 2.566 . 0 0 "[ . 1 . 2]" 1
600 1 47 LEU H 1 47 LEU QB . . 3.200 2.452 2.375 2.519 . 0 0 "[ . 1 . 2]" 1
601 1 47 LEU H 1 47 LEU HB3 . . 3.730 3.651 3.618 3.677 . 0 0 "[ . 1 . 2]" 1
602 1 47 LEU H 1 47 LEU MD1 . . 4.280 3.771 3.627 3.962 . 0 0 "[ . 1 . 2]" 1
603 1 47 LEU H 1 47 LEU MD2 . . 3.740 3.593 3.300 3.722 . 0 0 "[ . 1 . 2]" 1
604 1 47 LEU H 1 47 LEU HG . . 2.860 2.584 2.434 2.824 . 0 0 "[ . 1 . 2]" 1
605 1 47 LEU H 1 48 THR H . . 4.610 4.556 4.518 4.588 . 0 0 "[ . 1 . 2]" 1
606 1 47 LEU H 1 63 LEU MD1 . . 4.730 4.504 3.971 4.732 0.002 16 0 "[ . 1 . 2]" 1
607 1 47 LEU HA 1 47 LEU MD1 . . 4.400 3.885 3.831 3.942 . 0 0 "[ . 1 . 2]" 1
608 1 47 LEU HA 1 47 LEU MD2 . . 3.100 2.208 2.090 2.366 . 0 0 "[ . 1 . 2]" 1
609 1 47 LEU HA 1 48 THR H . . 2.720 2.416 2.336 2.514 . 0 0 "[ . 1 . 2]" 1
610 1 47 LEU HA 1 48 THR HA . . 5.460 4.418 4.379 4.473 . 0 0 "[ . 1 . 2]" 1
611 1 47 LEU HA 1 63 LEU MD1 . . 5.110 4.703 4.265 4.979 . 0 0 "[ . 1 . 2]" 1
612 1 47 LEU HA 1 87 ILE MG . . 4.790 4.182 4.000 4.330 . 0 0 "[ . 1 . 2]" 1
613 1 47 LEU HA 1 88 LYS H . . 5.040 4.568 4.355 4.742 . 0 0 "[ . 1 . 2]" 1
614 1 47 LEU HA 1 89 LYS HA . . 4.240 2.358 2.183 2.536 . 0 0 "[ . 1 . 2]" 1
615 1 47 LEU HA 1 89 LYS HB2 . . 4.950 3.468 3.173 3.936 . 0 0 "[ . 1 . 2]" 1
616 1 47 LEU HA 1 89 LYS HG3 . . 5.260 3.377 3.035 3.683 . 0 0 "[ . 1 . 2]" 1
617 1 47 LEU HA 1 94 VAL MG1 . . 5.190 3.870 3.625 4.149 . 0 0 "[ . 1 . 2]" 1
618 1 47 LEU QB 1 48 THR H . . 3.230 2.358 2.154 2.538 . 0 0 "[ . 1 . 2]" 1
619 1 47 LEU QB 1 87 ILE MG . . 3.480 2.678 2.472 2.997 . 0 0 "[ . 1 . 2]" 1
620 1 47 LEU HB2 1 47 LEU MD1 . . 3.340 2.303 2.129 2.427 . 0 0 "[ . 1 . 2]" 1
621 1 47 LEU HB2 1 47 LEU MD2 . . 3.240 3.179 3.166 3.187 . 0 0 "[ . 1 . 2]" 1
622 1 47 LEU HB2 1 48 THR H . . 3.680 3.549 3.362 3.682 0.002 16 0 "[ . 1 . 2]" 1
623 1 47 LEU HB2 1 63 LEU MD1 . . 3.370 2.791 2.416 3.033 . 0 0 "[ . 1 . 2]" 1
624 1 47 LEU HB3 1 47 LEU MD1 . . 3.340 2.357 2.209 2.539 . 0 0 "[ . 1 . 2]" 1
625 1 47 LEU HB3 1 47 LEU MD2 . . 3.240 2.257 2.158 2.354 . 0 0 "[ . 1 . 2]" 1
626 1 47 LEU HB3 1 48 THR H . . 3.680 2.394 2.178 2.590 . 0 0 "[ . 1 . 2]" 1
627 1 47 LEU HB3 1 63 LEU MD1 . . 3.370 3.120 2.715 3.368 . 0 0 "[ . 1 . 2]" 1
628 1 47 LEU MD1 1 48 THR H . . 4.880 4.392 4.152 4.676 . 0 0 "[ . 1 . 2]" 1
629 1 47 LEU MD2 1 48 THR H . . 3.440 3.290 3.061 3.434 . 0 0 "[ . 1 . 2]" 1
630 1 47 LEU MD2 1 87 ILE MG . . 3.230 3.009 2.758 3.223 . 0 0 "[ . 1 . 2]" 1
631 1 47 LEU MD2 1 88 LYS H . . 4.830 4.401 4.180 4.682 . 0 0 "[ . 1 . 2]" 1
632 1 47 LEU MD2 1 89 LYS H . . 4.360 4.141 3.978 4.338 . 0 0 "[ . 1 . 2]" 1
633 1 47 LEU MD2 1 89 LYS HA . . 3.830 2.980 2.622 3.231 . 0 0 "[ . 1 . 2]" 1
634 1 47 LEU MD2 1 89 LYS HB2 . . 3.180 2.132 1.904 2.359 . 0 0 "[ . 1 . 2]" 1
635 1 47 LEU MD2 1 89 LYS HB3 . . 3.900 3.561 3.310 3.730 . 0 0 "[ . 1 . 2]" 1
636 1 47 LEU MD2 1 89 LYS QD . . 3.480 3.342 2.587 3.482 0.002 12 0 "[ . 1 . 2]" 1
637 1 47 LEU MD2 1 89 LYS QE . . 3.710 2.163 1.762 3.482 . 0 0 "[ . 1 . 2]" 1
638 1 47 LEU MD2 1 94 VAL HB . . 4.870 3.609 3.294 3.969 . 0 0 "[ . 1 . 2]" 1
639 1 47 LEU MD2 1 94 VAL MG1 . . 3.100 1.976 1.774 2.210 . 0 0 "[ . 1 . 2]" 1
640 1 47 LEU HG 1 89 LYS QE . . 4.400 3.414 2.940 4.277 . 0 0 "[ . 1 . 2]" 1
641 1 48 THR H 1 48 THR HB . . 3.590 2.900 2.722 3.603 0.013 15 0 "[ . 1 . 2]" 1
642 1 48 THR H 1 48 THR MG . . 4.020 3.883 3.419 3.963 . 0 0 "[ . 1 . 2]" 1
643 1 48 THR H 1 49 ALA H . . 4.530 4.490 4.433 4.539 0.009 9 0 "[ . 1 . 2]" 1
644 1 48 THR H 1 87 ILE HA . . 4.190 3.768 3.587 3.960 . 0 0 "[ . 1 . 2]" 1
645 1 48 THR H 1 87 ILE MG . . 3.670 2.984 2.634 3.230 . 0 0 "[ . 1 . 2]" 1
646 1 48 THR H 1 88 LYS H . . 3.390 2.690 2.476 2.890 . 0 0 "[ . 1 . 2]" 1
647 1 48 THR H 1 88 LYS HB2 . . 5.440 4.527 4.289 4.761 . 0 0 "[ . 1 . 2]" 1
648 1 48 THR H 1 89 LYS HA . . 4.240 3.765 3.610 4.014 . 0 0 "[ . 1 . 2]" 1
649 1 48 THR H 1 94 VAL MG1 . . 5.500 4.174 3.969 4.372 . 0 0 "[ . 1 . 2]" 1
650 1 48 THR H 1 94 VAL MG2 . . 5.500 4.755 4.518 4.934 . 0 0 "[ . 1 . 2]" 1
651 1 48 THR HA 1 48 THR MG . . 3.050 2.130 1.991 2.268 . 0 0 "[ . 1 . 2]" 1
652 1 48 THR HA 1 49 ALA H . . 2.630 2.313 2.247 2.431 . 0 0 "[ . 1 . 2]" 1
653 1 48 THR HA 1 49 ALA HA . . 4.790 4.434 4.396 4.481 . 0 0 "[ . 1 . 2]" 1
654 1 48 THR HA 1 49 ALA MB . . 4.170 3.830 3.749 3.921 . 0 0 "[ . 1 . 2]" 1
655 1 48 THR HA 1 63 LEU MD1 . . 4.350 3.501 2.663 3.912 . 0 0 "[ . 1 . 2]" 1
656 1 48 THR HB 1 49 ALA H . . 3.580 3.471 2.844 3.580 0.000 14 0 "[ . 1 . 2]" 1
657 1 48 THR HB 1 49 ALA HA . . 5.380 4.394 4.110 4.492 . 0 0 "[ . 1 . 2]" 1
658 1 48 THR HB 1 87 ILE HA . . 3.800 3.518 3.203 3.783 . 0 0 "[ . 1 . 2]" 1
659 1 48 THR HB 1 88 LYS H . . 4.680 2.493 2.130 3.083 . 0 0 "[ . 1 . 2]" 1
660 1 48 THR HB 1 88 LYS HB3 . . 5.500 5.213 4.922 5.498 . 0 0 "[ . 1 . 2]" 1
661 1 48 THR HG1 1 88 LYS H . . 3.810 3.089 2.507 3.510 . 0 0 "[ . 1 . 2]" 1
662 1 48 THR MG 1 49 ALA H . . 3.420 2.133 1.825 3.305 . 0 0 "[ . 1 . 2]" 1
663 1 49 ALA H 1 49 ALA MB . . 3.030 2.507 2.411 2.598 . 0 0 "[ . 1 . 2]" 1
664 1 49 ALA H 1 63 LEU MD1 . . 3.860 3.486 2.927 3.812 . 0 0 "[ . 1 . 2]" 1
665 1 49 ALA HA 1 50 SER H . . 2.680 2.143 2.140 2.149 . 0 0 "[ . 1 . 2]" 1
666 1 49 ALA HA 1 50 SER HA . . 4.460 4.398 4.388 4.409 . 0 0 "[ . 1 . 2]" 1
667 1 49 ALA HA 1 63 LEU MD1 . . 3.730 2.981 2.329 3.327 . 0 0 "[ . 1 . 2]" 1
668 1 49 ALA HA 1 63 LEU HG . . 5.300 3.822 3.534 4.192 . 0 0 "[ . 1 . 2]" 1
669 1 49 ALA HA 1 85 VAL MG1 . . 4.710 3.579 3.390 3.772 . 0 0 "[ . 1 . 2]" 1
670 1 49 ALA HA 1 87 ILE HA . . 3.820 3.633 3.261 3.786 . 0 0 "[ . 1 . 2]" 1
671 1 49 ALA HA 1 87 ILE MD . . 3.920 2.217 1.963 2.333 . 0 0 "[ . 1 . 2]" 1
672 1 49 ALA HA 1 87 ILE HG13 . . 5.250 4.935 4.659 5.130 . 0 0 "[ . 1 . 2]" 1
673 1 49 ALA HA 1 87 ILE MG . . 4.430 3.874 3.575 4.123 . 0 0 "[ . 1 . 2]" 1
674 1 49 ALA MB 1 50 SER H . . 3.350 3.230 3.168 3.305 . 0 0 "[ . 1 . 2]" 1
675 1 49 ALA MB 1 61 CYS H . . 4.910 4.821 4.592 4.911 0.001 8 0 "[ . 1 . 2]" 1
676 1 49 ALA MB 1 61 CYS HB2 . . 4.660 3.142 2.698 3.756 . 0 0 "[ . 1 . 2]" 1
677 1 49 ALA MB 1 61 CYS HB3 . . 4.670 4.309 3.999 4.602 . 0 0 "[ . 1 . 2]" 1
678 1 49 ALA MB 1 62 LEU HA . . 4.320 3.320 2.868 3.860 . 0 0 "[ . 1 . 2]" 1
679 1 49 ALA MB 1 63 LEU H . . 4.130 2.992 2.542 3.529 . 0 0 "[ . 1 . 2]" 1
680 1 49 ALA MB 1 63 LEU HA . . 4.770 3.934 3.559 4.236 . 0 0 "[ . 1 . 2]" 1
681 1 49 ALA MB 1 63 LEU HB2 . . 3.820 2.984 2.535 3.648 . 0 0 "[ . 1 . 2]" 1
682 1 49 ALA MB 1 63 LEU HB3 . . 4.250 4.079 3.826 4.248 . 0 0 "[ . 1 . 2]" 1
683 1 49 ALA MB 1 63 LEU MD1 . . 2.740 2.023 1.839 2.236 . 0 0 "[ . 1 . 2]" 1
684 1 49 ALA MB 1 63 LEU HG . . 3.070 1.985 1.796 2.300 . 0 0 "[ . 1 . 2]" 1
685 1 49 ALA MB 1 73 ILE MD . . 2.680 2.028 1.812 2.276 . 0 0 "[ . 1 . 2]" 1
686 1 50 SER H 1 50 SER HB2 . . 3.900 2.853 2.722 3.133 . 0 0 "[ . 1 . 2]" 1
687 1 50 SER H 1 50 SER HB3 . . 3.900 3.620 3.080 3.907 0.007 15 0 "[ . 1 . 2]" 1
688 1 50 SER H 1 51 ILE H . . 4.430 4.265 4.148 4.327 . 0 0 "[ . 1 . 2]" 1
689 1 50 SER H 1 51 ILE HG13 . . 4.780 3.685 3.405 3.858 . 0 0 "[ . 1 . 2]" 1
690 1 50 SER H 1 85 VAL HA . . 4.710 4.375 4.169 4.627 . 0 0 "[ . 1 . 2]" 1
691 1 50 SER H 1 85 VAL MG1 . . 3.680 2.718 2.477 2.975 . 0 0 "[ . 1 . 2]" 1
692 1 50 SER H 1 86 SER H . . 3.670 3.493 3.162 3.653 . 0 0 "[ . 1 . 2]" 1
693 1 50 SER H 1 86 SER HB2 . . 4.110 3.908 3.662 4.043 . 0 0 "[ . 1 . 2]" 1
694 1 50 SER H 1 86 SER HB3 . . 5.500 5.427 5.204 5.506 0.006 16 0 "[ . 1 . 2]" 1
695 1 50 SER H 1 87 ILE MD . . 4.640 2.548 2.482 2.999 . 0 0 "[ . 1 . 2]" 1
696 1 50 SER H 1 87 ILE HG13 . . 5.500 5.471 5.391 5.504 0.004 16 0 "[ . 1 . 2]" 1
697 1 50 SER HA 1 51 ILE H . . 2.950 2.193 2.145 2.234 . 0 0 "[ . 1 . 2]" 1
698 1 50 SER HA 1 51 ILE HB . . 4.550 4.505 4.421 4.563 0.013 13 0 "[ . 1 . 2]" 1
699 1 50 SER HA 1 51 ILE HG13 . . 4.000 3.737 3.592 3.919 . 0 0 "[ . 1 . 2]" 1
700 1 50 SER QB 1 51 ILE H . . 3.510 3.181 2.936 3.510 . 0 0 "[ . 1 . 2]" 1
701 1 51 ILE H 1 51 ILE HB . . 3.380 2.790 2.692 2.879 . 0 0 "[ . 1 . 2]" 1
702 1 51 ILE H 1 51 ILE MD . . 4.540 4.307 4.110 4.453 . 0 0 "[ . 1 . 2]" 1
703 1 51 ILE H 1 51 ILE HG12 . . 4.350 4.126 3.989 4.299 . 0 0 "[ . 1 . 2]" 1
704 1 51 ILE H 1 51 ILE HG13 . . 4.050 3.145 3.004 3.302 . 0 0 "[ . 1 . 2]" 1
705 1 51 ILE H 1 51 ILE MG . . 4.080 3.887 3.839 3.929 . 0 0 "[ . 1 . 2]" 1
706 1 51 ILE H 1 52 LYS H . . 4.700 4.326 4.210 4.420 . 0 0 "[ . 1 . 2]" 1
707 1 51 ILE H 1 58 ASP HA . . 5.160 5.034 4.891 5.162 0.002 15 0 "[ . 1 . 2]" 1
708 1 51 ILE H 1 59 GLU H . . 4.060 3.905 3.720 4.060 . 0 0 "[ . 1 . 2]" 1
709 1 51 ILE HA 1 51 ILE MD . . 4.300 3.798 3.720 3.877 . 0 0 "[ . 1 . 2]" 1
710 1 51 ILE HA 1 52 LYS QB . . 4.090 3.991 3.930 4.046 . 0 0 "[ . 1 . 2]" 1
711 1 51 ILE HB 1 51 ILE MD . . 3.250 2.409 2.305 2.502 . 0 0 "[ . 1 . 2]" 1
712 1 51 ILE HB 1 52 LYS H . . 4.250 4.044 3.870 4.206 . 0 0 "[ . 1 . 2]" 1
713 1 51 ILE HB 1 58 ASP HA . . 5.500 5.229 4.976 5.473 . 0 0 "[ . 1 . 2]" 1
714 1 51 ILE HB 1 59 GLU H . . 4.350 3.590 3.345 3.812 . 0 0 "[ . 1 . 2]" 1
715 1 51 ILE HB 1 59 GLU HA . . 5.500 5.265 5.175 5.481 . 0 0 "[ . 1 . 2]" 1
716 1 51 ILE HB 1 59 GLU HB3 . . 4.370 4.285 4.105 4.373 0.003 9 0 "[ . 1 . 2]" 1
717 1 51 ILE HB 1 59 GLU QG . . 4.650 4.037 3.249 4.665 0.015 13 0 "[ . 1 . 2]" 1
718 1 51 ILE HB 1 61 CYS HA . . 5.500 5.077 4.711 5.330 . 0 0 "[ . 1 . 2]" 1
719 1 51 ILE HB 1 61 CYS HB3 . . 4.000 2.872 2.527 3.288 . 0 0 "[ . 1 . 2]" 1
720 1 51 ILE HB 1 75 PHE HB2 . . 5.460 4.302 4.068 4.665 . 0 0 "[ . 1 . 2]" 1
721 1 51 ILE HB 1 75 PHE HB3 . . 5.470 4.665 4.412 4.936 . 0 0 "[ . 1 . 2]" 1
722 1 51 ILE HB 1 83 HIS HD2 . . 5.370 4.645 4.376 4.939 . 0 0 "[ . 1 . 2]" 1
723 1 51 ILE HB 1 85 VAL MG2 . . 4.540 4.439 4.239 4.542 0.002 16 0 "[ . 1 . 2]" 1
724 1 51 ILE MD 1 51 ILE MG . . 3.160 1.990 1.891 2.141 . 0 0 "[ . 1 . 2]" 1
725 1 51 ILE MD 1 52 LYS H . . 5.190 4.852 4.551 5.016 . 0 0 "[ . 1 . 2]" 1
726 1 51 ILE MD 1 61 CYS HA . . 4.610 3.617 3.356 3.861 . 0 0 "[ . 1 . 2]" 1
727 1 51 ILE MD 1 61 CYS HB2 . . 3.710 2.587 1.995 3.300 . 0 0 "[ . 1 . 2]" 1
728 1 51 ILE MD 1 61 CYS HB3 . . 3.500 2.133 1.932 2.488 . 0 0 "[ . 1 . 2]" 1
729 1 51 ILE MD 1 62 LEU H . . 4.880 4.580 4.229 4.775 . 0 0 "[ . 1 . 2]" 1
730 1 51 ILE MD 1 73 ILE MD . . 3.360 2.099 1.776 2.589 . 0 0 "[ . 1 . 2]" 1
731 1 51 ILE MD 1 73 ILE HG12 . . 4.010 2.969 2.692 3.371 . 0 0 "[ . 1 . 2]" 1
732 1 51 ILE MD 1 73 ILE HG13 . . 4.690 4.199 3.999 4.528 . 0 0 "[ . 1 . 2]" 1
733 1 51 ILE MD 1 73 ILE MG . . 3.960 2.760 2.374 3.135 . 0 0 "[ . 1 . 2]" 1
734 1 51 ILE MD 1 75 PHE HB2 . . 3.930 3.064 2.728 3.410 . 0 0 "[ . 1 . 2]" 1
735 1 51 ILE MD 1 75 PHE HB3 . . 3.800 2.559 2.279 2.811 . 0 0 "[ . 1 . 2]" 1
736 1 51 ILE MD 1 75 PHE QD . . 3.580 2.504 2.294 2.706 . 0 0 "[ . 1 . 2]" 1
737 1 51 ILE MD 1 75 PHE QE . . 4.090 2.896 2.697 3.072 . 0 0 "[ . 1 . 2]" 1
738 1 51 ILE MD 1 75 PHE HZ . . 5.040 3.644 3.263 3.901 . 0 0 "[ . 1 . 2]" 1
739 1 51 ILE MD 1 83 HIS HB2 . . 5.370 5.023 4.689 5.283 . 0 0 "[ . 1 . 2]" 1
740 1 51 ILE MD 1 83 HIS HB3 . . 4.880 4.140 3.845 4.527 . 0 0 "[ . 1 . 2]" 1
741 1 51 ILE MD 1 83 HIS HD2 . . 4.540 4.146 3.834 4.436 . 0 0 "[ . 1 . 2]" 1
742 1 51 ILE MD 1 85 VAL MG1 . . 3.690 2.521 2.206 2.724 . 0 0 "[ . 1 . 2]" 1
743 1 51 ILE MD 1 85 VAL MG2 . . 3.510 2.183 1.896 2.531 . 0 0 "[ . 1 . 2]" 1
744 1 51 ILE HG12 1 51 ILE MG . . 3.130 2.379 2.292 2.498 . 0 0 "[ . 1 . 2]" 1
745 1 51 ILE HG12 1 52 LYS H . . 4.440 4.199 3.971 4.316 . 0 0 "[ . 1 . 2]" 1
746 1 51 ILE HG12 1 61 CYS HB2 . . 5.210 4.634 4.193 5.078 . 0 0 "[ . 1 . 2]" 1
747 1 51 ILE HG12 1 61 CYS HB3 . . 4.960 4.096 3.843 4.589 . 0 0 "[ . 1 . 2]" 1
748 1 51 ILE HG12 1 83 HIS HD2 . . 5.470 5.348 4.931 5.466 . 0 0 "[ . 1 . 2]" 1
749 1 51 ILE HG12 1 85 VAL HA . . 4.500 2.349 2.058 2.546 . 0 0 "[ . 1 . 2]" 1
750 1 51 ILE HG12 1 86 SER H . . 4.170 3.973 3.682 4.163 . 0 0 "[ . 1 . 2]" 1
751 1 51 ILE HG13 1 52 LYS H . . 5.040 4.986 4.878 5.042 0.002 11 0 "[ . 1 . 2]" 1
752 1 51 ILE HG13 1 61 CYS HB2 . . 4.410 3.177 2.882 3.695 . 0 0 "[ . 1 . 2]" 1
753 1 51 ILE HG13 1 61 CYS HB3 . . 4.550 2.647 2.337 3.278 . 0 0 "[ . 1 . 2]" 1
754 1 51 ILE HG13 1 73 ILE MD . . 3.950 2.820 2.358 3.011 . 0 0 "[ . 1 . 2]" 1
755 1 51 ILE HG13 1 85 VAL HA . . 4.880 3.551 3.117 3.768 . 0 0 "[ . 1 . 2]" 1
756 1 51 ILE HG13 1 85 VAL MG2 . . 3.820 3.387 3.123 3.590 . 0 0 "[ . 1 . 2]" 1
757 1 51 ILE HG13 1 86 SER H . . 4.780 4.436 4.111 4.624 . 0 0 "[ . 1 . 2]" 1
758 1 51 ILE MG 1 52 LYS H . . 3.640 2.135 1.919 2.338 . 0 0 "[ . 1 . 2]" 1
759 1 51 ILE MG 1 52 LYS HA . . 4.750 3.393 3.015 3.510 . 0 0 "[ . 1 . 2]" 1
760 1 51 ILE MG 1 53 ALA H . . 4.980 3.630 3.328 4.182 . 0 0 "[ . 1 . 2]" 1
761 1 51 ILE MG 1 53 ALA HA . . 4.770 3.936 3.690 4.215 . 0 0 "[ . 1 . 2]" 1
762 1 51 ILE MG 1 59 GLU H . . 4.330 3.842 3.550 4.216 . 0 0 "[ . 1 . 2]" 1
763 1 51 ILE MG 1 59 GLU HB2 . . 4.320 2.589 2.215 3.012 . 0 0 "[ . 1 . 2]" 1
764 1 51 ILE MG 1 59 GLU HB3 . . 4.300 3.888 3.525 4.255 . 0 0 "[ . 1 . 2]" 1
765 1 51 ILE MG 1 59 GLU QG . . 3.960 2.868 2.209 3.735 . 0 0 "[ . 1 . 2]" 1
766 1 51 ILE MG 1 61 CYS HB3 . . 4.470 4.048 3.714 4.307 . 0 0 "[ . 1 . 2]" 1
767 1 51 ILE MG 1 75 PHE QD . . 4.420 3.605 3.350 3.848 . 0 0 "[ . 1 . 2]" 1
768 1 51 ILE MG 1 75 PHE QE . . 4.400 3.305 2.980 3.677 . 0 0 "[ . 1 . 2]" 1
769 1 51 ILE MG 1 75 PHE HZ . . 5.280 3.769 3.568 4.128 . 0 0 "[ . 1 . 2]" 1
770 1 51 ILE MG 1 83 HIS HB2 . . 4.190 3.967 3.795 4.173 . 0 0 "[ . 1 . 2]" 1
771 1 51 ILE MG 1 83 HIS HB3 . . 3.650 2.652 2.478 2.861 . 0 0 "[ . 1 . 2]" 1
772 1 51 ILE MG 1 83 HIS HD2 . . 3.510 2.233 2.009 2.412 . 0 0 "[ . 1 . 2]" 1
773 1 51 ILE MG 1 84 LEU H . . 4.210 3.664 3.270 3.958 . 0 0 "[ . 1 . 2]" 1
774 1 51 ILE MG 1 85 VAL HA . . 4.640 3.534 3.177 3.729 . 0 0 "[ . 1 . 2]" 1
775 1 52 LYS H 1 52 LYS QB . . 3.100 2.618 2.528 2.792 . 0 0 "[ . 1 . 2]" 1
776 1 52 LYS H 1 52 LYS HG2 . . 5.140 4.776 4.412 4.961 . 0 0 "[ . 1 . 2]" 1
777 1 52 LYS H 1 52 LYS QG . . 4.440 4.079 3.997 4.168 . 0 0 "[ . 1 . 2]" 1
778 1 52 LYS H 1 52 LYS HG3 . . 5.140 4.440 4.289 4.642 . 0 0 "[ . 1 . 2]" 1
779 1 52 LYS H 1 53 ALA H . . 4.260 4.038 3.899 4.268 0.008 19 0 "[ . 1 . 2]" 1
780 1 52 LYS H 1 58 ASP HA . . 5.370 4.945 4.555 5.164 . 0 0 "[ . 1 . 2]" 1
781 1 52 LYS H 1 84 LEU H . . 3.660 3.545 3.301 3.660 0.000 11 0 "[ . 1 . 2]" 1
782 1 52 LYS H 1 86 SER H . . 5.500 4.780 4.544 5.198 . 0 0 "[ . 1 . 2]" 1
783 1 52 LYS HA 1 52 LYS HD2 . . 4.700 3.353 2.681 4.536 . 0 0 "[ . 1 . 2]" 1
784 1 52 LYS HA 1 52 LYS HD3 . . 4.420 3.119 2.423 3.911 . 0 0 "[ . 1 . 2]" 1
785 1 52 LYS HA 1 52 LYS HG2 . . 4.190 3.774 3.482 3.892 . 0 0 "[ . 1 . 2]" 1
786 1 52 LYS HA 1 52 LYS QG . . 3.540 2.710 2.388 2.903 . 0 0 "[ . 1 . 2]" 1
787 1 52 LYS HA 1 52 LYS HG3 . . 4.190 2.778 2.432 2.996 . 0 0 "[ . 1 . 2]" 1
788 1 52 LYS HA 1 53 ALA H . . 2.890 2.160 2.141 2.183 . 0 0 "[ . 1 . 2]" 1
789 1 52 LYS HA 1 57 ARG H . . 5.500 4.744 4.562 5.006 . 0 0 "[ . 1 . 2]" 1
790 1 52 LYS HA 1 58 ASP H . . 5.210 4.544 4.277 4.734 . 0 0 "[ . 1 . 2]" 1
791 1 52 LYS HA 1 58 ASP HA . . 3.470 2.310 1.996 2.555 . 0 0 "[ . 1 . 2]" 1
792 1 52 LYS HA 1 58 ASP HB2 . . 5.040 4.203 3.982 4.352 . 0 0 "[ . 1 . 2]" 1
793 1 52 LYS HA 1 58 ASP HB3 . . 5.450 5.215 4.961 5.417 . 0 0 "[ . 1 . 2]" 1
794 1 52 LYS HA 1 59 GLU H . . 4.340 3.434 2.793 3.825 . 0 0 "[ . 1 . 2]" 1
795 1 52 LYS QB 1 52 LYS QE . . 4.010 3.169 2.376 3.713 . 0 0 "[ . 1 . 2]" 1
796 1 52 LYS QB 1 53 ALA H . . 4.080 3.882 3.702 3.971 . 0 0 "[ . 1 . 2]" 1
797 1 52 LYS QB 1 58 ASP HA . . 4.110 3.470 2.266 4.027 . 0 0 "[ . 1 . 2]" 1
798 1 52 LYS HD2 1 52 LYS QE . . 2.760 2.204 2.149 2.340 . 0 0 "[ . 1 . 2]" 1
799 1 52 LYS HD2 1 56 GLY HA2 . . 4.160 2.816 2.055 3.308 . 0 0 "[ . 1 . 2]" 1
800 1 52 LYS HD2 1 56 GLY HA3 . . 4.560 3.998 3.439 4.426 . 0 0 "[ . 1 . 2]" 1
801 1 52 LYS HD2 1 58 ASP H . . 3.690 3.379 2.970 3.691 0.001 18 0 "[ . 1 . 2]" 1
802 1 52 LYS HD2 1 58 ASP HA . . 3.970 3.392 2.727 3.988 0.018 13 0 "[ . 1 . 2]" 1
803 1 52 LYS HD2 1 58 ASP HB2 . . 4.620 3.844 3.229 4.521 . 0 0 "[ . 1 . 2]" 1
804 1 52 LYS HD2 1 58 ASP HB3 . . 5.130 4.695 4.215 5.134 0.004 18 0 "[ . 1 . 2]" 1
805 1 52 LYS HD3 1 53 ALA H . . 5.500 4.576 3.305 5.432 . 0 0 "[ . 1 . 2]" 1
806 1 52 LYS HD3 1 56 GLY HA2 . . 4.370 4.126 3.806 4.293 . 0 0 "[ . 1 . 2]" 1
807 1 52 LYS HD3 1 56 GLY HA3 . . 5.500 5.411 5.171 5.528 0.028 16 0 "[ . 1 . 2]" 1
808 1 52 LYS HD3 1 58 ASP HA . . 4.150 3.161 2.333 3.744 . 0 0 "[ . 1 . 2]" 1
809 1 52 LYS HD3 1 58 ASP HB2 . . 4.820 3.224 2.872 3.783 . 0 0 "[ . 1 . 2]" 1
810 1 52 LYS HD3 1 58 ASP HB3 . . 5.500 4.562 4.000 5.172 . 0 0 "[ . 1 . 2]" 1
811 1 52 LYS QE 1 56 GLY H . . 4.860 4.349 4.060 4.891 0.031 9 0 "[ . 1 . 2]" 1
812 1 52 LYS QE 1 56 GLY HA2 . . 4.520 2.311 1.965 3.018 . 0 0 "[ . 1 . 2]" 1
813 1 52 LYS QE 1 56 GLY HA3 . . 4.240 3.237 2.613 3.993 . 0 0 "[ . 1 . 2]" 1
814 1 52 LYS QG 1 53 ALA H . . 3.500 3.098 2.628 3.365 . 0 0 "[ . 1 . 2]" 1
815 1 52 LYS QG 1 56 GLY H . . 3.870 3.324 3.203 3.426 . 0 0 "[ . 1 . 2]" 1
816 1 52 LYS QG 1 56 GLY HA3 . . 4.360 3.994 3.755 4.370 0.010 19 0 "[ . 1 . 2]" 1
817 1 52 LYS QG 1 58 ASP HA . . 4.660 3.924 2.714 4.392 . 0 0 "[ . 1 . 2]" 1
818 1 52 LYS HG2 1 56 GLY H . . 4.590 4.348 3.422 4.601 0.011 2 0 "[ . 1 . 2]" 1
819 1 52 LYS HG2 1 56 GLY HA2 . . 4.380 2.987 2.337 3.343 . 0 0 "[ . 1 . 2]" 1
820 1 52 LYS HG2 1 56 GLY HA3 . . 5.040 4.649 4.052 5.048 0.008 9 0 "[ . 1 . 2]" 1
821 1 52 LYS HG3 1 56 GLY H . . 4.590 3.532 3.353 4.020 . 0 0 "[ . 1 . 2]" 1
822 1 52 LYS HG3 1 56 GLY HA2 . . 4.380 2.739 2.363 3.225 . 0 0 "[ . 1 . 2]" 1
823 1 52 LYS HG3 1 56 GLY HA3 . . 5.040 4.381 4.060 4.803 . 0 0 "[ . 1 . 2]" 1
824 1 53 ALA H 1 53 ALA MB . . 3.030 2.048 2.032 2.082 . 0 0 "[ . 1 . 2]" 1
825 1 53 ALA H 1 54 PRO HD2 . . 5.220 4.653 4.642 4.679 . 0 0 "[ . 1 . 2]" 1
826 1 53 ALA H 1 54 PRO HD3 . . 5.140 5.064 5.047 5.114 . 0 0 "[ . 1 . 2]" 1
827 1 53 ALA H 1 56 GLY H . . 4.720 4.656 4.455 4.721 0.001 5 0 "[ . 1 . 2]" 1
828 1 53 ALA H 1 57 ARG H . . 4.320 3.526 3.188 3.882 . 0 0 "[ . 1 . 2]" 1
829 1 53 ALA H 1 57 ARG HB2 . . 4.320 3.868 3.602 4.183 . 0 0 "[ . 1 . 2]" 1
830 1 53 ALA H 1 58 ASP HA . . 3.990 3.424 3.285 3.689 . 0 0 "[ . 1 . 2]" 1
831 1 53 ALA H 1 59 GLU H . . 4.690 4.381 3.925 4.678 . 0 0 "[ . 1 . 2]" 1
832 1 53 ALA H 1 59 GLU QG . . 4.620 2.921 2.156 3.726 . 0 0 "[ . 1 . 2]" 1
833 1 53 ALA H 1 83 HIS HD2 . . 5.260 3.981 3.584 4.658 . 0 0 "[ . 1 . 2]" 1
834 1 53 ALA HA 1 54 PRO HD2 . . 3.470 2.639 2.593 2.658 . 0 0 "[ . 1 . 2]" 1
835 1 53 ALA HA 1 54 PRO HD3 . . 3.150 2.422 2.394 2.435 . 0 0 "[ . 1 . 2]" 1
836 1 53 ALA HA 1 54 PRO HG2 . . 4.810 4.710 4.672 4.727 . 0 0 "[ . 1 . 2]" 1
837 1 53 ALA HA 1 54 PRO HG3 . . 4.660 4.633 4.600 4.648 . 0 0 "[ . 1 . 2]" 1
838 1 53 ALA HA 1 55 SER H . . 4.340 4.107 4.027 4.159 . 0 0 "[ . 1 . 2]" 1
839 1 53 ALA HA 1 83 HIS HA . . 3.930 3.424 3.251 3.583 . 0 0 "[ . 1 . 2]" 1
840 1 53 ALA HA 1 83 HIS HB2 . . 5.230 5.061 4.910 5.198 . 0 0 "[ . 1 . 2]" 1
841 1 53 ALA HA 1 83 HIS HB3 . . 4.970 4.282 4.105 4.524 . 0 0 "[ . 1 . 2]" 1
842 1 53 ALA HA 1 83 HIS HD2 . . 3.840 3.062 2.725 3.599 . 0 0 "[ . 1 . 2]" 1
843 1 53 ALA HA 1 83 HIS HE1 . . 5.160 3.728 3.288 4.305 . 0 0 "[ . 1 . 2]" 1
844 1 53 ALA HA 1 84 LEU H . . 4.600 4.400 4.142 4.595 . 0 0 "[ . 1 . 2]" 1
845 1 53 ALA MB 1 54 PRO HA . . 4.800 4.311 4.300 4.337 . 0 0 "[ . 1 . 2]" 1
846 1 53 ALA MB 1 54 PRO HD2 . . 3.100 1.897 1.877 1.938 . 0 0 "[ . 1 . 2]" 1
847 1 53 ALA MB 1 54 PRO HD3 . . 3.390 2.966 2.928 3.049 . 0 0 "[ . 1 . 2]" 1
848 1 53 ALA MB 1 54 PRO HG2 . . 4.930 3.496 3.447 3.570 . 0 0 "[ . 1 . 2]" 1
849 1 53 ALA MB 1 54 PRO HG3 . . 4.450 4.158 4.137 4.202 . 0 0 "[ . 1 . 2]" 1
850 1 53 ALA MB 1 55 SER H . . 3.530 2.136 2.102 2.191 . 0 0 "[ . 1 . 2]" 1
851 1 53 ALA MB 1 56 GLY H . . 3.690 3.332 3.160 3.502 . 0 0 "[ . 1 . 2]" 1
852 1 53 ALA MB 1 57 ARG H . . 3.390 2.558 2.389 2.783 . 0 0 "[ . 1 . 2]" 1
853 1 53 ALA MB 1 57 ARG HB2 . . 3.560 2.276 1.945 2.502 . 0 0 "[ . 1 . 2]" 1
854 1 53 ALA MB 1 57 ARG HB3 . . 3.870 3.691 3.393 3.862 . 0 0 "[ . 1 . 2]" 1
855 1 53 ALA MB 1 57 ARG QG . . 4.020 3.358 2.986 3.677 . 0 0 "[ . 1 . 2]" 1
856 1 53 ALA MB 1 59 GLU QG . . 3.290 3.088 2.795 3.317 0.027 13 0 "[ . 1 . 2]" 1
857 1 53 ALA MB 1 79 GLU HB2 . . 3.780 2.885 2.223 3.591 . 0 0 "[ . 1 . 2]" 1
858 1 53 ALA MB 1 79 GLU QB . . 3.280 2.435 2.023 2.886 . 0 0 "[ . 1 . 2]" 1
859 1 53 ALA MB 1 79 GLU HB3 . . 3.780 3.046 2.051 3.747 . 0 0 "[ . 1 . 2]" 1
860 1 53 ALA MB 1 83 HIS HD2 . . 4.050 3.630 3.311 3.893 . 0 0 "[ . 1 . 2]" 1
861 1 54 PRO HA 1 56 GLY H . . 4.060 3.632 3.586 3.684 . 0 0 "[ . 1 . 2]" 1
862 1 54 PRO HB2 1 55 SER H . . 3.850 3.655 3.580 3.742 . 0 0 "[ . 1 . 2]" 1
863 1 54 PRO HB3 1 55 SER H . . 4.470 4.327 4.284 4.377 . 0 0 "[ . 1 . 2]" 1
864 1 54 PRO HB3 1 56 GLY H . . 5.500 5.516 5.495 5.536 0.036 18 0 "[ . 1 . 2]" 1
865 1 54 PRO HB3 1 82 GLU H . . 4.570 3.418 2.747 3.940 . 0 0 "[ . 1 . 2]" 1
866 1 54 PRO HD2 1 55 SER H . . 4.080 2.739 2.699 2.796 . 0 0 "[ . 1 . 2]" 1
867 1 54 PRO HD2 1 79 GLU HB2 . . 4.330 3.517 2.839 4.288 . 0 0 "[ . 1 . 2]" 1
868 1 54 PRO HD2 1 79 GLU QB . . 3.720 2.720 2.261 2.985 . 0 0 "[ . 1 . 2]" 1
869 1 54 PRO HD2 1 79 GLU HB3 . . 4.330 2.985 2.281 3.472 . 0 0 "[ . 1 . 2]" 1
870 1 54 PRO HD2 1 79 GLU QG . . 4.530 3.813 2.368 4.524 . 0 0 "[ . 1 . 2]" 1
871 1 54 PRO HD2 1 83 HIS HA . . 5.120 4.868 4.665 5.054 . 0 0 "[ . 1 . 2]" 1
872 1 54 PRO HD2 1 83 HIS HE1 . . 4.610 2.902 2.403 3.365 . 0 0 "[ . 1 . 2]" 1
873 1 54 PRO HD3 1 55 SER H . . 4.150 3.891 3.869 3.921 . 0 0 "[ . 1 . 2]" 1
874 1 54 PRO HD3 1 56 GLY H . . 5.500 5.421 5.344 5.507 0.007 15 0 "[ . 1 . 2]" 1
875 1 54 PRO HD3 1 83 HIS HA . . 4.450 3.277 3.071 3.453 . 0 0 "[ . 1 . 2]" 1
876 1 54 PRO HD3 1 83 HIS HD1 . . 5.330 2.903 2.406 3.324 . 0 0 "[ . 1 . 2]" 1
877 1 54 PRO HD3 1 83 HIS HD2 . . 5.080 4.630 4.332 5.072 . 0 0 "[ . 1 . 2]" 1
878 1 54 PRO HD3 1 83 HIS HE1 . . 4.150 2.928 2.454 3.361 . 0 0 "[ . 1 . 2]" 1
879 1 54 PRO HG2 1 55 SER H . . 4.130 2.815 2.702 2.954 . 0 0 "[ . 1 . 2]" 1
880 1 54 PRO HG2 1 81 GLY HA3 . . 4.530 4.388 4.163 4.524 . 0 0 "[ . 1 . 2]" 1
881 1 54 PRO HG2 1 82 GLU H . . 4.910 4.872 4.716 4.914 0.004 15 0 "[ . 1 . 2]" 1
882 1 54 PRO HG2 1 83 HIS HE1 . . 4.710 4.389 4.006 4.669 . 0 0 "[ . 1 . 2]" 1
883 1 54 PRO HG3 1 55 SER H . . 4.500 4.214 4.129 4.319 . 0 0 "[ . 1 . 2]" 1
884 1 54 PRO HG3 1 81 GLY HA2 . . 4.750 4.633 4.353 4.749 . 0 0 "[ . 1 . 2]" 1
885 1 54 PRO HG3 1 81 GLY HA3 . . 4.070 2.885 2.613 3.005 . 0 0 "[ . 1 . 2]" 1
886 1 54 PRO HG3 1 82 GLU H . . 4.770 3.168 3.032 3.285 . 0 0 "[ . 1 . 2]" 1
887 1 54 PRO HG3 1 83 HIS HE1 . . 4.500 3.781 3.322 4.344 . 0 0 "[ . 1 . 2]" 1
888 1 55 SER H 1 55 SER HB2 . . 3.750 2.707 2.293 3.673 . 0 0 "[ . 1 . 2]" 1
889 1 55 SER H 1 55 SER QB . . 2.920 2.452 2.267 2.919 . 0 0 "[ . 1 . 2]" 1
890 1 55 SER H 1 55 SER HB3 . . 3.750 3.137 2.591 3.666 . 0 0 "[ . 1 . 2]" 1
891 1 55 SER H 1 56 GLY H . . 3.250 2.432 2.405 2.470 . 0 0 "[ . 1 . 2]" 1
892 1 55 SER H 1 56 GLY HA2 . . 4.770 4.705 4.662 4.770 0.000 3 0 "[ . 1 . 2]" 1
893 1 55 SER H 1 56 GLY HA3 . . 5.060 5.030 5.008 5.067 0.007 3 0 "[ . 1 . 2]" 1
894 1 55 SER H 1 57 ARG H . . 4.190 3.246 3.147 3.360 . 0 0 "[ . 1 . 2]" 1
895 1 55 SER HA 1 56 GLY H . . 3.440 3.193 3.144 3.275 . 0 0 "[ . 1 . 2]" 1
896 1 55 SER HA 1 56 GLY HA2 . . 5.160 4.984 4.957 5.012 . 0 0 "[ . 1 . 2]" 1
897 1 55 SER QB 1 56 GLY H . . 4.110 3.582 3.375 3.931 . 0 0 "[ . 1 . 2]" 1
898 1 55 SER QB 1 57 ARG H . . 4.080 3.467 3.120 4.081 0.001 9 0 "[ . 1 . 2]" 1
899 1 55 SER QB 1 57 ARG QG . . 4.760 2.410 2.056 2.917 . 0 0 "[ . 1 . 2]" 1
900 1 56 GLY H 1 56 GLY HA2 . . 2.840 2.324 2.308 2.353 . 0 0 "[ . 1 . 2]" 1
901 1 56 GLY H 1 57 ARG H . . 2.980 2.418 2.284 2.507 . 0 0 "[ . 1 . 2]" 1
902 1 56 GLY H 1 57 ARG HA . . 5.270 5.098 4.993 5.169 . 0 0 "[ . 1 . 2]" 1
903 1 56 GLY H 1 57 ARG QG . . 4.160 3.985 3.786 4.114 . 0 0 "[ . 1 . 2]" 1
904 1 57 ARG H 1 57 ARG HB2 . . 2.950 2.578 2.511 2.654 . 0 0 "[ . 1 . 2]" 1
905 1 57 ARG H 1 57 ARG HB3 . . 3.790 3.689 3.649 3.719 . 0 0 "[ . 1 . 2]" 1
906 1 57 ARG H 1 57 ARG QD . . 4.220 3.999 3.669 4.221 0.001 3 0 "[ . 1 . 2]" 1
907 1 57 ARG H 1 57 ARG QG . . 2.760 2.450 2.253 2.630 . 0 0 "[ . 1 . 2]" 1
908 1 57 ARG H 1 58 ASP H . . 4.470 4.315 4.231 4.426 . 0 0 "[ . 1 . 2]" 1
909 1 57 ARG HA 1 57 ARG QD . . 4.420 3.042 2.092 4.273 . 0 0 "[ . 1 . 2]" 1
910 1 57 ARG HA 1 57 ARG QG . . 3.540 2.729 2.411 2.959 . 0 0 "[ . 1 . 2]" 1
911 1 57 ARG HA 1 58 ASP H . . 2.830 2.144 2.138 2.153 . 0 0 "[ . 1 . 2]" 1
912 1 57 ARG HA 1 58 ASP HA . . 4.690 4.405 4.375 4.423 . 0 0 "[ . 1 . 2]" 1
913 1 57 ARG HA 1 58 ASP HB2 . . 5.120 4.926 4.806 5.037 . 0 0 "[ . 1 . 2]" 1
914 1 57 ARG HA 1 58 ASP HB3 . . 4.410 4.332 4.280 4.410 . 0 0 "[ . 1 . 2]" 1
915 1 57 ARG HB2 1 57 ARG QD . . 3.830 2.977 2.183 3.501 . 0 0 "[ . 1 . 2]" 1
916 1 57 ARG HB2 1 58 ASP H . . 4.330 4.297 4.205 4.338 0.008 9 0 "[ . 1 . 2]" 1
917 1 57 ARG HB3 1 57 ARG QD . . 3.780 2.443 2.166 2.928 . 0 0 "[ . 1 . 2]" 1
918 1 57 ARG HB3 1 58 ASP H . . 3.690 3.591 3.408 3.693 0.003 9 0 "[ . 1 . 2]" 1
919 1 57 ARG HB3 1 58 ASP HB3 . . 5.500 5.381 5.212 5.500 . 0 0 "[ . 1 . 2]" 1
920 1 58 ASP H 1 58 ASP HB2 . . 3.400 2.884 2.736 2.965 . 0 0 "[ . 1 . 2]" 1
921 1 58 ASP H 1 58 ASP HB3 . . 3.340 2.240 2.180 2.341 . 0 0 "[ . 1 . 2]" 1
922 1 58 ASP HA 1 59 GLU H . . 2.940 2.288 2.191 2.402 . 0 0 "[ . 1 . 2]" 1
923 1 58 ASP HA 1 59 GLU QG . . 4.560 3.430 3.054 4.296 . 0 0 "[ . 1 . 2]" 1
924 1 58 ASP HB2 1 59 GLU H . . 4.200 3.686 3.502 3.933 . 0 0 "[ . 1 . 2]" 1
925 1 58 ASP HB3 1 59 GLU H . . 4.410 4.057 3.864 4.220 . 0 0 "[ . 1 . 2]" 1
926 1 59 GLU H 1 59 GLU HB2 . . 3.530 2.792 2.577 2.957 . 0 0 "[ . 1 . 2]" 1
927 1 59 GLU H 1 59 GLU HB3 . . 3.950 3.841 3.734 3.916 . 0 0 "[ . 1 . 2]" 1
928 1 59 GLU H 1 59 GLU QG . . 3.660 2.858 2.350 3.377 . 0 0 "[ . 1 . 2]" 1
929 1 59 GLU H 1 60 PRO HD2 . . 5.310 4.824 4.807 4.839 . 0 0 "[ . 1 . 2]" 1
930 1 59 GLU H 1 60 PRO QD . . 4.630 4.297 4.247 4.333 . 0 0 "[ . 1 . 2]" 1
931 1 59 GLU H 1 60 PRO HD3 . . 5.310 4.823 4.730 4.889 . 0 0 "[ . 1 . 2]" 1
932 1 59 GLU HA 1 60 PRO HD2 . . 3.250 2.246 2.214 2.263 . 0 0 "[ . 1 . 2]" 1
933 1 59 GLU HA 1 60 PRO QD . . 2.840 2.005 1.989 2.014 . 0 0 "[ . 1 . 2]" 1
934 1 59 GLU HA 1 60 PRO HD3 . . 3.250 2.256 2.252 2.259 . 0 0 "[ . 1 . 2]" 1
935 1 59 GLU HA 1 60 PRO HG2 . . 4.440 4.387 4.362 4.401 . 0 0 "[ . 1 . 2]" 1
936 1 59 GLU HA 1 60 PRO HG3 . . 4.440 4.387 4.372 4.396 . 0 0 "[ . 1 . 2]" 1
937 1 59 GLU HB2 1 60 PRO HD2 . . 4.950 3.739 3.514 3.863 . 0 0 "[ . 1 . 2]" 1
938 1 59 GLU HB2 1 60 PRO QD . . 4.100 3.608 3.409 3.717 . 0 0 "[ . 1 . 2]" 1
939 1 59 GLU HB2 1 60 PRO HD3 . . 4.950 4.754 4.596 4.837 . 0 0 "[ . 1 . 2]" 1
940 1 59 GLU HB2 1 75 PHE HB2 . . 5.500 3.737 3.232 3.952 . 0 0 "[ . 1 . 2]" 1
941 1 59 GLU HB2 1 75 PHE HB3 . . 5.160 4.991 4.564 5.156 . 0 0 "[ . 1 . 2]" 1
942 1 59 GLU HB2 1 75 PHE QD . . 3.850 3.048 2.544 3.520 . 0 0 "[ . 1 . 2]" 1
943 1 59 GLU HB2 1 83 HIS HD2 . . 5.500 4.257 3.999 4.470 . 0 0 "[ . 1 . 2]" 1
944 1 59 GLU HB3 1 60 PRO QD . . 3.460 2.289 2.234 2.357 . 0 0 "[ . 1 . 2]" 1
945 1 59 GLU HB3 1 75 PHE HB2 . . 5.190 3.573 3.219 3.796 . 0 0 "[ . 1 . 2]" 1
946 1 59 GLU HB3 1 75 PHE QD . . 3.960 2.518 1.999 2.976 . 0 0 "[ . 1 . 2]" 1
947 1 59 GLU QG 1 75 PHE QD . . 4.050 3.527 3.163 3.976 . 0 0 "[ . 1 . 2]" 1
948 1 59 GLU QG 1 75 PHE QE . . 4.360 3.396 2.537 4.360 . 0 0 "[ . 1 . 2]" 1
949 1 59 GLU QG 1 78 ARG H . . 5.270 3.265 2.234 4.052 . 0 0 "[ . 1 . 2]" 1
950 1 59 GLU QG 1 79 GLU H . . 5.290 4.497 3.942 5.038 . 0 0 "[ . 1 . 2]" 1
951 1 59 GLU QG 1 83 HIS HD2 . . 4.310 3.162 2.494 4.184 . 0 0 "[ . 1 . 2]" 1
952 1 60 PRO HA 1 61 CYS H . . 2.780 2.271 2.170 2.369 . 0 0 "[ . 1 . 2]" 1
953 1 60 PRO QB 1 61 CYS H . . 4.040 3.761 3.567 3.876 . 0 0 "[ . 1 . 2]" 1
954 1 60 PRO HB2 1 61 CYS H . . 4.650 4.082 3.846 4.219 . 0 0 "[ . 1 . 2]" 1
955 1 60 PRO HB3 1 61 CYS H . . 4.650 4.405 4.221 4.517 . 0 0 "[ . 1 . 2]" 1
956 1 61 CYS H 1 61 CYS HB3 . . 3.780 2.926 2.648 3.372 . 0 0 "[ . 1 . 2]" 1
957 1 61 CYS H 1 75 PHE HB2 . . 5.500 4.017 3.785 4.391 . 0 0 "[ . 1 . 2]" 1
958 1 61 CYS HA 1 62 LEU H . . 2.990 2.238 2.192 2.293 . 0 0 "[ . 1 . 2]" 1
959 1 61 CYS HA 1 62 LEU HB2 . . 5.010 4.108 4.071 4.194 . 0 0 "[ . 1 . 2]" 1
960 1 61 CYS HA 1 62 LEU HB3 . . 4.990 4.838 4.632 4.896 . 0 0 "[ . 1 . 2]" 1
961 1 61 CYS HA 1 75 PHE HA . . 4.360 2.730 2.326 2.985 . 0 0 "[ . 1 . 2]" 1
962 1 61 CYS HA 1 75 PHE HB2 . . 4.330 2.445 2.209 2.796 . 0 0 "[ . 1 . 2]" 1
963 1 61 CYS HA 1 75 PHE HB3 . . 4.150 2.040 1.997 2.175 . 0 0 "[ . 1 . 2]" 1
964 1 61 CYS HA 1 75 PHE QD . . 4.650 4.075 4.014 4.186 . 0 0 "[ . 1 . 2]" 1
965 1 61 CYS HB2 1 62 LEU H . . 3.410 2.911 2.716 3.068 . 0 0 "[ . 1 . 2]" 1
966 1 61 CYS HB2 1 73 ILE MD . . 3.850 1.943 1.857 2.093 . 0 0 "[ . 1 . 2]" 1
967 1 61 CYS HB2 1 73 ILE HG12 . . 4.400 2.780 2.381 3.423 . 0 0 "[ . 1 . 2]" 1
968 1 61 CYS HB2 1 73 ILE HG13 . . 3.970 3.244 2.839 3.482 . 0 0 "[ . 1 . 2]" 1
969 1 61 CYS HB2 1 75 PHE HB2 . . 4.430 3.933 3.294 4.399 . 0 0 "[ . 1 . 2]" 1
970 1 61 CYS HB2 1 75 PHE HB3 . . 4.210 2.858 2.229 3.383 . 0 0 "[ . 1 . 2]" 1
971 1 61 CYS HB2 1 75 PHE QD . . 4.840 4.214 3.608 4.696 . 0 0 "[ . 1 . 2]" 1
972 1 61 CYS HB3 1 62 LEU H . . 4.170 3.995 3.777 4.161 . 0 0 "[ . 1 . 2]" 1
973 1 61 CYS HB3 1 73 ILE MD . . 4.130 3.019 2.503 3.375 . 0 0 "[ . 1 . 2]" 1
974 1 61 CYS HB3 1 73 ILE HG12 . . 4.780 3.946 3.296 4.280 . 0 0 "[ . 1 . 2]" 1
975 1 61 CYS HB3 1 75 PHE HB2 . . 4.390 2.932 2.620 3.218 . 0 0 "[ . 1 . 2]" 1
976 1 61 CYS HB3 1 75 PHE HB3 . . 3.530 2.608 2.069 2.912 . 0 0 "[ . 1 . 2]" 1
977 1 61 CYS HB3 1 75 PHE QD . . 4.590 3.936 3.680 4.096 . 0 0 "[ . 1 . 2]" 1
978 1 61 CYS HB3 1 75 PHE QE . . 5.500 5.450 5.264 5.502 0.002 2 0 "[ . 1 . 2]" 1
979 1 62 LEU H 1 62 LEU HB2 . . 3.550 2.966 2.853 3.143 . 0 0 "[ . 1 . 2]" 1
980 1 62 LEU H 1 62 LEU HB3 . . 3.170 3.025 2.926 3.077 . 0 0 "[ . 1 . 2]" 1
981 1 62 LEU H 1 62 LEU MD1 . . 4.320 4.250 4.140 4.320 . 0 0 "[ . 1 . 2]" 1
982 1 62 LEU H 1 73 ILE HA . . 5.150 4.623 4.350 4.808 . 0 0 "[ . 1 . 2]" 1
983 1 62 LEU H 1 73 ILE MD . . 4.490 3.509 3.066 3.865 . 0 0 "[ . 1 . 2]" 1
984 1 62 LEU H 1 73 ILE HG12 . . 4.800 3.177 2.680 3.448 . 0 0 "[ . 1 . 2]" 1
985 1 62 LEU H 1 73 ILE HG13 . . 4.840 2.980 2.603 3.300 . 0 0 "[ . 1 . 2]" 1
986 1 62 LEU H 1 74 SER H . . 3.660 2.740 2.471 2.902 . 0 0 "[ . 1 . 2]" 1
987 1 62 LEU H 1 74 SER QB . . 3.800 3.612 3.438 3.805 0.005 18 0 "[ . 1 . 2]" 1
988 1 62 LEU H 1 75 PHE HA . . 4.720 3.806 3.375 4.049 . 0 0 "[ . 1 . 2]" 1
989 1 62 LEU H 1 75 PHE HB2 . . 4.820 4.417 4.123 4.750 . 0 0 "[ . 1 . 2]" 1
990 1 62 LEU H 1 75 PHE HB3 . . 4.540 3.306 3.090 3.474 . 0 0 "[ . 1 . 2]" 1
991 1 62 LEU HA 1 62 LEU MD1 . . 3.640 2.690 2.382 3.237 . 0 0 "[ . 1 . 2]" 1
992 1 62 LEU HA 1 62 LEU MD2 . . 3.510 2.031 1.919 2.148 . 0 0 "[ . 1 . 2]" 1
993 1 62 LEU HA 1 62 LEU HG . . 3.940 3.677 3.619 3.724 . 0 0 "[ . 1 . 2]" 1
994 1 62 LEU HA 1 63 LEU H . . 2.800 2.152 2.139 2.229 . 0 0 "[ . 1 . 2]" 1
995 1 62 LEU HB2 1 62 LEU MD1 . . 3.200 3.178 3.134 3.194 . 0 0 "[ . 1 . 2]" 1
996 1 62 LEU HB2 1 62 LEU MD2 . . 3.490 2.336 2.241 2.543 . 0 0 "[ . 1 . 2]" 1
997 1 62 LEU HB2 1 63 LEU H . . 4.560 4.410 4.233 4.489 . 0 0 "[ . 1 . 2]" 1
998 1 62 LEU HB2 1 74 SER H . . 5.110 4.927 4.674 5.098 . 0 0 "[ . 1 . 2]" 1
999 1 62 LEU HB2 1 74 SER QB . . 4.250 4.191 3.948 4.251 0.001 6 0 "[ . 1 . 2]" 1
1000 1 62 LEU HB3 1 62 LEU MD1 . . 3.220 2.256 2.098 2.409 . 0 0 "[ . 1 . 2]" 1
1001 1 62 LEU HB3 1 62 LEU MD2 . . 3.420 3.185 3.165 3.195 . 0 0 "[ . 1 . 2]" 1
1002 1 62 LEU HB3 1 63 LEU H . . 4.070 3.976 3.641 4.059 . 0 0 "[ . 1 . 2]" 1
1003 1 62 LEU HB3 1 74 SER H . . 4.280 3.918 3.601 4.191 . 0 0 "[ . 1 . 2]" 1
1004 1 62 LEU HB3 1 74 SER QB . . 3.400 2.985 2.511 3.407 0.007 18 0 "[ . 1 . 2]" 1
1005 1 62 LEU MD1 1 63 LEU H . . 4.370 2.315 1.867 2.924 . 0 0 "[ . 1 . 2]" 1
1006 1 62 LEU MD1 1 64 LYS HA . . 4.420 3.837 3.680 3.937 . 0 0 "[ . 1 . 2]" 1
1007 1 62 LEU MD1 1 64 LYS HB2 . . 4.680 4.369 3.946 4.623 . 0 0 "[ . 1 . 2]" 1
1008 1 62 LEU MD1 1 64 LYS HB3 . . 4.780 3.007 2.567 3.208 . 0 0 "[ . 1 . 2]" 1
1009 1 62 LEU MD1 1 64 LYS QE . . 4.790 3.892 2.658 4.792 0.002 6 0 "[ . 1 . 2]" 1
1010 1 62 LEU MD1 1 74 SER H . . 5.260 4.578 4.018 4.817 . 0 0 "[ . 1 . 2]" 1
1011 1 62 LEU MD1 1 74 SER QB . . 4.450 4.024 3.087 4.440 . 0 0 "[ . 1 . 2]" 1
1012 1 62 LEU MD2 1 63 LEU H . . 3.630 2.932 1.943 3.328 . 0 0 "[ . 1 . 2]" 1
1013 1 62 LEU MD2 1 63 LEU HA . . 5.500 5.231 4.330 5.500 0.000 7 0 "[ . 1 . 2]" 1
1014 1 63 LEU H 1 63 LEU HB2 . . 2.980 2.214 2.163 2.380 . 0 0 "[ . 1 . 2]" 1
1015 1 63 LEU H 1 63 LEU HB3 . . 3.620 3.505 3.472 3.602 . 0 0 "[ . 1 . 2]" 1
1016 1 63 LEU H 1 63 LEU MD1 . . 3.870 3.701 3.523 3.870 . 0 0 "[ . 1 . 2]" 1
1017 1 63 LEU H 1 63 LEU HG . . 3.250 3.096 2.552 3.249 . 0 0 "[ . 1 . 2]" 1
1018 1 63 LEU H 1 64 LYS H . . 4.580 4.546 4.446 4.598 0.018 15 0 "[ . 1 . 2]" 1
1019 1 63 LEU H 1 73 ILE HA . . 5.230 4.974 4.748 5.222 . 0 0 "[ . 1 . 2]" 1
1020 1 63 LEU HA 1 63 LEU MD1 . . 4.120 3.829 3.808 3.891 . 0 0 "[ . 1 . 2]" 1
1021 1 63 LEU HA 1 63 LEU MD2 . . 3.080 2.236 1.977 2.414 . 0 0 "[ . 1 . 2]" 1
1022 1 63 LEU HA 1 63 LEU HG . . 4.160 2.700 2.552 2.942 . 0 0 "[ . 1 . 2]" 1
1023 1 63 LEU HA 1 64 LYS H . . 2.800 2.178 2.145 2.229 . 0 0 "[ . 1 . 2]" 1
1024 1 63 LEU HA 1 64 LYS HG2 . . 5.130 3.915 3.640 4.228 . 0 0 "[ . 1 . 2]" 1
1025 1 63 LEU HA 1 73 ILE HA . . 3.590 2.483 2.197 2.735 . 0 0 "[ . 1 . 2]" 1
1026 1 63 LEU HA 1 73 ILE HB . . 4.850 3.976 3.497 4.544 . 0 0 "[ . 1 . 2]" 1
1027 1 63 LEU HA 1 73 ILE MD . . 4.520 3.900 3.309 4.514 . 0 0 "[ . 1 . 2]" 1
1028 1 63 LEU HA 1 73 ILE HG13 . . 4.790 2.959 2.555 3.381 . 0 0 "[ . 1 . 2]" 1
1029 1 63 LEU HA 1 74 SER H . . 4.230 3.449 3.135 3.756 . 0 0 "[ . 1 . 2]" 1
1030 1 63 LEU HB2 1 63 LEU MD1 . . 3.050 2.194 2.036 2.352 . 0 0 "[ . 1 . 2]" 1
1031 1 63 LEU HB2 1 63 LEU MD2 . . 3.240 3.169 3.151 3.183 . 0 0 "[ . 1 . 2]" 1
1032 1 63 LEU HB2 1 64 LYS H . . 4.440 4.280 4.024 4.384 . 0 0 "[ . 1 . 2]" 1
1033 1 63 LEU HB3 1 63 LEU MD1 . . 3.350 2.486 2.309 2.593 . 0 0 "[ . 1 . 2]" 1
1034 1 63 LEU HB3 1 63 LEU MD2 . . 3.200 2.222 2.101 2.360 . 0 0 "[ . 1 . 2]" 1
1035 1 63 LEU HB3 1 64 LYS H . . 3.590 3.187 2.904 3.387 . 0 0 "[ . 1 . 2]" 1
1036 1 63 LEU HB3 1 71 ILE MG . . 4.270 4.103 3.623 4.235 . 0 0 "[ . 1 . 2]" 1
1037 1 63 LEU MD2 1 64 LYS H . . 3.550 2.937 2.605 3.369 . 0 0 "[ . 1 . 2]" 1
1038 1 63 LEU MD2 1 73 ILE H . . 5.160 4.032 3.414 4.546 . 0 0 "[ . 1 . 2]" 1
1039 1 63 LEU MD2 1 73 ILE HA . . 3.660 2.724 2.148 3.303 . 0 0 "[ . 1 . 2]" 1
1040 1 63 LEU MD2 1 73 ILE HB . . 3.280 2.445 2.057 3.142 . 0 0 "[ . 1 . 2]" 1
1041 1 63 LEU HG 1 73 ILE HA . . 5.080 4.049 3.426 4.635 . 0 0 "[ . 1 . 2]" 1
1042 1 63 LEU HG 1 73 ILE MD . . 3.360 2.708 2.193 3.363 0.003 18 0 "[ . 1 . 2]" 1
1043 1 64 LYS H 1 64 LYS HB2 . . 4.030 3.904 3.838 3.947 . 0 0 "[ . 1 . 2]" 1
1044 1 64 LYS H 1 64 LYS HB3 . . 3.340 3.248 3.030 3.343 0.003 3 0 "[ . 1 . 2]" 1
1045 1 64 LYS H 1 64 LYS QD . . 4.850 4.270 3.685 4.605 . 0 0 "[ . 1 . 2]" 1
1046 1 64 LYS H 1 64 LYS HG2 . . 3.510 2.443 2.226 2.735 . 0 0 "[ . 1 . 2]" 1
1047 1 64 LYS H 1 64 LYS HG3 . . 3.920 3.408 3.061 3.837 . 0 0 "[ . 1 . 2]" 1
1048 1 64 LYS H 1 65 ARG H . . 4.690 4.408 4.380 4.434 . 0 0 "[ . 1 . 2]" 1
1049 1 64 LYS H 1 71 ILE MG . . 3.700 3.566 3.210 3.693 . 0 0 "[ . 1 . 2]" 1
1050 1 64 LYS H 1 72 GLY H . . 3.960 3.898 3.765 3.964 0.004 13 0 "[ . 1 . 2]" 1
1051 1 64 LYS H 1 72 GLY HA3 . . 5.500 5.364 5.192 5.495 . 0 0 "[ . 1 . 2]" 1
1052 1 64 LYS H 1 73 ILE HA . . 3.750 3.203 2.880 3.409 . 0 0 "[ . 1 . 2]" 1
1053 1 64 LYS HA 1 64 LYS QD . . 4.480 4.431 4.248 4.491 0.011 20 0 "[ . 1 . 2]" 1
1054 1 64 LYS HA 1 64 LYS HG2 . . 4.030 3.730 3.640 3.864 . 0 0 "[ . 1 . 2]" 1
1055 1 64 LYS HA 1 65 ARG H . . 2.540 2.442 2.288 2.568 0.028 10 0 "[ . 1 . 2]" 1
1056 1 64 LYS HB2 1 64 LYS QE . . 3.560 2.851 2.101 3.595 0.035 19 0 "[ . 1 . 2]" 1
1057 1 64 LYS HB2 1 65 ARG H . . 3.380 2.404 2.133 2.794 . 0 0 "[ . 1 . 2]" 1
1058 1 64 LYS HB2 1 66 LEU MD2 . . 5.110 4.709 4.357 5.093 . 0 0 "[ . 1 . 2]" 1
1059 1 64 LYS HB3 1 64 LYS QE . . 4.090 2.457 1.994 3.978 . 0 0 "[ . 1 . 2]" 1
1060 1 64 LYS HB3 1 65 ARG H . . 4.060 3.783 3.593 4.061 0.001 9 0 "[ . 1 . 2]" 1
1061 1 64 LYS QD 1 65 ARG H . . 4.730 4.530 4.119 4.742 0.012 3 0 "[ . 1 . 2]" 1
1062 1 64 LYS QD 1 74 SER HA . . 5.470 5.004 4.135 5.468 . 0 0 "[ . 1 . 2]" 1
1063 1 64 LYS QE 1 64 LYS HG2 . . 3.560 2.748 2.291 3.473 . 0 0 "[ . 1 . 2]" 1
1064 1 64 LYS QE 1 64 LYS HG3 . . 3.590 2.963 2.189 3.597 0.007 20 0 "[ . 1 . 2]" 1
1065 1 64 LYS QE 1 74 SER QB . . 3.810 2.706 1.806 3.812 0.002 13 0 "[ . 1 . 2]" 1
1066 1 64 LYS HG2 1 65 ARG H . . 4.710 4.459 3.902 4.711 0.001 2 0 "[ . 1 . 2]" 1
1067 1 64 LYS HG2 1 66 LEU MD2 . . 4.120 3.853 3.464 4.118 . 0 0 "[ . 1 . 2]" 1
1068 1 64 LYS HG2 1 72 GLY H . . 4.600 4.213 3.475 4.600 0.000 12 0 "[ . 1 . 2]" 1
1069 1 64 LYS HG2 1 72 GLY HA3 . . 5.350 5.148 4.628 5.351 0.001 1 0 "[ . 1 . 2]" 1
1070 1 64 LYS HG2 1 73 ILE HA . . 4.770 3.801 3.361 4.226 . 0 0 "[ . 1 . 2]" 1
1071 1 64 LYS HG2 1 74 SER QB . . 4.120 3.399 2.850 4.117 . 0 0 "[ . 1 . 2]" 1
1072 1 64 LYS HG3 1 65 ARG H . . 4.270 3.462 3.004 3.867 . 0 0 "[ . 1 . 2]" 1
1073 1 64 LYS HG3 1 65 ARG HA . . 5.010 4.306 4.073 4.608 . 0 0 "[ . 1 . 2]" 1
1074 1 64 LYS HG3 1 66 LEU MD2 . . 3.910 2.866 2.651 3.185 . 0 0 "[ . 1 . 2]" 1
1075 1 64 LYS HG3 1 72 GLY H . . 4.200 3.996 3.661 4.201 0.001 18 0 "[ . 1 . 2]" 1
1076 1 65 ARG H 1 65 ARG HB2 . . 3.190 2.724 2.361 3.169 . 0 0 "[ . 1 . 2]" 1
1077 1 65 ARG H 1 65 ARG QB . . 2.690 2.294 2.220 2.415 . 0 0 "[ . 1 . 2]" 1
1078 1 65 ARG H 1 65 ARG HB3 . . 3.190 2.584 2.317 2.894 . 0 0 "[ . 1 . 2]" 1
1079 1 65 ARG H 1 65 ARG HD2 . . 5.500 5.075 4.702 5.517 0.017 6 0 "[ . 1 . 2]" 1
1080 1 65 ARG H 1 65 ARG QD . . 4.810 4.354 3.931 4.533 . 0 0 "[ . 1 . 2]" 1
1081 1 65 ARG H 1 65 ARG HD3 . . 5.500 4.800 4.026 5.142 . 0 0 "[ . 1 . 2]" 1
1082 1 65 ARG HA 1 65 ARG HD2 . . 3.880 3.023 2.336 3.853 . 0 0 "[ . 1 . 2]" 1
1083 1 65 ARG HA 1 65 ARG HD3 . . 3.880 2.771 2.211 3.253 . 0 0 "[ . 1 . 2]" 1
1084 1 65 ARG HA 1 65 ARG QG . . 3.590 2.728 2.335 3.117 . 0 0 "[ . 1 . 2]" 1
1085 1 65 ARG HA 1 66 LEU H . . 2.910 2.167 2.140 2.261 . 0 0 "[ . 1 . 2]" 1
1086 1 65 ARG HA 1 66 LEU HG . . 4.190 4.032 3.743 4.153 . 0 0 "[ . 1 . 2]" 1
1087 1 65 ARG HA 1 71 ILE MD . . 4.200 3.786 3.188 4.183 . 0 0 "[ . 1 . 2]" 1
1088 1 65 ARG HA 1 71 ILE MG . . 4.300 2.657 2.283 2.924 . 0 0 "[ . 1 . 2]" 1
1089 1 65 ARG HA 1 72 GLY H . . 4.140 3.820 3.441 4.096 . 0 0 "[ . 1 . 2]" 1
1090 1 65 ARG QB 1 65 ARG QD . . 3.090 2.244 2.057 2.396 . 0 0 "[ . 1 . 2]" 1
1091 1 65 ARG QB 1 66 LEU H . . 4.120 3.699 3.444 3.827 . 0 0 "[ . 1 . 2]" 1
1092 1 65 ARG QD 1 71 ILE MD . . 3.910 3.036 2.272 3.605 . 0 0 "[ . 1 . 2]" 1
1093 1 65 ARG HD2 1 66 LEU H . . 4.120 2.969 1.974 4.092 . 0 0 "[ . 1 . 2]" 1
1094 1 65 ARG HD2 1 71 ILE MD . . 4.450 3.713 2.418 4.478 0.028 19 0 "[ . 1 . 2]" 1
1095 1 65 ARG HD3 1 66 LEU H . . 4.120 3.280 1.998 4.114 . 0 0 "[ . 1 . 2]" 1
1096 1 65 ARG HD3 1 71 ILE MD . . 4.450 3.272 2.759 3.809 . 0 0 "[ . 1 . 2]" 1
1097 1 65 ARG QG 1 66 LEU H . . 3.710 3.092 2.348 3.698 . 0 0 "[ . 1 . 2]" 1
1098 1 66 LEU H 1 66 LEU HB2 . . 3.480 2.420 2.358 2.546 . 0 0 "[ . 1 . 2]" 1
1099 1 66 LEU H 1 66 LEU HB3 . . 3.700 3.629 3.595 3.684 . 0 0 "[ . 1 . 2]" 1
1100 1 66 LEU H 1 66 LEU MD1 . . 4.400 3.842 3.340 4.234 . 0 0 "[ . 1 . 2]" 1
1101 1 66 LEU H 1 66 LEU MD2 . . 4.000 3.761 3.502 3.944 . 0 0 "[ . 1 . 2]" 1
1102 1 66 LEU H 1 66 LEU HG . . 3.440 2.814 2.154 3.266 . 0 0 "[ . 1 . 2]" 1
1103 1 66 LEU H 1 67 PRO HD2 . . 4.890 4.797 4.782 4.807 . 0 0 "[ . 1 . 2]" 1
1104 1 66 LEU H 1 67 PRO HD3 . . 5.180 5.046 5.005 5.060 . 0 0 "[ . 1 . 2]" 1
1105 1 66 LEU H 1 70 HIS H . . 4.800 4.267 3.866 4.520 . 0 0 "[ . 1 . 2]" 1
1106 1 66 LEU H 1 70 HIS HB2 . . 4.690 4.621 4.492 4.728 0.038 19 0 "[ . 1 . 2]" 1
1107 1 66 LEU H 1 71 ILE H . . 4.930 4.373 4.193 4.482 . 0 0 "[ . 1 . 2]" 1
1108 1 66 LEU H 1 71 ILE MD . . 4.660 4.421 4.159 4.659 . 0 0 "[ . 1 . 2]" 1
1109 1 66 LEU H 1 71 ILE MG . . 4.350 3.443 3.235 3.566 . 0 0 "[ . 1 . 2]" 1
1110 1 66 LEU H 1 72 GLY H . . 4.090 3.513 3.295 3.886 . 0 0 "[ . 1 . 2]" 1
1111 1 66 LEU HA 1 66 LEU MD1 . . 4.020 3.859 3.766 3.947 . 0 0 "[ . 1 . 2]" 1
1112 1 66 LEU HA 1 66 LEU MD2 . . 3.040 2.056 1.955 2.451 . 0 0 "[ . 1 . 2]" 1
1113 1 66 LEU HA 1 66 LEU HG . . 3.920 3.034 2.965 3.149 . 0 0 "[ . 1 . 2]" 1
1114 1 66 LEU HA 1 67 PRO HD2 . . 3.110 2.404 2.363 2.426 . 0 0 "[ . 1 . 2]" 1
1115 1 66 LEU HA 1 67 PRO HD3 . . 3.460 2.301 2.287 2.311 . 0 0 "[ . 1 . 2]" 1
1116 1 66 LEU HA 1 67 PRO HG2 . . 4.540 4.516 4.483 4.534 . 0 0 "[ . 1 . 2]" 1
1117 1 66 LEU HA 1 67 PRO HG3 . . 4.540 4.475 4.450 4.487 . 0 0 "[ . 1 . 2]" 1
1118 1 66 LEU HB2 1 66 LEU MD1 . . 3.660 2.311 2.156 2.475 . 0 0 "[ . 1 . 2]" 1
1119 1 66 LEU HB2 1 66 LEU MD2 . . 3.630 3.180 3.153 3.193 . 0 0 "[ . 1 . 2]" 1
1120 1 66 LEU HB2 1 67 PRO HD2 . . 4.250 3.614 3.563 3.647 . 0 0 "[ . 1 . 2]" 1
1121 1 66 LEU HB2 1 67 PRO HD3 . . 4.710 4.688 4.645 4.710 . 0 0 "[ . 1 . 2]" 1
1122 1 66 LEU HB2 1 70 HIS H . . 4.420 3.644 2.695 3.957 . 0 0 "[ . 1 . 2]" 1
1123 1 66 LEU HB2 1 70 HIS HB2 . . 3.940 2.627 2.422 2.898 . 0 0 "[ . 1 . 2]" 1
1124 1 66 LEU HB2 1 70 HIS HB3 . . 4.180 3.323 3.065 3.504 . 0 0 "[ . 1 . 2]" 1
1125 1 66 LEU HB2 1 71 ILE HA . . 4.660 2.557 2.349 3.113 . 0 0 "[ . 1 . 2]" 1
1126 1 66 LEU HB3 1 66 LEU MD1 . . 3.130 2.373 2.216 2.566 . 0 0 "[ . 1 . 2]" 1
1127 1 66 LEU HB3 1 66 LEU MD2 . . 3.240 2.314 2.105 2.406 . 0 0 "[ . 1 . 2]" 1
1128 1 66 LEU HB3 1 67 PRO HD2 . . 3.540 2.014 1.994 2.044 . 0 0 "[ . 1 . 2]" 1
1129 1 66 LEU HB3 1 67 PRO HD3 . . 3.600 3.457 3.441 3.485 . 0 0 "[ . 1 . 2]" 1
1130 1 66 LEU HB3 1 70 HIS H . . 4.500 4.322 3.881 4.453 . 0 0 "[ . 1 . 2]" 1
1131 1 66 LEU HB3 1 70 HIS HB2 . . 4.080 2.962 2.746 3.351 . 0 0 "[ . 1 . 2]" 1
1132 1 66 LEU HB3 1 70 HIS HB3 . . 4.650 4.128 3.858 4.665 0.015 19 0 "[ . 1 . 2]" 1
1133 1 66 LEU HB3 1 71 ILE HA . . 4.280 4.191 4.056 4.373 0.093 19 0 "[ . 1 . 2]" 1
1134 1 66 LEU MD1 1 70 HIS H . . 5.500 5.102 3.933 5.382 . 0 0 "[ . 1 . 2]" 1
1135 1 66 LEU MD1 1 70 HIS HB2 . . 3.730 3.281 2.253 3.667 . 0 0 "[ . 1 . 2]" 1
1136 1 66 LEU MD1 1 70 HIS HB3 . . 3.710 3.227 2.211 3.637 . 0 0 "[ . 1 . 2]" 1
1137 1 66 LEU MD1 1 71 ILE H . . 3.930 3.410 2.369 3.647 . 0 0 "[ . 1 . 2]" 1
1138 1 66 LEU MD1 1 72 GLY H . . 3.370 2.781 2.467 3.137 . 0 0 "[ . 1 . 2]" 1
1139 1 66 LEU MD1 1 72 GLY HA2 . . 3.750 3.329 3.121 3.510 . 0 0 "[ . 1 . 2]" 1
1140 1 66 LEU MD1 1 72 GLY HA3 . . 3.360 2.154 1.974 2.384 . 0 0 "[ . 1 . 2]" 1
1141 1 66 LEU MD1 1 73 ILE H . . 4.480 4.339 4.138 4.487 0.007 19 0 "[ . 1 . 2]" 1
1142 1 66 LEU MD2 1 67 PRO HD2 . . 3.570 2.263 2.023 2.581 . 0 0 "[ . 1 . 2]" 1
1143 1 66 LEU MD2 1 67 PRO HD3 . . 3.430 2.919 2.645 3.438 0.008 19 0 "[ . 1 . 2]" 1
1144 1 66 LEU MD2 1 72 GLY H . . 4.290 3.767 2.857 4.197 . 0 0 "[ . 1 . 2]" 1
1145 1 66 LEU MD2 1 72 GLY HA2 . . 5.500 5.230 4.215 5.500 . 0 0 "[ . 1 . 2]" 1
1146 1 66 LEU HG 1 67 PRO HD2 . . 4.650 4.351 4.261 4.499 . 0 0 "[ . 1 . 2]" 1
1147 1 66 LEU HG 1 72 GLY H . . 3.570 2.314 1.899 2.665 . 0 0 "[ . 1 . 2]" 1
1148 1 66 LEU HG 1 72 GLY HA2 . . 4.760 4.570 4.085 4.764 0.004 18 0 "[ . 1 . 2]" 1
1149 1 66 LEU HG 1 72 GLY HA3 . . 4.030 3.449 3.034 3.680 . 0 0 "[ . 1 . 2]" 1
1150 1 68 ASN QB 1 68 ASN QD . . 3.100 2.158 2.065 2.368 . 0 0 "[ . 1 . 2]" 1
1151 1 68 ASN QB 1 70 HIS HD2 . . 3.730 2.483 2.083 2.939 . 0 0 "[ . 1 . 2]" 1
1152 1 68 ASN HB2 1 70 HIS HD2 . . 4.530 2.976 2.188 3.992 . 0 0 "[ . 1 . 2]" 1
1153 1 68 ASN HB3 1 70 HIS HD2 . . 4.530 3.107 2.275 3.988 . 0 0 "[ . 1 . 2]" 1
1154 1 69 ASN H 1 69 ASN HA . . 2.730 2.279 2.273 2.317 . 0 0 "[ . 1 . 2]" 1
1155 1 69 ASN H 1 69 ASN QB . . 3.630 3.177 2.696 3.423 . 0 0 "[ . 1 . 2]" 1
1156 1 69 ASN H 1 70 HIS H . . 3.600 2.791 2.675 3.088 . 0 0 "[ . 1 . 2]" 1
1157 1 69 ASN HA 1 69 ASN HD21 . . 4.590 3.653 2.690 4.382 . 0 0 "[ . 1 . 2]" 1
1158 1 69 ASN HA 1 69 ASN QD . . 4.030 3.422 2.629 3.973 . 0 0 "[ . 1 . 2]" 1
1159 1 69 ASN HA 1 69 ASN HD22 . . 4.590 4.193 3.700 4.581 . 0 0 "[ . 1 . 2]" 1
1160 1 69 ASN QB 1 69 ASN QD . . 3.000 2.138 2.067 2.237 . 0 0 "[ . 1 . 2]" 1
1161 1 69 ASN HB2 1 69 ASN HD22 . . 4.080 3.656 3.436 4.062 . 0 0 "[ . 1 . 2]" 1
1162 1 69 ASN HB2 1 70 HIS H . . 5.250 4.390 4.135 4.634 . 0 0 "[ . 1 . 2]" 1
1163 1 69 ASN HB3 1 69 ASN HD22 . . 4.080 3.764 3.436 4.071 . 0 0 "[ . 1 . 2]" 1
1164 1 69 ASN HB3 1 70 HIS H . . 5.250 4.379 4.233 4.500 . 0 0 "[ . 1 . 2]" 1
1165 1 70 HIS H 1 70 HIS HB2 . . 3.360 2.745 2.649 2.834 . 0 0 "[ . 1 . 2]" 1
1166 1 70 HIS H 1 70 HIS HB3 . . 3.850 3.836 3.763 3.889 0.039 19 0 "[ . 1 . 2]" 1
1167 1 70 HIS H 1 71 ILE H . . 5.150 4.444 4.365 4.499 . 0 0 "[ . 1 . 2]" 1
1168 1 70 HIS H 1 71 ILE MD . . 5.500 5.400 5.258 5.530 0.030 19 0 "[ . 1 . 2]" 1
1169 1 70 HIS HA 1 71 ILE H . . 3.300 2.437 2.348 2.652 . 0 0 "[ . 1 . 2]" 1
1170 1 70 HIS HA 1 71 ILE HB . . 4.740 4.521 4.384 4.654 . 0 0 "[ . 1 . 2]" 1
1171 1 70 HIS HB2 1 71 ILE H . . 3.970 3.517 3.197 3.683 . 0 0 "[ . 1 . 2]" 1
1172 1 70 HIS HB2 1 71 ILE HA . . 4.560 4.530 4.483 4.566 0.006 3 0 "[ . 1 . 2]" 1
1173 1 70 HIS HB3 1 71 ILE H . . 3.520 2.382 1.950 2.578 . 0 0 "[ . 1 . 2]" 1
1174 1 70 HIS HB3 1 71 ILE HA . . 4.570 4.407 4.311 4.457 . 0 0 "[ . 1 . 2]" 1
1175 1 71 ILE H 1 71 ILE HB . . 3.500 2.856 2.809 2.902 . 0 0 "[ . 1 . 2]" 1
1176 1 71 ILE H 1 71 ILE MD . . 4.460 4.175 3.978 4.437 . 0 0 "[ . 1 . 2]" 1
1177 1 71 ILE H 1 71 ILE HG12 . . 4.320 4.228 4.054 4.334 0.014 3 0 "[ . 1 . 2]" 1
1178 1 71 ILE H 1 71 ILE QG . . 3.660 3.022 2.814 3.194 . 0 0 "[ . 1 . 2]" 1
1179 1 71 ILE H 1 71 ILE HG13 . . 4.320 3.098 2.862 3.292 . 0 0 "[ . 1 . 2]" 1
1180 1 71 ILE H 1 71 ILE MG . . 4.300 3.919 3.871 3.954 . 0 0 "[ . 1 . 2]" 1
1181 1 71 ILE H 1 72 GLY H . . 4.430 4.327 4.186 4.406 . 0 0 "[ . 1 . 2]" 1
1182 1 71 ILE HA 1 72 GLY H . . 2.960 2.222 2.155 2.301 . 0 0 "[ . 1 . 2]" 1
1183 1 71 ILE HA 1 72 GLY HA2 . . 4.950 4.449 4.401 4.497 . 0 0 "[ . 1 . 2]" 1
1184 1 71 ILE HA 1 72 GLY HA3 . . 4.730 4.321 4.303 4.355 . 0 0 "[ . 1 . 2]" 1
1185 1 71 ILE HB 1 71 ILE MD . . 3.200 2.314 2.158 2.556 . 0 0 "[ . 1 . 2]" 1
1186 1 71 ILE HB 1 72 GLY H . . 4.190 3.969 3.767 4.161 . 0 0 "[ . 1 . 2]" 1
1187 1 71 ILE MD 1 72 GLY H . . 5.140 4.927 4.812 5.096 . 0 0 "[ . 1 . 2]" 1
1188 1 71 ILE QG 1 72 GLY H . . 4.800 4.021 3.905 4.161 . 0 0 "[ . 1 . 2]" 1
1189 1 71 ILE HG12 1 71 ILE MG . . 3.410 2.272 2.091 2.394 . 0 0 "[ . 1 . 2]" 1
1190 1 71 ILE HG13 1 71 ILE MG . . 3.410 3.180 3.154 3.201 . 0 0 "[ . 1 . 2]" 1
1191 1 71 ILE MG 1 72 GLY H . . 3.250 2.074 1.885 2.405 . 0 0 "[ . 1 . 2]" 1
1192 1 71 ILE MG 1 72 GLY HA2 . . 4.730 3.359 3.153 3.619 . 0 0 "[ . 1 . 2]" 1
1193 1 71 ILE MG 1 72 GLY HA3 . . 4.800 4.018 3.885 4.188 . 0 0 "[ . 1 . 2]" 1
1194 1 72 GLY HA2 1 73 ILE H . . 3.410 2.515 2.310 2.748 . 0 0 "[ . 1 . 2]" 1
1195 1 72 GLY HA2 1 73 ILE MG . . 5.450 4.105 3.838 4.337 . 0 0 "[ . 1 . 2]" 1
1196 1 72 GLY HA3 1 73 ILE H . . 3.520 2.619 2.391 2.854 . 0 0 "[ . 1 . 2]" 1
1197 1 72 GLY HA3 1 73 ILE HA . . 5.180 4.477 4.404 4.532 . 0 0 "[ . 1 . 2]" 1
1198 1 72 GLY HA3 1 73 ILE MG . . 5.300 4.369 4.105 4.515 . 0 0 "[ . 1 . 2]" 1
1199 1 73 ILE H 1 73 ILE HB . . 3.900 2.881 2.715 3.061 . 0 0 "[ . 1 . 2]" 1
1200 1 73 ILE H 1 73 ILE MD . . 4.880 4.555 4.486 4.630 . 0 0 "[ . 1 . 2]" 1
1201 1 73 ILE H 1 73 ILE HG12 . . 4.720 4.554 4.470 4.688 . 0 0 "[ . 1 . 2]" 1
1202 1 73 ILE H 1 73 ILE HG13 . . 4.710 4.530 4.469 4.612 . 0 0 "[ . 1 . 2]" 1
1203 1 73 ILE H 1 73 ILE MG . . 3.500 2.143 1.894 2.276 . 0 0 "[ . 1 . 2]" 1
1204 1 73 ILE H 1 74 SER H . . 4.710 4.530 4.482 4.561 . 0 0 "[ . 1 . 2]" 1
1205 1 73 ILE HA 1 73 ILE MD . . 3.930 3.572 3.497 3.754 . 0 0 "[ . 1 . 2]" 1
1206 1 73 ILE HA 1 73 ILE HG12 . . 4.160 3.271 3.085 3.356 . 0 0 "[ . 1 . 2]" 1
1207 1 73 ILE HA 1 73 ILE HG13 . . 3.280 2.281 2.178 2.408 . 0 0 "[ . 1 . 2]" 1
1208 1 73 ILE HA 1 73 ILE MG . . 3.720 3.190 3.180 3.202 . 0 0 "[ . 1 . 2]" 1
1209 1 73 ILE HA 1 74 SER H . . 2.940 2.303 2.244 2.406 . 0 0 "[ . 1 . 2]" 1
1210 1 73 ILE HA 1 74 SER HA . . 5.220 4.431 4.399 4.470 . 0 0 "[ . 1 . 2]" 1
1211 1 73 ILE HA 1 74 SER QB . . 4.410 4.018 3.907 4.431 0.021 18 0 "[ . 1 . 2]" 1
1212 1 73 ILE HB 1 73 ILE MD . . 3.010 2.191 2.101 2.445 . 0 0 "[ . 1 . 2]" 1
1213 1 73 ILE HB 1 74 SER H . . 4.040 3.946 3.822 4.046 0.006 11 0 "[ . 1 . 2]" 1
1214 1 73 ILE MD 1 73 ILE MG . . 2.870 2.355 1.960 2.486 . 0 0 "[ . 1 . 2]" 1
1215 1 73 ILE MD 1 74 SER H . . 3.960 3.708 3.494 3.879 . 0 0 "[ . 1 . 2]" 1
1216 1 73 ILE MD 1 75 PHE QD . . 3.950 3.743 3.138 3.955 0.005 6 0 "[ . 1 . 2]" 1
1217 1 73 ILE MD 1 101 ILE MD . . 4.720 4.253 3.873 4.640 . 0 0 "[ . 1 . 2]" 1
1218 1 73 ILE HG12 1 73 ILE MG . . 3.350 2.161 2.047 2.300 . 0 0 "[ . 1 . 2]" 1
1219 1 73 ILE HG12 1 74 SER H . . 3.980 2.520 2.160 2.800 . 0 0 "[ . 1 . 2]" 1
1220 1 73 ILE HG12 1 74 SER HA . . 5.190 3.978 3.667 4.193 . 0 0 "[ . 1 . 2]" 1
1221 1 73 ILE HG12 1 75 PHE H . . 5.400 4.188 3.794 4.423 . 0 0 "[ . 1 . 2]" 1
1222 1 73 ILE HG12 1 75 PHE QD . . 3.960 2.976 2.518 3.453 . 0 0 "[ . 1 . 2]" 1
1223 1 73 ILE HG12 1 75 PHE QE . . 5.500 4.952 4.497 5.477 . 0 0 "[ . 1 . 2]" 1
1224 1 73 ILE HG13 1 73 ILE MG . . 3.660 3.153 3.131 3.199 . 0 0 "[ . 1 . 2]" 1
1225 1 73 ILE HG13 1 74 SER H . . 3.350 2.111 1.915 2.326 . 0 0 "[ . 1 . 2]" 1
1226 1 73 ILE HG13 1 74 SER HA . . 5.500 4.679 4.490 4.879 . 0 0 "[ . 1 . 2]" 1
1227 1 73 ILE HG13 1 75 PHE H . . 5.500 5.420 5.280 5.501 0.001 19 0 "[ . 1 . 2]" 1
1228 1 73 ILE MG 1 74 SER H . . 4.020 3.534 3.264 3.722 . 0 0 "[ . 1 . 2]" 1
1229 1 73 ILE MG 1 75 PHE QD . . 4.040 2.584 2.216 3.014 . 0 0 "[ . 1 . 2]" 1
1230 1 73 ILE MG 1 101 ILE MD . . 3.880 2.801 2.604 2.999 . 0 0 "[ . 1 . 2]" 1
1231 1 74 SER H 1 74 SER QB . . 3.340 2.585 2.426 3.197 . 0 0 "[ . 1 . 2]" 1
1232 1 74 SER HA 1 75 PHE H . . 2.890 2.143 2.138 2.152 . 0 0 "[ . 1 . 2]" 1
1233 1 74 SER HA 1 75 PHE HA . . 5.210 4.385 4.371 4.410 . 0 0 "[ . 1 . 2]" 1
1234 1 74 SER HA 1 75 PHE QD . . 4.500 3.891 3.687 4.090 . 0 0 "[ . 1 . 2]" 1
1235 1 74 SER QB 1 75 PHE H . . 3.980 3.729 3.323 3.918 . 0 0 "[ . 1 . 2]" 1
1236 1 75 PHE H 1 75 PHE HB3 . . 4.060 3.145 2.986 3.266 . 0 0 "[ . 1 . 2]" 1
1237 1 75 PHE H 1 75 PHE QD . . 3.580 2.817 2.383 3.221 . 0 0 "[ . 1 . 2]" 1
1238 1 75 PHE H 1 76 ILE H . . 4.470 4.387 4.333 4.439 . 0 0 "[ . 1 . 2]" 1
1239 1 75 PHE H 1 76 ILE HA . . 4.880 4.689 4.621 4.804 . 0 0 "[ . 1 . 2]" 1
1240 1 75 PHE H 1 76 ILE QG . . 5.340 4.658 4.483 4.870 . 0 0 "[ . 1 . 2]" 1
1241 1 75 PHE HA 1 75 PHE QD . . 3.900 3.692 3.674 3.716 . 0 0 "[ . 1 . 2]" 1
1242 1 75 PHE HA 1 76 ILE H . . 3.210 2.382 2.298 2.510 . 0 0 "[ . 1 . 2]" 1
1243 1 75 PHE HA 1 76 ILE HB . . 4.960 4.713 4.554 4.865 . 0 0 "[ . 1 . 2]" 1
1244 1 75 PHE HA 1 76 ILE QG . . 4.880 3.388 3.195 3.704 . 0 0 "[ . 1 . 2]" 1
1245 1 75 PHE HB2 1 76 ILE H . . 3.420 2.618 2.340 2.800 . 0 0 "[ . 1 . 2]" 1
1246 1 75 PHE HB2 1 76 ILE HB . . 5.500 5.096 4.972 5.203 . 0 0 "[ . 1 . 2]" 1
1247 1 75 PHE HB3 1 76 ILE H . . 4.100 3.967 3.787 4.080 . 0 0 "[ . 1 . 2]" 1
1248 1 75 PHE QD 1 76 ILE H . . 3.870 2.877 2.558 3.145 . 0 0 "[ . 1 . 2]" 1
1249 1 75 PHE QD 1 76 ILE MG . . 4.910 4.812 4.637 4.919 0.009 8 0 "[ . 1 . 2]" 1
1250 1 75 PHE QD 1 77 PRO HA . . 3.970 3.166 3.065 3.253 . 0 0 "[ . 1 . 2]" 1
1251 1 75 PHE QD 1 77 PRO HB2 . . 5.500 5.265 5.172 5.351 . 0 0 "[ . 1 . 2]" 1
1252 1 75 PHE QD 1 77 PRO HB3 . . 4.440 3.988 3.871 4.095 . 0 0 "[ . 1 . 2]" 1
1253 1 75 PHE QD 1 77 PRO HD2 . . 4.990 4.533 4.333 4.612 . 0 0 "[ . 1 . 2]" 1
1254 1 75 PHE QD 1 77 PRO HD3 . . 4.990 3.363 3.190 3.424 . 0 0 "[ . 1 . 2]" 1
1255 1 75 PHE QD 1 77 PRO HG3 . . 5.180 4.930 4.724 5.022 . 0 0 "[ . 1 . 2]" 1
1256 1 75 PHE QD 1 101 ILE MD . . 4.980 3.955 3.530 4.425 . 0 0 "[ . 1 . 2]" 1
1257 1 75 PHE QE 1 77 PRO HA . . 3.600 2.168 1.993 2.562 . 0 0 "[ . 1 . 2]" 1
1258 1 75 PHE QE 1 77 PRO HB2 . . 4.510 3.534 3.445 3.657 . 0 0 "[ . 1 . 2]" 1
1259 1 75 PHE QE 1 77 PRO HB3 . . 3.870 1.997 1.993 2.002 . 0 0 "[ . 1 . 2]" 1
1260 1 75 PHE QE 1 77 PRO QD . . 4.440 3.140 2.928 3.272 . 0 0 "[ . 1 . 2]" 1
1261 1 75 PHE QE 1 77 PRO HG2 . . 4.700 4.522 4.424 4.642 . 0 0 "[ . 1 . 2]" 1
1262 1 75 PHE QE 1 77 PRO HG3 . . 4.280 3.730 3.625 3.818 . 0 0 "[ . 1 . 2]" 1
1263 1 75 PHE QE 1 78 ARG H . . 4.760 4.147 3.876 4.575 . 0 0 "[ . 1 . 2]" 1
1264 1 75 PHE QE 1 83 HIS HB2 . . 5.500 4.693 4.453 4.906 . 0 0 "[ . 1 . 2]" 1
1265 1 75 PHE QE 1 83 HIS HB3 . . 5.370 4.589 4.248 4.912 . 0 0 "[ . 1 . 2]" 1
1266 1 75 PHE QE 1 83 HIS HD2 . . 4.060 3.317 2.937 3.740 . 0 0 "[ . 1 . 2]" 1
1267 1 75 PHE QE 1 101 ILE MD . . 3.940 2.466 2.011 2.818 . 0 0 "[ . 1 . 2]" 1
1268 1 75 PHE QE 1 101 ILE MG . . 4.520 3.315 2.869 3.897 . 0 0 "[ . 1 . 2]" 1
1269 1 75 PHE QE 1 103 VAL MG2 . . 3.910 3.524 3.309 3.741 . 0 0 "[ . 1 . 2]" 1
1270 1 75 PHE HZ 1 77 PRO HA . . 5.370 4.401 3.996 4.931 . 0 0 "[ . 1 . 2]" 1
1271 1 75 PHE HZ 1 77 PRO HB3 . . 4.720 2.812 2.169 3.448 . 0 0 "[ . 1 . 2]" 1
1272 1 75 PHE HZ 1 77 PRO HG3 . . 5.060 3.859 3.316 4.435 . 0 0 "[ . 1 . 2]" 1
1273 1 75 PHE HZ 1 83 HIS HD2 . . 4.530 3.974 3.413 4.421 . 0 0 "[ . 1 . 2]" 1
1274 1 75 PHE HZ 1 101 ILE MD . . 4.640 3.564 2.862 4.121 . 0 0 "[ . 1 . 2]" 1
1275 1 75 PHE HZ 1 101 ILE MG . . 4.560 3.398 2.673 3.842 . 0 0 "[ . 1 . 2]" 1
1276 1 75 PHE HZ 1 103 VAL MG2 . . 3.760 2.845 2.464 3.224 . 0 0 "[ . 1 . 2]" 1
1277 1 76 ILE H 1 76 ILE HB . . 3.290 2.580 2.428 2.681 . 0 0 "[ . 1 . 2]" 1
1278 1 76 ILE H 1 76 ILE MD . . 4.070 3.550 3.355 3.824 . 0 0 "[ . 1 . 2]" 1
1279 1 76 ILE H 1 76 ILE HG12 . . 4.220 3.993 3.785 4.163 . 0 0 "[ . 1 . 2]" 1
1280 1 76 ILE H 1 76 ILE QG . . 3.600 2.595 2.333 2.803 . 0 0 "[ . 1 . 2]" 1
1281 1 76 ILE H 1 76 ILE HG13 . . 4.220 2.629 2.354 2.851 . 0 0 "[ . 1 . 2]" 1
1282 1 76 ILE H 1 76 ILE MG . . 4.080 3.821 3.738 3.869 . 0 0 "[ . 1 . 2]" 1
1283 1 76 ILE H 1 77 PRO HD2 . . 5.170 4.598 4.487 4.679 . 0 0 "[ . 1 . 2]" 1
1284 1 76 ILE H 1 77 PRO QD . . 4.440 3.888 3.737 4.001 . 0 0 "[ . 1 . 2]" 1
1285 1 76 ILE H 1 77 PRO HD3 . . 5.170 4.194 3.998 4.347 . 0 0 "[ . 1 . 2]" 1
1286 1 76 ILE HA 1 76 ILE MD . . 3.990 3.889 3.830 3.948 . 0 0 "[ . 1 . 2]" 1
1287 1 76 ILE HA 1 76 ILE HG12 . . 4.050 2.756 2.650 2.894 . 0 0 "[ . 1 . 2]" 1
1288 1 76 ILE HA 1 76 ILE QG . . 3.560 2.467 2.364 2.568 . 0 0 "[ . 1 . 2]" 1
1289 1 76 ILE HA 1 76 ILE HG13 . . 4.050 2.794 2.640 2.976 . 0 0 "[ . 1 . 2]" 1
1290 1 76 ILE HA 1 76 ILE MG . . 3.290 2.384 2.238 2.475 . 0 0 "[ . 1 . 2]" 1
1291 1 76 ILE HA 1 77 PRO HD2 . . 3.420 1.914 1.910 1.927 . 0 0 "[ . 1 . 2]" 1
1292 1 76 ILE HA 1 77 PRO HD3 . . 3.420 2.496 2.415 2.610 . 0 0 "[ . 1 . 2]" 1
1293 1 76 ILE HA 1 77 PRO HG2 . . 4.460 4.117 4.113 4.130 . 0 0 "[ . 1 . 2]" 1
1294 1 76 ILE HA 1 77 PRO HG3 . . 4.960 4.380 4.342 4.442 . 0 0 "[ . 1 . 2]" 1
1295 1 76 ILE HB 1 76 ILE MD . . 3.050 2.253 2.111 2.377 . 0 0 "[ . 1 . 2]" 1
1296 1 76 ILE HB 1 77 PRO QD . . 5.350 4.280 4.210 4.348 . 0 0 "[ . 1 . 2]" 1
1297 1 76 ILE HB 1 78 ARG HD2 . . 5.500 4.446 3.326 5.505 0.005 11 0 "[ . 1 . 2]" 1
1298 1 76 ILE HB 1 78 ARG HD3 . . 5.500 4.503 4.056 5.429 . 0 0 "[ . 1 . 2]" 1
1299 1 76 ILE MD 1 76 ILE MG . . 2.880 2.309 2.046 2.490 . 0 0 "[ . 1 . 2]" 1
1300 1 76 ILE QG 1 76 ILE MG . . 3.010 2.126 2.008 2.226 . 0 0 "[ . 1 . 2]" 1
1301 1 76 ILE HG12 1 76 ILE MG . . 3.560 2.161 2.032 2.274 . 0 0 "[ . 1 . 2]" 1
1302 1 76 ILE HG13 1 76 ILE MG . . 3.560 3.158 3.126 3.185 . 0 0 "[ . 1 . 2]" 1
1303 1 76 ILE MG 1 77 PRO HA . . 4.810 4.296 4.175 4.478 . 0 0 "[ . 1 . 2]" 1
1304 1 76 ILE MG 1 77 PRO HD2 . . 4.520 2.868 2.626 3.246 . 0 0 "[ . 1 . 2]" 1
1305 1 76 ILE MG 1 77 PRO QD . . 3.710 2.809 2.583 3.150 . 0 0 "[ . 1 . 2]" 1
1306 1 76 ILE MG 1 77 PRO HD3 . . 4.520 4.027 3.835 4.251 . 0 0 "[ . 1 . 2]" 1
1307 1 76 ILE MG 1 77 PRO HG2 . . 4.350 4.034 3.753 4.364 0.014 1 0 "[ . 1 . 2]" 1
1308 1 76 ILE MG 1 78 ARG H . . 5.500 4.561 3.690 5.057 . 0 0 "[ . 1 . 2]" 1
1309 1 76 ILE MG 1 78 ARG HD2 . . 4.560 3.068 2.237 3.831 . 0 0 "[ . 1 . 2]" 1
1310 1 76 ILE MG 1 78 ARG HD3 . . 4.560 3.601 3.123 4.423 . 0 0 "[ . 1 . 2]" 1
1311 1 77 PRO HA 1 78 ARG H . . 3.300 2.163 2.151 2.260 . 0 0 "[ . 1 . 2]" 1
1312 1 77 PRO HA 1 79 GLU H . . 3.800 3.600 3.401 3.800 . 0 0 "[ . 1 . 2]" 1
1313 1 77 PRO HA 1 103 VAL MG1 . . 4.800 4.561 4.274 4.800 0.000 14 0 "[ . 1 . 2]" 1
1314 1 77 PRO HA 1 103 VAL MG2 . . 5.160 4.411 4.108 4.644 . 0 0 "[ . 1 . 2]" 1
1315 1 77 PRO HB2 1 79 GLU H . . 4.300 3.550 3.032 3.944 . 0 0 "[ . 1 . 2]" 1
1316 1 77 PRO HB2 1 103 VAL MG1 . . 3.510 2.300 1.978 2.538 . 0 0 "[ . 1 . 2]" 1
1317 1 77 PRO HB2 1 103 VAL MG2 . . 3.650 3.042 2.641 3.308 . 0 0 "[ . 1 . 2]" 1
1318 1 77 PRO HB3 1 78 ARG H . . 4.600 4.057 3.862 4.405 . 0 0 "[ . 1 . 2]" 1
1319 1 77 PRO HB3 1 79 GLU H . . 4.820 4.516 4.138 4.808 . 0 0 "[ . 1 . 2]" 1
1320 1 77 PRO HB3 1 83 HIS HE1 . . 5.500 4.927 4.481 5.474 . 0 0 "[ . 1 . 2]" 1
1321 1 77 PRO HB3 1 103 VAL HB . . 4.830 4.756 4.516 4.832 0.002 17 0 "[ . 1 . 2]" 1
1322 1 77 PRO HB3 1 103 VAL MG1 . . 3.500 3.144 2.730 3.461 . 0 0 "[ . 1 . 2]" 1
1323 1 77 PRO HB3 1 103 VAL MG2 . . 3.440 2.645 2.367 2.860 . 0 0 "[ . 1 . 2]" 1
1324 1 77 PRO QD 1 103 VAL MG2 . . 5.070 4.396 4.197 4.630 . 0 0 "[ . 1 . 2]" 1
1325 1 77 PRO HG2 1 103 VAL MG1 . . 3.720 3.251 3.025 3.674 . 0 0 "[ . 1 . 2]" 1
1326 1 77 PRO HG2 1 103 VAL MG2 . . 4.760 4.176 3.864 4.599 . 0 0 "[ . 1 . 2]" 1
1327 1 77 PRO HG3 1 103 VAL MG1 . . 3.530 3.042 2.783 3.358 . 0 0 "[ . 1 . 2]" 1
1328 1 77 PRO HG3 1 103 VAL MG2 . . 3.800 3.196 2.831 3.644 . 0 0 "[ . 1 . 2]" 1
1329 1 78 ARG H 1 78 ARG QB . . 3.580 2.315 2.171 2.527 . 0 0 "[ . 1 . 2]" 1
1330 1 78 ARG H 1 78 ARG HG2 . . 4.690 3.758 2.227 4.707 0.017 11 0 "[ . 1 . 2]" 1
1331 1 78 ARG H 1 78 ARG HG3 . . 4.690 3.990 3.579 4.542 . 0 0 "[ . 1 . 2]" 1
1332 1 78 ARG H 1 79 GLU H . . 3.120 2.222 1.975 2.632 . 0 0 "[ . 1 . 2]" 1
1333 1 78 ARG HA 1 78 ARG HD2 . . 4.100 2.758 2.003 3.905 . 0 0 "[ . 1 . 2]" 1
1334 1 78 ARG HA 1 78 ARG HD3 . . 4.100 3.540 2.751 3.985 . 0 0 "[ . 1 . 2]" 1
1335 1 78 ARG HA 1 78 ARG HG2 . . 3.800 3.337 2.783 3.656 . 0 0 "[ . 1 . 2]" 1
1336 1 78 ARG HA 1 78 ARG QG . . 3.300 2.477 2.169 2.916 . 0 0 "[ . 1 . 2]" 1
1337 1 78 ARG HA 1 78 ARG HG3 . . 3.800 2.840 2.190 3.809 0.009 9 0 "[ . 1 . 2]" 1
1338 1 78 ARG QB 1 78 ARG QD . . 3.000 2.423 2.141 2.712 . 0 0 "[ . 1 . 2]" 1
1339 1 78 ARG QB 1 79 GLU H . . 3.590 2.960 2.696 3.350 . 0 0 "[ . 1 . 2]" 1
1340 1 79 GLU H 1 79 GLU HB2 . . 4.060 2.740 2.401 3.062 . 0 0 "[ . 1 . 2]" 1
1341 1 79 GLU H 1 79 GLU HB3 . . 4.060 3.187 2.508 3.740 . 0 0 "[ . 1 . 2]" 1
1342 1 79 GLU H 1 79 GLU HG2 . . 4.730 4.489 3.526 4.732 0.002 16 0 "[ . 1 . 2]" 1
1343 1 79 GLU H 1 79 GLU QG . . 4.160 3.844 3.408 4.151 . 0 0 "[ . 1 . 2]" 1
1344 1 79 GLU H 1 79 GLU HG3 . . 4.730 4.295 3.565 4.627 . 0 0 "[ . 1 . 2]" 1
1345 1 79 GLU H 1 83 HIS HE1 . . 4.220 3.610 3.273 4.022 . 0 0 "[ . 1 . 2]" 1
1346 1 79 GLU H 1 103 VAL MG1 . . 4.790 4.250 3.794 4.783 . 0 0 "[ . 1 . 2]" 1
1347 1 79 GLU HA 1 79 GLU HG2 . . 4.030 3.103 2.351 3.839 . 0 0 "[ . 1 . 2]" 1
1348 1 79 GLU HA 1 79 GLU QG . . 3.500 2.478 2.185 2.946 . 0 0 "[ . 1 . 2]" 1
1349 1 79 GLU HA 1 79 GLU HG3 . . 4.030 2.806 2.222 3.627 . 0 0 "[ . 1 . 2]" 1
1350 1 79 GLU HA 1 80 VAL H . . 2.760 2.445 2.291 2.624 . 0 0 "[ . 1 . 2]" 1
1351 1 79 GLU HA 1 80 VAL HA . . 4.580 4.411 4.369 4.456 . 0 0 "[ . 1 . 2]" 1
1352 1 79 GLU HA 1 80 VAL MG1 . . 3.820 3.571 3.422 3.688 . 0 0 "[ . 1 . 2]" 1
1353 1 79 GLU HA 1 80 VAL MG2 . . 4.030 3.770 3.541 4.017 . 0 0 "[ . 1 . 2]" 1
1354 1 79 GLU HB2 1 80 VAL H . . 3.890 3.793 3.521 3.953 0.063 8 0 "[ . 1 . 2]" 1
1355 1 79 GLU HB2 1 83 HIS HE1 . . 4.640 3.733 2.864 4.602 . 0 0 "[ . 1 . 2]" 1
1356 1 79 GLU HB3 1 80 VAL H . . 3.890 2.871 2.009 3.876 . 0 0 "[ . 1 . 2]" 1
1357 1 79 GLU HB3 1 83 HIS HE1 . . 4.640 2.998 2.463 3.579 . 0 0 "[ . 1 . 2]" 1
1358 1 79 GLU QG 1 80 VAL H . . 3.770 2.752 1.856 3.775 0.005 3 0 "[ . 1 . 2]" 1
1359 1 79 GLU HG2 1 80 VAL H . . 4.430 3.378 1.869 4.425 . 0 0 "[ . 1 . 2]" 1
1360 1 79 GLU HG3 1 80 VAL H . . 4.430 3.273 2.133 4.422 . 0 0 "[ . 1 . 2]" 1
1361 1 80 VAL H 1 80 VAL HB . . 3.780 3.745 3.704 3.795 0.015 9 0 "[ . 1 . 2]" 1
1362 1 80 VAL H 1 80 VAL MG1 . . 3.210 2.862 2.604 3.115 . 0 0 "[ . 1 . 2]" 1
1363 1 80 VAL H 1 80 VAL MG2 . . 2.930 2.044 1.914 2.248 . 0 0 "[ . 1 . 2]" 1
1364 1 80 VAL H 1 81 GLY H . . 4.770 4.480 4.422 4.535 . 0 0 "[ . 1 . 2]" 1
1365 1 80 VAL H 1 103 VAL MG1 . . 4.680 4.297 4.099 4.446 . 0 0 "[ . 1 . 2]" 1
1366 1 80 VAL HA 1 80 VAL MG1 . . 3.190 2.263 2.181 2.346 . 0 0 "[ . 1 . 2]" 1
1367 1 80 VAL HA 1 80 VAL MG2 . . 3.440 3.199 3.186 3.204 . 0 0 "[ . 1 . 2]" 1
1368 1 80 VAL HA 1 81 GLY H . . 2.990 2.231 2.178 2.389 . 0 0 "[ . 1 . 2]" 1
1369 1 80 VAL HA 1 81 GLY HA2 . . 4.680 4.514 4.461 4.638 . 0 0 "[ . 1 . 2]" 1
1370 1 80 VAL HA 1 83 HIS HE1 . . 4.450 3.429 2.953 3.752 . 0 0 "[ . 1 . 2]" 1
1371 1 80 VAL HA 1 103 VAL H . . 4.550 4.205 4.088 4.363 . 0 0 "[ . 1 . 2]" 1
1372 1 80 VAL HA 1 103 VAL HB . . 3.560 2.072 2.000 2.255 . 0 0 "[ . 1 . 2]" 1
1373 1 80 VAL HA 1 103 VAL MG1 . . 3.370 2.213 1.970 2.361 . 0 0 "[ . 1 . 2]" 1
1374 1 80 VAL HA 1 103 VAL MG2 . . 4.330 3.631 3.441 3.791 . 0 0 "[ . 1 . 2]" 1
1375 1 80 VAL HA 1 104 VAL HA . . 4.480 4.038 3.850 4.392 . 0 0 "[ . 1 . 2]" 1
1376 1 80 VAL HB 1 81 GLY H . . 3.370 2.894 2.437 3.108 . 0 0 "[ . 1 . 2]" 1
1377 1 80 VAL HB 1 81 GLY HA2 . . 4.940 4.137 3.971 4.277 . 0 0 "[ . 1 . 2]" 1
1378 1 80 VAL HB 1 103 VAL HB . . 4.700 3.818 3.241 4.075 . 0 0 "[ . 1 . 2]" 1
1379 1 80 VAL HB 1 104 VAL HA . . 4.240 2.180 2.001 2.567 . 0 0 "[ . 1 . 2]" 1
1380 1 80 VAL MG1 1 81 GLY H . . 4.080 3.803 3.554 3.998 . 0 0 "[ . 1 . 2]" 1
1381 1 80 VAL MG1 1 104 VAL HA . . 3.480 2.416 1.964 2.746 . 0 0 "[ . 1 . 2]" 1
1382 1 80 VAL MG1 1 105 GLN H . . 3.530 2.400 1.888 3.002 . 0 0 "[ . 1 . 2]" 1
1383 1 80 VAL MG1 1 105 GLN QB . . 3.400 3.090 1.930 3.402 0.002 5 0 "[ . 1 . 2]" 1
1384 1 80 VAL MG1 1 105 GLN QE . . 4.920 3.304 2.092 4.577 . 0 0 "[ . 1 . 2]" 1
1385 1 80 VAL MG2 1 81 GLY H . . 3.890 3.792 3.371 3.890 . 0 0 "[ . 1 . 2]" 1
1386 1 80 VAL MG2 1 105 GLN H . . 4.300 3.467 3.039 3.968 . 0 0 "[ . 1 . 2]" 1
1387 1 80 VAL MG2 1 105 GLN HA . . 5.110 4.967 4.619 5.111 0.001 14 0 "[ . 1 . 2]" 1
1388 1 81 GLY H 1 82 GLU H . . 4.350 4.318 4.262 4.358 0.008 4 0 "[ . 1 . 2]" 1
1389 1 81 GLY H 1 82 GLU HA . . 5.500 4.811 4.752 4.880 . 0 0 "[ . 1 . 2]" 1
1390 1 81 GLY H 1 83 HIS HE1 . . 4.930 4.035 3.580 4.365 . 0 0 "[ . 1 . 2]" 1
1391 1 81 GLY H 1 102 MET ME . . 4.410 3.330 2.837 4.186 . 0 0 "[ . 1 . 2]" 1
1392 1 81 GLY H 1 103 VAL H . . 3.570 2.536 2.459 2.673 . 0 0 "[ . 1 . 2]" 1
1393 1 81 GLY H 1 103 VAL HB . . 3.440 2.074 1.922 2.242 . 0 0 "[ . 1 . 2]" 1
1394 1 81 GLY H 1 103 VAL MG1 . . 3.870 3.373 3.190 3.543 . 0 0 "[ . 1 . 2]" 1
1395 1 81 GLY H 1 103 VAL MG2 . . 4.240 3.587 3.472 3.702 . 0 0 "[ . 1 . 2]" 1
1396 1 81 GLY H 1 104 VAL HA . . 4.380 4.117 3.994 4.285 . 0 0 "[ . 1 . 2]" 1
1397 1 81 GLY H 1 104 VAL MG1 . . 5.270 4.016 3.637 4.267 . 0 0 "[ . 1 . 2]" 1
1398 1 81 GLY HA2 1 82 GLU H . . 3.130 3.063 2.980 3.126 . 0 0 "[ . 1 . 2]" 1
1399 1 81 GLY HA2 1 82 GLU HA . . 4.450 4.425 4.403 4.452 0.002 6 0 "[ . 1 . 2]" 1
1400 1 81 GLY HA2 1 82 GLU HB2 . . 5.310 4.688 4.560 4.750 . 0 0 "[ . 1 . 2]" 1
1401 1 81 GLY HA2 1 82 GLU HB3 . . 5.310 5.227 5.053 5.309 . 0 0 "[ . 1 . 2]" 1
1402 1 81 GLY HA2 1 102 MET ME . . 3.790 2.204 1.949 2.777 . 0 0 "[ . 1 . 2]" 1
1403 1 81 GLY HA2 1 103 VAL H . . 4.500 3.931 3.751 4.024 . 0 0 "[ . 1 . 2]" 1
1404 1 81 GLY HA2 1 103 VAL MG2 . . 5.500 5.474 5.384 5.507 0.007 13 0 "[ . 1 . 2]" 1
1405 1 81 GLY HA3 1 82 GLU H . . 3.040 2.187 2.160 2.228 . 0 0 "[ . 1 . 2]" 1
1406 1 81 GLY HA3 1 82 GLU QB . . 4.570 4.199 4.166 4.248 . 0 0 "[ . 1 . 2]" 1
1407 1 81 GLY HA3 1 83 HIS HD1 . . 5.050 4.128 3.961 4.336 . 0 0 "[ . 1 . 2]" 1
1408 1 81 GLY HA3 1 102 MET ME . . 4.110 3.451 3.251 3.920 . 0 0 "[ . 1 . 2]" 1
1409 1 81 GLY HA3 1 103 VAL H . . 5.010 4.580 4.510 4.707 . 0 0 "[ . 1 . 2]" 1
1410 1 82 GLU H 1 82 GLU HB2 . . 3.080 2.913 2.830 3.050 . 0 0 "[ . 1 . 2]" 1
1411 1 82 GLU H 1 82 GLU QB . . 2.690 2.371 2.337 2.442 . 0 0 "[ . 1 . 2]" 1
1412 1 82 GLU H 1 82 GLU HB3 . . 3.080 2.513 2.431 2.634 . 0 0 "[ . 1 . 2]" 1
1413 1 82 GLU H 1 82 GLU HG2 . . 4.820 4.406 4.263 4.749 . 0 0 "[ . 1 . 2]" 1
1414 1 82 GLU H 1 82 GLU QG . . 4.140 4.012 3.962 4.088 . 0 0 "[ . 1 . 2]" 1
1415 1 82 GLU H 1 82 GLU HG3 . . 4.820 4.629 4.459 4.733 . 0 0 "[ . 1 . 2]" 1
1416 1 82 GLU H 1 83 HIS H . . 4.600 4.165 4.071 4.301 . 0 0 "[ . 1 . 2]" 1
1417 1 82 GLU H 1 102 MET ME . . 4.010 3.516 3.184 3.856 . 0 0 "[ . 1 . 2]" 1
1418 1 82 GLU HA 1 82 GLU HG2 . . 4.060 3.157 2.859 3.765 . 0 0 "[ . 1 . 2]" 1
1419 1 82 GLU HA 1 82 GLU QG . . 3.530 2.487 2.385 2.636 . 0 0 "[ . 1 . 2]" 1
1420 1 82 GLU HA 1 82 GLU HG3 . . 4.060 2.619 2.451 2.890 . 0 0 "[ . 1 . 2]" 1
1421 1 82 GLU HA 1 83 HIS H . . 2.890 2.174 2.144 2.192 . 0 0 "[ . 1 . 2]" 1
1422 1 82 GLU HA 1 83 HIS HD1 . . 5.090 3.879 3.600 4.126 . 0 0 "[ . 1 . 2]" 1
1423 1 82 GLU HA 1 101 ILE H . . 4.710 4.470 4.146 4.686 . 0 0 "[ . 1 . 2]" 1
1424 1 82 GLU HA 1 102 MET HA . . 4.630 2.869 2.699 3.056 . 0 0 "[ . 1 . 2]" 1
1425 1 82 GLU HA 1 102 MET ME . . 3.820 3.386 2.802 3.780 . 0 0 "[ . 1 . 2]" 1
1426 1 82 GLU HA 1 103 VAL H . . 3.880 3.762 3.660 3.870 . 0 0 "[ . 1 . 2]" 1
1427 1 82 GLU QB 1 83 HIS H . . 4.170 3.956 3.897 3.979 . 0 0 "[ . 1 . 2]" 1
1428 1 82 GLU HB2 1 83 HIS H . . 4.900 4.453 4.396 4.525 . 0 0 "[ . 1 . 2]" 1
1429 1 82 GLU HB3 1 83 HIS H . . 4.900 4.428 4.353 4.493 . 0 0 "[ . 1 . 2]" 1
1430 1 82 GLU QG 1 83 HIS H . . 3.530 3.334 3.160 3.430 . 0 0 "[ . 1 . 2]" 1
1431 1 82 GLU QG 1 84 LEU MD2 . . 3.910 3.540 3.357 3.760 . 0 0 "[ . 1 . 2]" 1
1432 1 82 GLU QG 1 84 LEU HG . . 4.210 3.168 2.912 3.551 . 0 0 "[ . 1 . 2]" 1
1433 1 82 GLU QG 1 100 SER QB . . 3.650 3.315 2.897 3.645 . 0 0 "[ . 1 . 2]" 1
1434 1 82 GLU QG 1 101 ILE H . . 4.070 3.843 3.229 4.063 . 0 0 "[ . 1 . 2]" 1
1435 1 82 GLU HG2 1 84 LEU MD2 . . 4.620 3.747 3.525 4.032 . 0 0 "[ . 1 . 2]" 1
1436 1 82 GLU HG2 1 84 LEU HG . . 4.850 3.253 2.961 4.245 . 0 0 "[ . 1 . 2]" 1
1437 1 82 GLU HG2 1 100 SER HA . . 5.070 4.602 4.159 4.918 . 0 0 "[ . 1 . 2]" 1
1438 1 82 GLU HG2 1 101 ILE H . . 4.880 4.538 4.154 4.883 0.003 6 0 "[ . 1 . 2]" 1
1439 1 82 GLU HG3 1 84 LEU MD2 . . 4.620 4.397 3.667 4.616 . 0 0 "[ . 1 . 2]" 1
1440 1 82 GLU HG3 1 84 LEU HG . . 4.850 4.613 3.808 4.833 . 0 0 "[ . 1 . 2]" 1
1441 1 82 GLU HG3 1 100 SER HA . . 5.070 4.494 3.800 4.843 . 0 0 "[ . 1 . 2]" 1
1442 1 82 GLU HG3 1 101 ILE H . . 4.880 4.190 3.276 4.702 . 0 0 "[ . 1 . 2]" 1
1443 1 83 HIS H 1 83 HIS HB2 . . 3.430 2.286 2.236 2.368 . 0 0 "[ . 1 . 2]" 1
1444 1 83 HIS H 1 83 HIS HB3 . . 3.760 3.553 3.512 3.607 . 0 0 "[ . 1 . 2]" 1
1445 1 83 HIS H 1 83 HIS HD1 . . 3.800 2.765 2.568 3.005 . 0 0 "[ . 1 . 2]" 1
1446 1 83 HIS H 1 84 LEU H . . 4.570 4.537 4.459 4.575 0.005 4 0 "[ . 1 . 2]" 1
1447 1 83 HIS H 1 101 ILE H . . 3.760 3.350 3.165 3.608 . 0 0 "[ . 1 . 2]" 1
1448 1 83 HIS H 1 101 ILE HB . . 4.360 3.674 3.288 3.900 . 0 0 "[ . 1 . 2]" 1
1449 1 83 HIS H 1 102 MET HA . . 3.620 3.464 3.184 3.619 . 0 0 "[ . 1 . 2]" 1
1450 1 83 HIS H 1 103 VAL H . . 4.460 3.940 3.622 4.189 . 0 0 "[ . 1 . 2]" 1
1451 1 83 HIS HA 1 83 HIS HD2 . . 4.340 4.000 3.789 4.310 . 0 0 "[ . 1 . 2]" 1
1452 1 83 HIS HA 1 84 LEU H . . 2.870 2.207 2.146 2.298 . 0 0 "[ . 1 . 2]" 1
1453 1 83 HIS HA 1 101 ILE H . . 5.090 4.876 4.713 5.015 . 0 0 "[ . 1 . 2]" 1
1454 1 83 HIS HB2 1 84 LEU H . . 4.410 4.216 3.963 4.409 . 0 0 "[ . 1 . 2]" 1
1455 1 83 HIS HB2 1 85 VAL MG2 . . 4.590 4.271 4.145 4.422 . 0 0 "[ . 1 . 2]" 1
1456 1 83 HIS HB2 1 101 ILE H . . 4.370 3.745 3.590 3.924 . 0 0 "[ . 1 . 2]" 1
1457 1 83 HIS HB2 1 101 ILE HB . . 3.950 2.616 2.357 2.928 . 0 0 "[ . 1 . 2]" 1
1458 1 83 HIS HB2 1 101 ILE HG13 . . 5.220 4.802 4.566 5.144 . 0 0 "[ . 1 . 2]" 1
1459 1 83 HIS HB2 1 103 VAL MG2 . . 4.490 2.943 2.526 3.200 . 0 0 "[ . 1 . 2]" 1
1460 1 83 HIS HB3 1 83 HIS HD2 . . 3.890 2.696 2.691 2.741 . 0 0 "[ . 1 . 2]" 1
1461 1 83 HIS HB3 1 84 LEU H . . 3.640 3.079 2.719 3.422 . 0 0 "[ . 1 . 2]" 1
1462 1 83 HIS HB3 1 85 VAL MG2 . . 4.550 3.490 3.391 3.669 . 0 0 "[ . 1 . 2]" 1
1463 1 83 HIS HB3 1 101 ILE H . . 4.580 4.428 4.221 4.560 . 0 0 "[ . 1 . 2]" 1
1464 1 83 HIS HB3 1 101 ILE HB . . 4.250 3.566 3.344 3.784 . 0 0 "[ . 1 . 2]" 1
1465 1 83 HIS HB3 1 101 ILE HG13 . . 5.430 5.161 4.905 5.383 . 0 0 "[ . 1 . 2]" 1
1466 1 83 HIS HB3 1 103 VAL MG2 . . 4.960 4.108 3.732 4.373 . 0 0 "[ . 1 . 2]" 1
1467 1 83 HIS HD1 1 103 VAL H . . 4.610 3.884 3.460 4.130 . 0 0 "[ . 1 . 2]" 1
1468 1 83 HIS HD1 1 103 VAL HB . . 4.720 3.356 3.085 3.773 . 0 0 "[ . 1 . 2]" 1
1469 1 83 HIS HD1 1 103 VAL MG2 . . 4.050 2.899 2.651 3.273 . 0 0 "[ . 1 . 2]" 1
1470 1 83 HIS HE1 1 103 VAL HB . . 3.860 3.502 3.119 3.776 . 0 0 "[ . 1 . 2]" 1
1471 1 83 HIS HE1 1 103 VAL MG1 . . 4.210 3.907 3.566 4.210 0.000 16 0 "[ . 1 . 2]" 1
1472 1 83 HIS HE1 1 103 VAL MG2 . . 3.770 3.506 3.204 3.743 . 0 0 "[ . 1 . 2]" 1
1473 1 84 LEU H 1 84 LEU HB2 . . 3.150 2.378 2.261 2.466 . 0 0 "[ . 1 . 2]" 1
1474 1 84 LEU H 1 84 LEU HB3 . . 3.730 3.601 3.537 3.651 . 0 0 "[ . 1 . 2]" 1
1475 1 84 LEU H 1 84 LEU MD1 . . 4.420 4.021 3.877 4.163 . 0 0 "[ . 1 . 2]" 1
1476 1 84 LEU H 1 84 LEU MD2 . . 4.440 4.108 4.000 4.255 . 0 0 "[ . 1 . 2]" 1
1477 1 84 LEU H 1 84 LEU HG . . 3.650 3.309 3.157 3.473 . 0 0 "[ . 1 . 2]" 1
1478 1 84 LEU H 1 85 VAL H . . 4.490 4.297 4.229 4.401 . 0 0 "[ . 1 . 2]" 1
1479 1 84 LEU HA 1 84 LEU MD1 . . 3.860 3.836 3.803 3.868 0.008 9 0 "[ . 1 . 2]" 1
1480 1 84 LEU HA 1 84 LEU MD2 . . 3.080 2.145 1.968 2.330 . 0 0 "[ . 1 . 2]" 1
1481 1 84 LEU HA 1 84 LEU HG . . 4.160 2.835 2.730 2.900 . 0 0 "[ . 1 . 2]" 1
1482 1 84 LEU HA 1 85 VAL H . . 2.880 2.141 2.139 2.154 . 0 0 "[ . 1 . 2]" 1
1483 1 84 LEU HA 1 85 VAL HB . . 4.920 4.776 4.710 4.839 . 0 0 "[ . 1 . 2]" 1
1484 1 84 LEU HA 1 85 VAL MG2 . . 4.170 3.601 3.459 3.715 . 0 0 "[ . 1 . 2]" 1
1485 1 84 LEU HA 1 98 PRO HB2 . . 4.860 3.566 3.457 3.700 . 0 0 "[ . 1 . 2]" 1
1486 1 84 LEU HA 1 98 PRO HB3 . . 5.370 5.107 5.003 5.211 . 0 0 "[ . 1 . 2]" 1
1487 1 84 LEU HA 1 100 SER HA . . 3.660 2.902 2.624 3.064 . 0 0 "[ . 1 . 2]" 1
1488 1 84 LEU HA 1 101 ILE H . . 3.980 3.700 3.478 3.843 . 0 0 "[ . 1 . 2]" 1
1489 1 84 LEU HB2 1 84 LEU MD1 . . 3.420 2.239 2.100 2.363 . 0 0 "[ . 1 . 2]" 1
1490 1 84 LEU HB2 1 84 LEU MD2 . . 3.370 3.182 3.165 3.193 . 0 0 "[ . 1 . 2]" 1
1491 1 84 LEU HB2 1 85 VAL H . . 4.670 4.436 4.352 4.466 . 0 0 "[ . 1 . 2]" 1
1492 1 84 LEU HB2 1 98 PRO HB3 . . 5.500 5.470 5.309 5.506 0.006 16 0 "[ . 1 . 2]" 1
1493 1 84 LEU HB3 1 84 LEU MD1 . . 3.290 2.414 2.317 2.521 . 0 0 "[ . 1 . 2]" 1
1494 1 84 LEU HB3 1 84 LEU MD2 . . 3.320 2.249 2.141 2.355 . 0 0 "[ . 1 . 2]" 1
1495 1 84 LEU HB3 1 85 VAL H . . 4.120 3.546 3.319 3.597 . 0 0 "[ . 1 . 2]" 1
1496 1 84 LEU HB3 1 98 PRO HB2 . . 3.730 2.911 2.702 3.011 . 0 0 "[ . 1 . 2]" 1
1497 1 84 LEU HB3 1 98 PRO HB3 . . 4.380 3.779 3.640 3.821 . 0 0 "[ . 1 . 2]" 1
1498 1 84 LEU MD1 1 98 PRO QG . . 4.100 3.247 2.887 3.533 . 0 0 "[ . 1 . 2]" 1
1499 1 84 LEU MD2 1 85 VAL H . . 4.060 3.348 2.912 3.596 . 0 0 "[ . 1 . 2]" 1
1500 1 84 LEU MD2 1 98 PRO HB2 . . 3.300 2.521 2.321 2.667 . 0 0 "[ . 1 . 2]" 1
1501 1 84 LEU MD2 1 98 PRO HB3 . . 3.900 3.837 3.701 3.902 0.002 19 0 "[ . 1 . 2]" 1
1502 1 84 LEU MD2 1 98 PRO QG . . 3.430 2.230 1.958 2.455 . 0 0 "[ . 1 . 2]" 1
1503 1 84 LEU MD2 1 100 SER H . . 4.300 4.153 3.878 4.287 . 0 0 "[ . 1 . 2]" 1
1504 1 84 LEU MD2 1 100 SER HA . . 3.410 2.605 2.375 2.791 . 0 0 "[ . 1 . 2]" 1
1505 1 84 LEU MD2 1 100 SER QB . . 3.490 2.879 2.349 3.490 0.000 6 0 "[ . 1 . 2]" 1
1506 1 84 LEU MD2 1 101 ILE H . . 4.220 4.079 3.866 4.215 . 0 0 "[ . 1 . 2]" 1
1507 1 84 LEU HG 1 85 VAL H . . 5.210 4.917 4.827 4.987 . 0 0 "[ . 1 . 2]" 1
1508 1 85 VAL H 1 85 VAL HB . . 3.340 2.654 2.600 2.706 . 0 0 "[ . 1 . 2]" 1
1509 1 85 VAL H 1 85 VAL MG1 . . 4.040 3.826 3.815 3.857 . 0 0 "[ . 1 . 2]" 1
1510 1 85 VAL H 1 85 VAL MG2 . . 3.290 2.343 2.111 2.519 . 0 0 "[ . 1 . 2]" 1
1511 1 85 VAL H 1 86 SER H . . 4.480 4.360 4.271 4.440 . 0 0 "[ . 1 . 2]" 1
1512 1 85 VAL H 1 98 PRO HA . . 4.800 4.613 4.399 4.702 . 0 0 "[ . 1 . 2]" 1
1513 1 85 VAL H 1 98 PRO HB2 . . 4.460 3.017 2.834 3.213 . 0 0 "[ . 1 . 2]" 1
1514 1 85 VAL H 1 99 VAL H . . 3.670 3.154 2.761 3.451 . 0 0 "[ . 1 . 2]" 1
1515 1 85 VAL H 1 99 VAL HA . . 5.240 4.571 4.396 4.672 . 0 0 "[ . 1 . 2]" 1
1516 1 85 VAL H 1 99 VAL HB . . 4.150 3.532 3.162 3.733 . 0 0 "[ . 1 . 2]" 1
1517 1 85 VAL H 1 99 VAL MG1 . . 4.700 4.504 4.360 4.626 . 0 0 "[ . 1 . 2]" 1
1518 1 85 VAL H 1 99 VAL MG2 . . 5.100 4.447 4.002 4.662 . 0 0 "[ . 1 . 2]" 1
1519 1 85 VAL H 1 100 SER HA . . 3.980 3.649 3.334 3.878 . 0 0 "[ . 1 . 2]" 1
1520 1 85 VAL H 1 101 ILE H . . 4.940 4.401 4.229 4.699 . 0 0 "[ . 1 . 2]" 1
1521 1 85 VAL HA 1 85 VAL MG1 . . 3.350 2.269 2.142 2.385 . 0 0 "[ . 1 . 2]" 1
1522 1 85 VAL HA 1 85 VAL MG2 . . 3.460 2.433 2.354 2.518 . 0 0 "[ . 1 . 2]" 1
1523 1 85 VAL HA 1 86 SER H . . 2.830 2.143 2.140 2.146 . 0 0 "[ . 1 . 2]" 1
1524 1 85 VAL HB 1 86 SER H . . 4.520 4.224 4.113 4.267 . 0 0 "[ . 1 . 2]" 1
1525 1 85 VAL HB 1 87 ILE MD . . 4.380 3.457 3.341 3.633 . 0 0 "[ . 1 . 2]" 1
1526 1 85 VAL HB 1 87 ILE HG12 . . 5.160 3.279 3.137 3.422 . 0 0 "[ . 1 . 2]" 1
1527 1 85 VAL HB 1 99 VAL H . . 3.470 2.465 2.323 2.630 . 0 0 "[ . 1 . 2]" 1
1528 1 85 VAL HB 1 99 VAL HB . . 3.220 2.008 1.996 2.043 . 0 0 "[ . 1 . 2]" 1
1529 1 85 VAL HB 1 99 VAL MG1 . . 3.720 3.709 3.674 3.730 0.010 20 0 "[ . 1 . 2]" 1
1530 1 85 VAL HB 1 99 VAL MG2 . . 3.620 2.822 2.316 3.113 . 0 0 "[ . 1 . 2]" 1
1531 1 85 VAL MG1 1 86 SER H . . 3.290 2.763 2.422 3.011 . 0 0 "[ . 1 . 2]" 1
1532 1 85 VAL MG1 1 87 ILE HG13 . . 3.480 3.048 2.819 3.259 . 0 0 "[ . 1 . 2]" 1
1533 1 85 VAL MG1 1 98 PRO HA . . 4.790 4.729 4.649 4.789 . 0 0 "[ . 1 . 2]" 1
1534 1 85 VAL MG1 1 99 VAL H . . 3.820 3.685 3.558 3.770 . 0 0 "[ . 1 . 2]" 1
1535 1 85 VAL MG1 1 99 VAL HB . . 3.820 3.328 3.225 3.483 . 0 0 "[ . 1 . 2]" 1
1536 1 85 VAL MG2 1 99 VAL H . . 4.290 3.856 3.675 4.059 . 0 0 "[ . 1 . 2]" 1
1537 1 85 VAL MG2 1 99 VAL HB . . 3.910 2.590 2.224 2.809 . 0 0 "[ . 1 . 2]" 1
1538 1 85 VAL MG2 1 101 ILE H . . 4.680 3.930 3.640 4.153 . 0 0 "[ . 1 . 2]" 1
1539 1 85 VAL MG2 1 101 ILE HB . . 3.730 3.505 3.325 3.695 . 0 0 "[ . 1 . 2]" 1
1540 1 85 VAL MG2 1 101 ILE MD . . 3.190 1.920 1.762 2.139 . 0 0 "[ . 1 . 2]" 1
1541 1 85 VAL MG2 1 101 ILE HG13 . . 3.630 2.582 2.329 2.897 . 0 0 "[ . 1 . 2]" 1
1542 1 86 SER H 1 86 SER HB2 . . 3.270 2.747 2.615 2.854 . 0 0 "[ . 1 . 2]" 1
1543 1 86 SER H 1 86 SER HB3 . . 3.640 3.622 3.588 3.645 0.005 3 0 "[ . 1 . 2]" 1
1544 1 86 SER H 1 87 ILE H . . 4.730 4.330 4.265 4.396 . 0 0 "[ . 1 . 2]" 1
1545 1 86 SER H 1 87 ILE HG12 . . 4.610 4.509 4.171 4.625 0.015 16 0 "[ . 1 . 2]" 1
1546 1 86 SER H 1 98 PRO HA . . 5.160 4.931 4.858 5.026 . 0 0 "[ . 1 . 2]" 1
1547 1 86 SER H 1 98 PRO HB2 . . 5.230 4.578 4.396 4.902 . 0 0 "[ . 1 . 2]" 1
1548 1 86 SER HA 1 87 ILE H . . 3.360 2.154 2.141 2.169 . 0 0 "[ . 1 . 2]" 1
1549 1 86 SER HA 1 87 ILE HA . . 4.810 4.395 4.390 4.406 . 0 0 "[ . 1 . 2]" 1
1550 1 86 SER HA 1 87 ILE HB . . 5.500 4.826 4.744 4.884 . 0 0 "[ . 1 . 2]" 1
1551 1 86 SER HA 1 88 LYS QE . . 5.340 4.067 3.899 4.200 . 0 0 "[ . 1 . 2]" 1
1552 1 86 SER HA 1 93 HIS HE1 . . 4.230 3.172 2.954 3.357 . 0 0 "[ . 1 . 2]" 1
1553 1 86 SER HA 1 98 PRO HA . . 3.690 2.823 2.672 2.952 . 0 0 "[ . 1 . 2]" 1
1554 1 86 SER HA 1 98 PRO HB2 . . 5.140 3.543 3.445 3.768 . 0 0 "[ . 1 . 2]" 1
1555 1 86 SER HA 1 98 PRO HB3 . . 4.270 2.159 2.011 2.423 . 0 0 "[ . 1 . 2]" 1
1556 1 86 SER HA 1 99 VAL H . . 4.280 4.088 3.980 4.234 . 0 0 "[ . 1 . 2]" 1
1557 1 86 SER HB2 1 87 ILE H . . 4.950 4.237 4.123 4.319 . 0 0 "[ . 1 . 2]" 1
1558 1 86 SER HB2 1 88 LYS HE2 . . 4.500 4.112 3.763 4.508 0.008 13 0 "[ . 1 . 2]" 1
1559 1 86 SER HB2 1 88 LYS QE . . 3.910 3.248 3.011 3.457 . 0 0 "[ . 1 . 2]" 1
1560 1 86 SER HB2 1 88 LYS HE3 . . 4.500 3.407 3.167 3.591 . 0 0 "[ . 1 . 2]" 1
1561 1 86 SER HB2 1 88 LYS HG3 . . 4.460 4.354 4.099 4.459 . 0 0 "[ . 1 . 2]" 1
1562 1 86 SER HB2 1 93 HIS HE1 . . 4.850 4.687 4.460 4.840 . 0 0 "[ . 1 . 2]" 1
1563 1 86 SER HB3 1 87 ILE H . . 4.540 3.745 3.643 3.859 . 0 0 "[ . 1 . 2]" 1
1564 1 86 SER HB3 1 88 LYS HE2 . . 4.560 2.895 2.400 3.805 . 0 0 "[ . 1 . 2]" 1
1565 1 86 SER HB3 1 88 LYS QE . . 3.740 2.482 2.264 2.707 . 0 0 "[ . 1 . 2]" 1
1566 1 86 SER HB3 1 88 LYS HE3 . . 4.560 2.806 2.492 3.118 . 0 0 "[ . 1 . 2]" 1
1567 1 86 SER HB3 1 88 LYS HG2 . . 5.140 4.406 4.224 4.632 . 0 0 "[ . 1 . 2]" 1
1568 1 86 SER HB3 1 88 LYS HG3 . . 4.300 3.852 3.601 4.062 . 0 0 "[ . 1 . 2]" 1
1569 1 86 SER HB3 1 93 HIS HE1 . . 3.720 2.980 2.733 3.134 . 0 0 "[ . 1 . 2]" 1
1570 1 86 SER HB3 1 98 PRO HB3 . . 4.640 3.872 3.613 4.086 . 0 0 "[ . 1 . 2]" 1
1571 1 87 ILE H 1 87 ILE HB . . 3.660 2.744 2.656 2.840 . 0 0 "[ . 1 . 2]" 1
1572 1 87 ILE H 1 87 ILE MD . . 4.290 3.365 3.170 3.923 . 0 0 "[ . 1 . 2]" 1
1573 1 87 ILE H 1 87 ILE HG12 . . 4.650 2.608 2.409 2.766 . 0 0 "[ . 1 . 2]" 1
1574 1 87 ILE H 1 87 ILE HG13 . . 4.520 4.042 3.732 4.183 . 0 0 "[ . 1 . 2]" 1
1575 1 87 ILE H 1 88 LYS H . . 4.780 4.244 4.164 4.399 . 0 0 "[ . 1 . 2]" 1
1576 1 87 ILE H 1 88 LYS HG3 . . 4.560 3.874 3.782 3.969 . 0 0 "[ . 1 . 2]" 1
1577 1 87 ILE H 1 93 HIS HE1 . . 5.240 3.912 3.712 4.158 . 0 0 "[ . 1 . 2]" 1
1578 1 87 ILE H 1 94 VAL H . . 4.890 4.659 4.549 4.743 . 0 0 "[ . 1 . 2]" 1
1579 1 87 ILE H 1 94 VAL MG2 . . 4.840 4.107 3.946 4.214 . 0 0 "[ . 1 . 2]" 1
1580 1 87 ILE H 1 97 SER HB2 . . 4.150 3.390 3.160 3.619 . 0 0 "[ . 1 . 2]" 1
1581 1 87 ILE H 1 97 SER HB3 . . 4.830 3.849 3.749 3.965 . 0 0 "[ . 1 . 2]" 1
1582 1 87 ILE H 1 97 SER HG . . 3.970 2.119 1.919 2.496 . 0 0 "[ . 1 . 2]" 1
1583 1 87 ILE H 1 98 PRO HA . . 4.460 2.597 2.487 2.710 . 0 0 "[ . 1 . 2]" 1
1584 1 87 ILE HA 1 88 LYS H . . 2.820 2.142 2.138 2.149 . 0 0 "[ . 1 . 2]" 1
1585 1 87 ILE HA 1 88 LYS HG2 . . 4.890 4.731 4.672 4.834 . 0 0 "[ . 1 . 2]" 1
1586 1 87 ILE HA 1 88 LYS HG3 . . 4.230 3.424 3.298 3.493 . 0 0 "[ . 1 . 2]" 1
1587 1 87 ILE HB 1 87 ILE MD . . 3.540 3.213 3.176 3.227 . 0 0 "[ . 1 . 2]" 1
1588 1 87 ILE HB 1 88 LYS H . . 4.350 4.214 4.092 4.304 . 0 0 "[ . 1 . 2]" 1
1589 1 87 ILE HB 1 94 VAL H . . 4.420 4.012 3.930 4.118 . 0 0 "[ . 1 . 2]" 1
1590 1 87 ILE HB 1 94 VAL HB . . 5.500 5.242 5.056 5.453 . 0 0 "[ . 1 . 2]" 1
1591 1 87 ILE HB 1 94 VAL MG2 . . 3.080 2.371 2.242 2.516 . 0 0 "[ . 1 . 2]" 1
1592 1 87 ILE HB 1 97 SER H . . 5.500 5.342 5.204 5.484 . 0 0 "[ . 1 . 2]" 1
1593 1 87 ILE HB 1 97 SER HB2 . . 3.650 2.111 1.998 2.269 . 0 0 "[ . 1 . 2]" 1
1594 1 87 ILE HB 1 97 SER HB3 . . 5.020 3.400 3.264 3.522 . 0 0 "[ . 1 . 2]" 1
1595 1 87 ILE MD 1 88 LYS H . . 4.730 3.811 3.621 4.084 . 0 0 "[ . 1 . 2]" 1
1596 1 87 ILE MD 1 97 SER HA . . 5.500 5.492 5.433 5.515 0.015 16 0 "[ . 1 . 2]" 1
1597 1 87 ILE MD 1 97 SER HB2 . . 5.080 4.757 4.619 4.910 . 0 0 "[ . 1 . 2]" 1
1598 1 87 ILE MD 1 99 VAL H . . 4.660 4.263 4.111 4.444 . 0 0 "[ . 1 . 2]" 1
1599 1 87 ILE MD 1 99 VAL HB . . 4.910 4.482 4.244 4.682 . 0 0 "[ . 1 . 2]" 1
1600 1 87 ILE MD 1 99 VAL MG2 . . 3.840 3.353 2.978 3.762 . 0 0 "[ . 1 . 2]" 1
1601 1 87 ILE HG12 1 87 ILE MG . . 3.380 3.186 3.155 3.201 . 0 0 "[ . 1 . 2]" 1
1602 1 87 ILE HG12 1 99 VAL HB . . 5.500 4.122 3.657 4.418 . 0 0 "[ . 1 . 2]" 1
1603 1 87 ILE HG13 1 87 ILE MG . . 3.360 2.316 2.202 2.565 . 0 0 "[ . 1 . 2]" 1
1604 1 87 ILE HG13 1 98 PRO HA . . 5.500 4.855 4.171 5.185 . 0 0 "[ . 1 . 2]" 1
1605 1 87 ILE MG 1 88 LYS H . . 3.700 2.838 2.674 3.005 . 0 0 "[ . 1 . 2]" 1
1606 1 87 ILE MG 1 88 LYS HA . . 4.780 3.729 3.489 3.933 . 0 0 "[ . 1 . 2]" 1
1607 1 87 ILE MG 1 94 VAL H . . 4.280 4.053 3.866 4.272 . 0 0 "[ . 1 . 2]" 1
1608 1 87 ILE MG 1 94 VAL HB . . 4.590 4.198 4.016 4.357 . 0 0 "[ . 1 . 2]" 1
1609 1 87 ILE MG 1 94 VAL MG2 . . 2.980 1.955 1.840 2.131 . 0 0 "[ . 1 . 2]" 1
1610 1 87 ILE MG 1 97 SER HB2 . . 4.810 3.568 3.411 3.804 . 0 0 "[ . 1 . 2]" 1
1611 1 88 LYS H 1 88 LYS HB2 . . 3.520 3.014 2.957 3.076 . 0 0 "[ . 1 . 2]" 1
1612 1 88 LYS H 1 88 LYS HB3 . . 3.970 3.877 3.845 3.926 . 0 0 "[ . 1 . 2]" 1
1613 1 88 LYS H 1 88 LYS HD2 . . 4.260 4.207 4.100 4.265 0.005 13 0 "[ . 1 . 2]" 1
1614 1 88 LYS H 1 88 LYS HD3 . . 5.500 5.093 5.003 5.177 . 0 0 "[ . 1 . 2]" 1
1615 1 88 LYS H 1 88 LYS HG2 . . 4.240 3.743 3.666 3.889 . 0 0 "[ . 1 . 2]" 1
1616 1 88 LYS H 1 88 LYS HG3 . . 3.190 2.439 2.364 2.558 . 0 0 "[ . 1 . 2]" 1
1617 1 88 LYS H 1 89 LYS H . . 4.510 4.433 4.408 4.450 . 0 0 "[ . 1 . 2]" 1
1618 1 88 LYS H 1 93 HIS HA . . 4.690 4.357 4.286 4.456 . 0 0 "[ . 1 . 2]" 1
1619 1 88 LYS H 1 94 VAL H . . 4.990 4.653 4.518 4.793 . 0 0 "[ . 1 . 2]" 1
1620 1 88 LYS HA 1 88 LYS HD2 . . 4.900 4.739 4.709 4.773 . 0 0 "[ . 1 . 2]" 1
1621 1 88 LYS HA 1 88 LYS HD3 . . 4.690 4.645 4.594 4.675 . 0 0 "[ . 1 . 2]" 1
1622 1 88 LYS HA 1 88 LYS HG2 . . 3.960 2.982 2.933 3.003 . 0 0 "[ . 1 . 2]" 1
1623 1 88 LYS HA 1 88 LYS HG3 . . 4.160 3.250 3.179 3.284 . 0 0 "[ . 1 . 2]" 1
1624 1 88 LYS HA 1 89 LYS H . . 2.710 2.502 2.483 2.560 . 0 0 "[ . 1 . 2]" 1
1625 1 88 LYS HA 1 89 LYS HB3 . . 5.150 4.640 4.477 4.793 . 0 0 "[ . 1 . 2]" 1
1626 1 88 LYS HA 1 92 ASN H . . 4.590 4.379 4.306 4.491 . 0 0 "[ . 1 . 2]" 1
1627 1 88 LYS HA 1 93 HIS HA . . 3.900 2.055 2.009 2.126 . 0 0 "[ . 1 . 2]" 1
1628 1 88 LYS HA 1 94 VAL H . . 3.400 2.372 2.166 2.583 . 0 0 "[ . 1 . 2]" 1
1629 1 88 LYS HA 1 94 VAL HA . . 5.030 4.258 4.084 4.408 . 0 0 "[ . 1 . 2]" 1
1630 1 88 LYS HA 1 94 VAL MG1 . . 3.790 2.324 2.064 2.566 . 0 0 "[ . 1 . 2]" 1
1631 1 88 LYS HA 1 94 VAL MG2 . . 4.220 2.990 2.810 3.121 . 0 0 "[ . 1 . 2]" 1
1632 1 88 LYS HA 1 97 SER HB3 . . 5.480 4.728 4.518 4.914 . 0 0 "[ . 1 . 2]" 1
1633 1 88 LYS HB2 1 88 LYS HD3 . . 4.150 2.970 2.893 3.022 . 0 0 "[ . 1 . 2]" 1
1634 1 88 LYS HB2 1 89 LYS H . . 3.460 3.014 2.943 3.064 . 0 0 "[ . 1 . 2]" 1
1635 1 88 LYS HB2 1 91 GLY H . . 4.550 3.108 3.034 3.260 . 0 0 "[ . 1 . 2]" 1
1636 1 88 LYS HB2 1 91 GLY HA2 . . 4.490 3.513 3.437 3.646 . 0 0 "[ . 1 . 2]" 1
1637 1 88 LYS HB2 1 91 GLY HA3 . . 5.300 5.023 4.936 5.143 . 0 0 "[ . 1 . 2]" 1
1638 1 88 LYS HB2 1 92 ASN H . . 3.410 3.274 3.175 3.365 . 0 0 "[ . 1 . 2]" 1
1639 1 88 LYS HB2 1 92 ASN HA . . 5.150 4.935 4.845 5.039 . 0 0 "[ . 1 . 2]" 1
1640 1 88 LYS HB2 1 93 HIS HA . . 4.340 3.686 3.581 3.776 . 0 0 "[ . 1 . 2]" 1
1641 1 88 LYS HB3 1 88 LYS HD2 . . 3.980 3.148 3.094 3.217 . 0 0 "[ . 1 . 2]" 1
1642 1 88 LYS HB3 1 88 LYS HD3 . . 3.780 2.739 2.678 2.779 . 0 0 "[ . 1 . 2]" 1
1643 1 88 LYS HB3 1 88 LYS HE2 . . 4.850 4.487 4.351 4.870 0.020 16 0 "[ . 1 . 2]" 1
1644 1 88 LYS HB3 1 88 LYS HE3 . . 4.850 4.758 4.426 4.851 0.001 15 0 "[ . 1 . 2]" 1
1645 1 88 LYS HB3 1 89 LYS H . . 4.400 2.457 2.333 2.497 . 0 0 "[ . 1 . 2]" 1
1646 1 88 LYS HB3 1 91 GLY H . . 4.610 3.873 3.759 4.079 . 0 0 "[ . 1 . 2]" 1
1647 1 88 LYS HB3 1 91 GLY HA2 . . 4.890 4.017 3.930 4.159 . 0 0 "[ . 1 . 2]" 1
1648 1 88 LYS HB3 1 91 GLY HA3 . . 5.500 5.267 5.192 5.410 . 0 0 "[ . 1 . 2]" 1
1649 1 88 LYS HB3 1 92 ASN H . . 3.850 2.875 2.822 2.991 . 0 0 "[ . 1 . 2]" 1
1650 1 88 LYS HB3 1 93 HIS HA . . 4.990 2.256 2.119 2.343 . 0 0 "[ . 1 . 2]" 1
1651 1 88 LYS HB3 1 94 VAL H . . 4.560 4.080 3.906 4.267 . 0 0 "[ . 1 . 2]" 1
1652 1 88 LYS HD2 1 91 GLY H . . 5.500 4.387 4.295 4.480 . 0 0 "[ . 1 . 2]" 1
1653 1 88 LYS HD2 1 91 GLY HA2 . . 4.340 3.470 3.329 3.634 . 0 0 "[ . 1 . 2]" 1
1654 1 88 LYS HD2 1 91 GLY HA3 . . 5.430 5.213 5.065 5.386 . 0 0 "[ . 1 . 2]" 1
1655 1 88 LYS HD2 1 93 HIS HA . . 5.220 4.648 4.507 4.779 . 0 0 "[ . 1 . 2]" 1
1656 1 88 LYS HD3 1 91 GLY H . . 5.280 4.972 4.823 5.183 . 0 0 "[ . 1 . 2]" 1
1657 1 88 LYS HD3 1 91 GLY HA2 . . 4.730 3.725 3.578 3.933 . 0 0 "[ . 1 . 2]" 1
1658 1 88 LYS HD3 1 91 GLY HA3 . . 5.490 5.240 5.122 5.414 . 0 0 "[ . 1 . 2]" 1
1659 1 88 LYS HD3 1 92 ASN H . . 4.700 4.601 4.480 4.690 . 0 0 "[ . 1 . 2]" 1
1660 1 88 LYS HD3 1 93 HIS HA . . 5.240 3.827 3.668 3.928 . 0 0 "[ . 1 . 2]" 1
1661 1 88 LYS QE 1 88 LYS HG2 . . 3.480 2.428 2.354 2.486 . 0 0 "[ . 1 . 2]" 1
1662 1 88 LYS QE 1 93 HIS HA . . 4.590 4.264 4.189 4.342 . 0 0 "[ . 1 . 2]" 1
1663 1 88 LYS HE2 1 88 LYS HG2 . . 3.990 2.646 2.403 3.581 . 0 0 "[ . 1 . 2]" 1
1664 1 88 LYS HE2 1 88 LYS HG3 . . 3.780 2.842 2.575 3.698 . 0 0 "[ . 1 . 2]" 1
1665 1 88 LYS HE2 1 93 HIS HE1 . . 4.600 3.089 2.725 4.526 . 0 0 "[ . 1 . 2]" 1
1666 1 88 LYS HE3 1 88 LYS HG2 . . 3.990 3.270 2.468 3.504 . 0 0 "[ . 1 . 2]" 1
1667 1 88 LYS HE3 1 88 LYS HG3 . . 3.780 2.651 2.498 2.740 . 0 0 "[ . 1 . 2]" 1
1668 1 88 LYS HE3 1 93 HIS HE1 . . 4.600 4.154 2.961 4.493 . 0 0 "[ . 1 . 2]" 1
1669 1 88 LYS HG2 1 89 LYS H . . 4.710 4.550 4.456 4.584 . 0 0 "[ . 1 . 2]" 1
1670 1 88 LYS HG2 1 92 ASN H . . 5.300 5.172 5.091 5.287 . 0 0 "[ . 1 . 2]" 1
1671 1 88 LYS HG2 1 93 HIS HA . . 3.880 2.060 1.999 2.149 . 0 0 "[ . 1 . 2]" 1
1672 1 88 LYS HG2 1 94 VAL H . . 4.040 3.834 3.713 3.942 . 0 0 "[ . 1 . 2]" 1
1673 1 88 LYS HG3 1 89 LYS H . . 4.850 4.838 4.774 4.855 0.005 18 0 "[ . 1 . 2]" 1
1674 1 88 LYS HG3 1 93 HIS HA . . 4.220 3.394 3.326 3.509 . 0 0 "[ . 1 . 2]" 1
1675 1 88 LYS HG3 1 93 HIS HE1 . . 4.870 4.439 4.273 4.697 . 0 0 "[ . 1 . 2]" 1
1676 1 89 LYS H 1 89 LYS HB2 . . 3.360 3.097 2.974 3.259 . 0 0 "[ . 1 . 2]" 1
1677 1 89 LYS H 1 89 LYS HB3 . . 3.330 2.695 2.592 2.799 . 0 0 "[ . 1 . 2]" 1
1678 1 89 LYS H 1 89 LYS HG2 . . 4.580 4.454 4.325 4.556 . 0 0 "[ . 1 . 2]" 1
1679 1 89 LYS H 1 89 LYS HG3 . . 4.980 4.743 4.699 4.828 . 0 0 "[ . 1 . 2]" 1
1680 1 89 LYS H 1 91 GLY H . . 3.980 3.564 3.480 3.660 . 0 0 "[ . 1 . 2]" 1
1681 1 89 LYS H 1 92 ASN H . . 3.140 2.354 2.282 2.428 . 0 0 "[ . 1 . 2]" 1
1682 1 89 LYS H 1 92 ASN HB2 . . 4.420 3.360 3.247 3.532 . 0 0 "[ . 1 . 2]" 1
1683 1 89 LYS H 1 92 ASN HB3 . . 4.650 4.191 4.028 4.354 . 0 0 "[ . 1 . 2]" 1
1684 1 89 LYS H 1 93 HIS HA . . 3.980 3.621 3.564 3.666 . 0 0 "[ . 1 . 2]" 1
1685 1 89 LYS H 1 94 VAL H . . 4.660 4.372 4.110 4.600 . 0 0 "[ . 1 . 2]" 1
1686 1 89 LYS H 1 94 VAL MG1 . . 3.710 2.793 2.639 2.913 . 0 0 "[ . 1 . 2]" 1
1687 1 89 LYS HA 1 89 LYS QD . . 4.450 4.171 4.009 4.248 . 0 0 "[ . 1 . 2]" 1
1688 1 89 LYS HA 1 89 LYS HG2 . . 4.150 3.028 2.773 3.263 . 0 0 "[ . 1 . 2]" 1
1689 1 89 LYS HA 1 89 LYS HG3 . . 3.910 2.624 2.503 2.747 . 0 0 "[ . 1 . 2]" 1
1690 1 89 LYS HA 1 90 ASN QD . . 4.390 3.825 3.099 4.349 . 0 0 "[ . 1 . 2]" 1
1691 1 89 LYS HA 1 92 ASN H . . 4.620 4.107 4.046 4.142 . 0 0 "[ . 1 . 2]" 1
1692 1 89 LYS HA 1 94 VAL MG1 . . 4.660 3.633 3.460 3.750 . 0 0 "[ . 1 . 2]" 1
1693 1 89 LYS HB2 1 89 LYS QD . . 3.250 2.679 2.299 2.947 . 0 0 "[ . 1 . 2]" 1
1694 1 89 LYS HB2 1 89 LYS QE . . 4.480 2.687 2.051 3.723 . 0 0 "[ . 1 . 2]" 1
1695 1 89 LYS HB2 1 94 VAL MG1 . . 3.240 2.215 1.979 2.377 . 0 0 "[ . 1 . 2]" 1
1696 1 89 LYS HB3 1 89 LYS QD . . 3.550 2.293 2.141 2.464 . 0 0 "[ . 1 . 2]" 1
1697 1 89 LYS HB3 1 89 LYS QE . . 4.470 3.450 2.956 4.072 . 0 0 "[ . 1 . 2]" 1
1698 1 89 LYS HB3 1 92 ASN H . . 4.580 3.966 3.858 4.096 . 0 0 "[ . 1 . 2]" 1
1699 1 89 LYS HB3 1 94 VAL MG1 . . 3.360 2.856 2.660 3.093 . 0 0 "[ . 1 . 2]" 1
1700 1 89 LYS QD 1 90 ASN HD21 . . 5.060 3.634 3.079 5.046 . 0 0 "[ . 1 . 2]" 1
1701 1 89 LYS QD 1 90 ASN QD . . 4.410 3.436 2.805 3.915 . 0 0 "[ . 1 . 2]" 1
1702 1 89 LYS QD 1 90 ASN HD22 . . 5.060 4.424 3.230 4.955 . 0 0 "[ . 1 . 2]" 1
1703 1 89 LYS QD 1 94 VAL MG1 . . 3.940 3.555 3.132 3.930 . 0 0 "[ . 1 . 2]" 1
1704 1 89 LYS QE 1 89 LYS HG2 . . 3.390 3.158 2.563 3.313 . 0 0 "[ . 1 . 2]" 1
1705 1 89 LYS QE 1 89 LYS HG3 . . 3.320 2.173 2.067 2.366 . 0 0 "[ . 1 . 2]" 1
1706 1 89 LYS QE 1 94 VAL MG1 . . 4.700 3.225 2.447 4.620 . 0 0 "[ . 1 . 2]" 1
1707 1 89 LYS HG2 1 90 ASN HB2 . . 4.750 2.965 2.635 3.415 . 0 0 "[ . 1 . 2]" 1
1708 1 89 LYS HG2 1 90 ASN QB . . 4.100 2.927 2.615 3.316 . 0 0 "[ . 1 . 2]" 1
1709 1 89 LYS HG2 1 90 ASN HB3 . . 4.750 4.583 4.394 4.739 . 0 0 "[ . 1 . 2]" 1
1710 1 89 LYS HG2 1 90 ASN HD21 . . 4.610 2.231 1.984 3.503 . 0 0 "[ . 1 . 2]" 1
1711 1 89 LYS HG2 1 90 ASN QD . . 4.040 2.174 1.934 2.830 . 0 0 "[ . 1 . 2]" 1
1712 1 89 LYS HG2 1 90 ASN HD22 . . 4.610 3.461 2.586 4.232 . 0 0 "[ . 1 . 2]" 1
1713 1 89 LYS HG3 1 90 ASN QB . . 4.690 4.362 3.792 4.689 . 0 0 "[ . 1 . 2]" 1
1714 1 89 LYS HG3 1 90 ASN HD21 . . 4.980 3.231 2.430 3.829 . 0 0 "[ . 1 . 2]" 1
1715 1 89 LYS HG3 1 90 ASN QD . . 4.290 3.051 2.400 3.469 . 0 0 "[ . 1 . 2]" 1
1716 1 89 LYS HG3 1 90 ASN HD22 . . 4.980 4.032 3.078 4.687 . 0 0 "[ . 1 . 2]" 1
1717 1 90 ASN HA 1 90 ASN QD . . 4.490 3.361 2.040 4.000 . 0 0 "[ . 1 . 2]" 1
1718 1 90 ASN HA 1 90 ASN HD22 . . 5.300 4.131 3.634 4.665 . 0 0 "[ . 1 . 2]" 1
1719 1 90 ASN HA 1 92 ASN H . . 4.640 4.582 4.548 4.607 . 0 0 "[ . 1 . 2]" 1
1720 1 90 ASN QB 1 90 ASN QD . . 2.990 2.228 2.063 2.718 . 0 0 "[ . 1 . 2]" 1
1721 1 90 ASN QB 1 91 GLY H . . 4.480 3.761 3.737 3.784 . 0 0 "[ . 1 . 2]" 1
1722 1 90 ASN QB 1 92 ASN H . . 4.890 3.966 3.872 4.012 . 0 0 "[ . 1 . 2]" 1
1723 1 90 ASN QB 1 92 ASN QD . . 3.600 3.134 2.752 3.527 . 0 0 "[ . 1 . 2]" 1
1724 1 90 ASN HB2 1 91 GLY H . . 5.090 4.103 4.047 4.184 . 0 0 "[ . 1 . 2]" 1
1725 1 90 ASN HB3 1 91 GLY H . . 5.090 4.373 4.307 4.548 . 0 0 "[ . 1 . 2]" 1
1726 1 91 GLY H 1 92 ASN H . . 3.440 2.238 2.206 2.313 . 0 0 "[ . 1 . 2]" 1
1727 1 91 GLY HA2 1 92 ASN H . . 3.560 3.102 3.086 3.118 . 0 0 "[ . 1 . 2]" 1
1728 1 91 GLY HA3 1 92 ASN H . . 3.530 3.418 3.406 3.428 . 0 0 "[ . 1 . 2]" 1
1729 1 92 ASN H 1 92 ASN HB2 . . 2.920 2.616 2.555 2.678 . 0 0 "[ . 1 . 2]" 1
1730 1 92 ASN H 1 92 ASN HB3 . . 3.810 3.744 3.652 3.803 . 0 0 "[ . 1 . 2]" 1
1731 1 92 ASN H 1 92 ASN QD . . 4.720 3.222 2.500 3.925 . 0 0 "[ . 1 . 2]" 1
1732 1 92 ASN H 1 93 HIS HA . . 4.760 4.745 4.713 4.764 0.004 11 0 "[ . 1 . 2]" 1
1733 1 92 ASN HA 1 92 ASN QD . . 4.400 3.590 3.112 3.947 . 0 0 "[ . 1 . 2]" 1
1734 1 92 ASN HA 1 92 ASN HD22 . . 5.020 4.278 3.936 4.547 . 0 0 "[ . 1 . 2]" 1
1735 1 92 ASN HA 1 93 HIS HA . . 5.080 4.459 4.444 4.475 . 0 0 "[ . 1 . 2]" 1
1736 1 92 ASN HB2 1 92 ASN HD21 . . 3.630 2.223 2.117 2.450 . 0 0 "[ . 1 . 2]" 1
1737 1 92 ASN HB2 1 92 ASN QD . . 3.070 2.198 2.098 2.409 . 0 0 "[ . 1 . 2]" 1
1738 1 92 ASN HB2 1 92 ASN HD22 . . 3.630 3.476 3.435 3.568 . 0 0 "[ . 1 . 2]" 1
1739 1 92 ASN HB2 1 93 HIS H . . 5.160 4.510 4.440 4.574 . 0 0 "[ . 1 . 2]" 1
1740 1 92 ASN HB3 1 93 HIS H . . 4.750 3.835 3.768 3.898 . 0 0 "[ . 1 . 2]" 1
1741 1 93 HIS H 1 93 HIS HD2 . . 4.790 2.773 2.613 2.895 . 0 0 "[ . 1 . 2]" 1
1742 1 93 HIS HA 1 93 HIS HD2 . . 4.930 3.861 3.618 3.964 . 0 0 "[ . 1 . 2]" 1
1743 1 93 HIS HA 1 93 HIS HE1 . . 5.060 4.911 4.848 5.038 . 0 0 "[ . 1 . 2]" 1
1744 1 93 HIS HA 1 94 VAL H . . 3.380 2.235 2.193 2.287 . 0 0 "[ . 1 . 2]" 1
1745 1 93 HIS HA 1 94 VAL MG1 . . 4.730 3.618 3.511 3.783 . 0 0 "[ . 1 . 2]" 1
1746 1 93 HIS HA 1 94 VAL MG2 . . 4.970 3.906 3.795 4.018 . 0 0 "[ . 1 . 2]" 1
1747 1 93 HIS HA 1 97 SER HG . . 5.330 3.748 3.380 4.359 . 0 0 "[ . 1 . 2]" 1
1748 1 93 HIS HB2 1 93 HIS HD2 . . 3.800 2.821 2.782 2.912 . 0 0 "[ . 1 . 2]" 1
1749 1 93 HIS HB2 1 94 VAL H . . 4.450 4.187 4.090 4.275 . 0 0 "[ . 1 . 2]" 1
1750 1 93 HIS HB2 1 97 SER HB3 . . 5.500 5.303 5.129 5.454 . 0 0 "[ . 1 . 2]" 1
1751 1 93 HIS HB2 1 97 SER HG . . 5.500 5.249 5.075 5.450 . 0 0 "[ . 1 . 2]" 1
1752 1 93 HIS HB3 1 94 VAL H . . 3.660 2.987 2.821 3.145 . 0 0 "[ . 1 . 2]" 1
1753 1 93 HIS HB3 1 94 VAL MG1 . . 5.410 4.921 4.830 5.049 . 0 0 "[ . 1 . 2]" 1
1754 1 93 HIS HB3 1 94 VAL MG2 . . 5.500 4.534 4.312 4.635 . 0 0 "[ . 1 . 2]" 1
1755 1 93 HIS HB3 1 97 SER HB3 . . 4.250 3.579 3.413 3.726 . 0 0 "[ . 1 . 2]" 1
1756 1 93 HIS HB3 1 97 SER HG . . 4.830 3.835 3.685 3.998 . 0 0 "[ . 1 . 2]" 1
1757 1 93 HIS HE1 1 97 SER HG . . 4.660 3.543 3.192 3.831 . 0 0 "[ . 1 . 2]" 1
1758 1 93 HIS HE1 1 98 PRO HA . . 4.650 4.278 4.153 4.443 . 0 0 "[ . 1 . 2]" 1
1759 1 93 HIS HE1 1 98 PRO HB2 . . 5.120 5.060 4.957 5.122 0.002 20 0 "[ . 1 . 2]" 1
1760 1 93 HIS HE1 1 98 PRO HB3 . . 3.800 3.340 3.222 3.406 . 0 0 "[ . 1 . 2]" 1
1761 1 93 HIS HE1 1 98 PRO HD2 . . 4.890 4.726 4.519 4.881 . 0 0 "[ . 1 . 2]" 1
1762 1 93 HIS HE1 1 98 PRO QD . . 4.200 2.929 2.722 3.082 . 0 0 "[ . 1 . 2]" 1
1763 1 93 HIS HE1 1 98 PRO HD3 . . 4.890 2.958 2.745 3.116 . 0 0 "[ . 1 . 2]" 1
1764 1 94 VAL H 1 94 VAL HB . . 4.000 3.728 3.683 3.773 . 0 0 "[ . 1 . 2]" 1
1765 1 94 VAL H 1 94 VAL MG1 . . 3.070 2.710 2.575 2.833 . 0 0 "[ . 1 . 2]" 1
1766 1 94 VAL H 1 94 VAL MG2 . . 3.170 2.221 2.012 2.297 . 0 0 "[ . 1 . 2]" 1
1767 1 94 VAL H 1 95 ALA H . . 4.520 4.462 4.434 4.500 . 0 0 "[ . 1 . 2]" 1
1768 1 94 VAL H 1 97 SER H . . 5.260 4.995 4.944 5.074 . 0 0 "[ . 1 . 2]" 1
1769 1 94 VAL H 1 97 SER HB2 . . 3.800 3.634 3.515 3.760 . 0 0 "[ . 1 . 2]" 1
1770 1 94 VAL H 1 97 SER HB3 . . 2.680 2.670 2.605 2.686 0.006 12 0 "[ . 1 . 2]" 1
1771 1 94 VAL H 1 97 SER HG . . 4.490 3.187 2.760 3.883 . 0 0 "[ . 1 . 2]" 1
1772 1 94 VAL HA 1 94 VAL MG1 . . 3.030 2.301 2.220 2.352 . 0 0 "[ . 1 . 2]" 1
1773 1 94 VAL HA 1 95 ALA H . . 2.950 2.591 2.519 2.634 . 0 0 "[ . 1 . 2]" 1
1774 1 94 VAL HA 1 95 ALA HA . . 4.780 4.316 4.306 4.324 . 0 0 "[ . 1 . 2]" 1
1775 1 94 VAL HA 1 95 ALA MB . . 4.370 4.221 4.166 4.261 . 0 0 "[ . 1 . 2]" 1
1776 1 94 VAL HB 1 95 ALA H . . 2.960 2.043 1.951 2.156 . 0 0 "[ . 1 . 2]" 1
1777 1 94 VAL HB 1 95 ALA HA . . 4.880 4.651 4.557 4.705 . 0 0 "[ . 1 . 2]" 1
1778 1 94 VAL HB 1 95 ALA MB . . 4.140 3.710 3.609 3.789 . 0 0 "[ . 1 . 2]" 1
1779 1 94 VAL MG1 1 95 ALA H . . 3.860 3.605 3.495 3.660 . 0 0 "[ . 1 . 2]" 1
1780 1 94 VAL MG2 1 95 ALA H . . 3.250 3.011 2.840 3.222 . 0 0 "[ . 1 . 2]" 1
1781 1 94 VAL MG2 1 96 ASN H . . 5.040 4.862 4.710 5.010 . 0 0 "[ . 1 . 2]" 1
1782 1 94 VAL MG2 1 97 SER H . . 4.020 3.824 3.679 3.944 . 0 0 "[ . 1 . 2]" 1
1783 1 94 VAL MG2 1 97 SER HB2 . . 3.470 2.239 2.108 2.527 . 0 0 "[ . 1 . 2]" 1
1784 1 94 VAL MG2 1 97 SER HB3 . . 3.330 2.433 2.009 2.674 . 0 0 "[ . 1 . 2]" 1
1785 1 95 ALA H 1 95 ALA MB . . 2.910 2.188 2.056 2.247 . 0 0 "[ . 1 . 2]" 1
1786 1 95 ALA HA 1 96 ASN H . . 2.730 2.243 2.202 2.285 . 0 0 "[ . 1 . 2]" 1
1787 1 95 ALA HA 1 96 ASN HA . . 4.620 4.432 4.413 4.446 . 0 0 "[ . 1 . 2]" 1
1788 1 95 ALA HA 1 97 SER H . . 3.730 3.391 3.325 3.484 . 0 0 "[ . 1 . 2]" 1
1789 1 95 ALA HA 1 97 SER HB3 . . 5.260 4.600 4.523 4.701 . 0 0 "[ . 1 . 2]" 1
1790 1 95 ALA MB 1 96 ASN H . . 3.110 2.772 2.643 2.891 . 0 0 "[ . 1 . 2]" 1
1791 1 95 ALA MB 1 96 ASN HD21 . . 4.530 2.687 1.947 4.189 . 0 0 "[ . 1 . 2]" 1
1792 1 95 ALA MB 1 96 ASN QD . . 3.980 2.450 1.905 3.486 . 0 0 "[ . 1 . 2]" 1
1793 1 95 ALA MB 1 96 ASN HD22 . . 4.530 2.901 2.479 3.850 . 0 0 "[ . 1 . 2]" 1
1794 1 95 ALA MB 1 97 SER H . . 4.570 4.437 4.363 4.515 . 0 0 "[ . 1 . 2]" 1
1795 1 96 ASN H 1 96 ASN HA . . 2.810 2.276 2.274 2.280 . 0 0 "[ . 1 . 2]" 1
1796 1 96 ASN H 1 96 ASN HB2 . . 4.020 3.640 3.549 3.733 . 0 0 "[ . 1 . 2]" 1
1797 1 96 ASN H 1 96 ASN HD21 . . 5.320 3.886 2.903 5.112 . 0 0 "[ . 1 . 2]" 1
1798 1 96 ASN H 1 96 ASN QD . . 4.530 3.603 2.817 4.515 . 0 0 "[ . 1 . 2]" 1
1799 1 96 ASN H 1 96 ASN HD22 . . 5.320 4.307 3.806 5.027 . 0 0 "[ . 1 . 2]" 1
1800 1 96 ASN H 1 97 SER H . . 3.220 2.597 2.511 2.720 . 0 0 "[ . 1 . 2]" 1
1801 1 96 ASN HA 1 96 ASN HD21 . . 4.800 4.145 3.645 4.508 . 0 0 "[ . 1 . 2]" 1
1802 1 96 ASN HA 1 96 ASN HD22 . . 4.800 4.563 4.237 4.791 . 0 0 "[ . 1 . 2]" 1
1803 1 96 ASN HA 1 97 SER H . . 3.420 2.938 2.858 2.985 . 0 0 "[ . 1 . 2]" 1
1804 1 96 ASN HB2 1 96 ASN QD . . 3.230 2.182 2.097 2.323 . 0 0 "[ . 1 . 2]" 1
1805 1 96 ASN HB2 1 96 ASN HD22 . . 3.760 3.469 3.434 3.529 . 0 0 "[ . 1 . 2]" 1
1806 1 96 ASN HB2 1 97 SER H . . 4.220 4.073 4.015 4.157 . 0 0 "[ . 1 . 2]" 1
1807 1 96 ASN HB2 1 97 SER HB2 . . 4.860 4.609 4.492 4.715 . 0 0 "[ . 1 . 2]" 1
1808 1 96 ASN HB2 1 99 VAL MG2 . . 4.560 3.796 3.378 4.185 . 0 0 "[ . 1 . 2]" 1
1809 1 96 ASN HB3 1 99 VAL MG2 . . 4.510 3.724 3.389 4.351 . 0 0 "[ . 1 . 2]" 1
1810 1 97 SER H 1 97 SER HB2 . . 3.450 3.243 3.129 3.341 . 0 0 "[ . 1 . 2]" 1
1811 1 97 SER H 1 97 SER HB3 . . 3.560 2.679 2.583 2.786 . 0 0 "[ . 1 . 2]" 1
1812 1 97 SER H 1 97 SER HG . . 4.640 4.473 4.122 4.624 . 0 0 "[ . 1 . 2]" 1
1813 1 97 SER H 1 98 PRO HA . . 5.020 4.795 4.787 4.801 . 0 0 "[ . 1 . 2]" 1
1814 1 97 SER HA 1 99 VAL MG2 . . 4.630 2.646 2.414 2.967 . 0 0 "[ . 1 . 2]" 1
1815 1 97 SER HB2 1 98 PRO HA . . 4.340 3.393 3.183 3.587 . 0 0 "[ . 1 . 2]" 1
1816 1 97 SER HB2 1 99 VAL H . . 4.780 4.300 3.893 4.672 . 0 0 "[ . 1 . 2]" 1
1817 1 97 SER HB3 1 98 PRO HA . . 5.240 3.815 3.772 3.830 . 0 0 "[ . 1 . 2]" 1
1818 1 97 SER HG 1 98 PRO HA . . 4.560 2.841 2.220 3.113 . 0 0 "[ . 1 . 2]" 1
1819 1 98 PRO HA 1 99 VAL H . . 2.920 2.268 2.208 2.331 . 0 0 "[ . 1 . 2]" 1
1820 1 98 PRO HA 1 99 VAL HA . . 4.820 4.351 4.341 4.358 . 0 0 "[ . 1 . 2]" 1
1821 1 98 PRO HA 1 99 VAL HB . . 4.980 4.877 4.781 4.975 . 0 0 "[ . 1 . 2]" 1
1822 1 98 PRO HA 1 99 VAL MG2 . . 4.110 3.347 3.272 3.453 . 0 0 "[ . 1 . 2]" 1
1823 1 98 PRO HB2 1 99 VAL H . . 3.620 2.991 2.800 3.209 . 0 0 "[ . 1 . 2]" 1
1824 1 98 PRO HB3 1 99 VAL H . . 3.940 3.662 3.553 3.792 . 0 0 "[ . 1 . 2]" 1
1825 1 99 VAL H 1 99 VAL HB . . 3.330 2.636 2.569 2.754 . 0 0 "[ . 1 . 2]" 1
1826 1 99 VAL H 1 99 VAL MG1 . . 4.220 3.791 3.764 3.807 . 0 0 "[ . 1 . 2]" 1
1827 1 99 VAL H 1 99 VAL MG2 . . 3.350 2.112 1.977 2.276 . 0 0 "[ . 1 . 2]" 1
1828 1 99 VAL H 1 100 SER H . . 4.690 4.488 4.433 4.561 . 0 0 "[ . 1 . 2]" 1
1829 1 99 VAL HA 1 99 VAL MG1 . . 3.260 2.274 2.152 2.400 . 0 0 "[ . 1 . 2]" 1
1830 1 99 VAL HA 1 99 VAL MG2 . . 3.190 2.498 2.439 2.540 . 0 0 "[ . 1 . 2]" 1
1831 1 99 VAL HA 1 100 SER H . . 2.580 2.151 2.139 2.193 . 0 0 "[ . 1 . 2]" 1
1832 1 99 VAL HA 1 100 SER HA . . 4.570 4.380 4.368 4.395 . 0 0 "[ . 1 . 2]" 1
1833 1 99 VAL HA 1 100 SER QB . . 4.350 4.251 4.052 4.349 . 0 0 "[ . 1 . 2]" 1
1834 1 99 VAL HB 1 100 SER H . . 4.200 4.113 3.881 4.199 . 0 0 "[ . 1 . 2]" 1
1835 1 99 VAL HB 1 101 ILE HG12 . . 5.500 4.657 4.252 4.984 . 0 0 "[ . 1 . 2]" 1
1836 1 99 VAL HB 1 101 ILE HG13 . . 4.650 3.584 3.317 3.843 . 0 0 "[ . 1 . 2]" 1
1837 1 99 VAL MG1 1 100 SER H . . 3.200 2.554 2.223 2.806 . 0 0 "[ . 1 . 2]" 1
1838 1 99 VAL MG1 1 101 ILE MD . . 4.130 3.040 2.763 3.289 . 0 0 "[ . 1 . 2]" 1
1839 1 100 SER H 1 100 SER QB . . 2.810 2.495 2.153 2.721 . 0 0 "[ . 1 . 2]" 1
1840 1 100 SER H 1 101 ILE H . . 4.700 4.456 4.274 4.566 . 0 0 "[ . 1 . 2]" 1
1841 1 100 SER HA 1 101 ILE H . . 2.770 2.150 2.137 2.183 . 0 0 "[ . 1 . 2]" 1
1842 1 100 SER HA 1 101 ILE HA . . 4.620 4.399 4.392 4.418 . 0 0 "[ . 1 . 2]" 1
1843 1 100 SER HA 1 101 ILE HB . . 4.760 4.615 4.509 4.718 . 0 0 "[ . 1 . 2]" 1
1844 1 100 SER HA 1 101 ILE HG12 . . 5.350 5.161 4.812 5.347 . 0 0 "[ . 1 . 2]" 1
1845 1 100 SER QB 1 101 ILE H . . 3.660 3.361 3.053 3.649 . 0 0 "[ . 1 . 2]" 1
1846 1 101 ILE H 1 101 ILE HB . . 3.510 2.688 2.547 2.848 . 0 0 "[ . 1 . 2]" 1
1847 1 101 ILE H 1 101 ILE MD . . 4.710 4.032 3.928 4.210 . 0 0 "[ . 1 . 2]" 1
1848 1 101 ILE H 1 101 ILE HG12 . . 4.210 4.026 3.799 4.204 . 0 0 "[ . 1 . 2]" 1
1849 1 101 ILE H 1 101 ILE HG13 . . 3.950 2.876 2.681 3.049 . 0 0 "[ . 1 . 2]" 1
1850 1 101 ILE H 1 101 ILE MG . . 4.190 3.863 3.801 3.933 . 0 0 "[ . 1 . 2]" 1
1851 1 101 ILE H 1 102 MET H . . 4.590 4.439 4.369 4.510 . 0 0 "[ . 1 . 2]" 1
1852 1 101 ILE HA 1 101 ILE MD . . 4.260 3.845 3.811 3.884 . 0 0 "[ . 1 . 2]" 1
1853 1 101 ILE HA 1 101 ILE HG12 . . 3.880 2.571 2.500 2.642 . 0 0 "[ . 1 . 2]" 1
1854 1 101 ILE HA 1 101 ILE HG13 . . 4.040 2.981 2.866 3.141 . 0 0 "[ . 1 . 2]" 1
1855 1 101 ILE HA 1 101 ILE MG . . 3.570 2.387 2.292 2.466 . 0 0 "[ . 1 . 2]" 1
1856 1 101 ILE HA 1 102 MET H . . 2.810 2.236 2.198 2.314 . 0 0 "[ . 1 . 2]" 1
1857 1 101 ILE HA 1 102 MET HB2 . . 4.770 4.367 4.245 4.601 . 0 0 "[ . 1 . 2]" 1
1858 1 101 ILE HA 1 102 MET HB3 . . 4.770 4.666 4.416 4.770 0.000 18 0 "[ . 1 . 2]" 1
1859 1 101 ILE HB 1 101 ILE MD . . 3.700 2.383 2.270 2.495 . 0 0 "[ . 1 . 2]" 1
1860 1 101 ILE HB 1 102 MET H . . 4.020 3.923 3.774 4.012 . 0 0 "[ . 1 . 2]" 1
1861 1 101 ILE HB 1 103 VAL MG2 . . 3.780 3.675 3.513 3.780 . 6 0 "[ . 1 . 2]" 1
1862 1 101 ILE MD 1 101 ILE MG . . 3.110 2.044 1.922 2.216 . 0 0 "[ . 1 . 2]" 1
1863 1 101 ILE MD 1 102 MET H . . 4.980 4.839 4.694 4.968 . 0 0 "[ . 1 . 2]" 1
1864 1 101 ILE HG12 1 101 ILE MG . . 3.090 2.320 2.255 2.382 . 0 0 "[ . 1 . 2]" 1
1865 1 101 ILE HG12 1 102 MET H . . 4.410 4.223 4.080 4.396 . 0 0 "[ . 1 . 2]" 1
1866 1 101 ILE HG13 1 102 MET H . . 5.150 4.927 4.811 5.060 . 0 0 "[ . 1 . 2]" 1
1867 1 101 ILE MG 1 102 MET H . . 3.660 2.069 1.887 2.205 . 0 0 "[ . 1 . 2]" 1
1868 1 101 ILE MG 1 102 MET QB . . 4.420 3.778 3.695 3.901 . 0 0 "[ . 1 . 2]" 1
1869 1 102 MET H 1 102 MET HB2 . . 3.130 2.864 2.717 3.103 . 0 0 "[ . 1 . 2]" 1
1870 1 102 MET H 1 102 MET HB3 . . 3.130 2.607 2.413 2.728 . 0 0 "[ . 1 . 2]" 1
1871 1 102 MET H 1 102 MET HG2 . . 4.930 4.743 4.647 4.857 . 0 0 "[ . 1 . 2]" 1
1872 1 102 MET H 1 102 MET QG . . 4.180 4.074 3.989 4.160 . 0 0 "[ . 1 . 2]" 1
1873 1 102 MET H 1 102 MET HG3 . . 4.930 4.440 4.274 4.522 . 0 0 "[ . 1 . 2]" 1
1874 1 102 MET H 1 103 VAL H . . 4.600 4.355 4.282 4.426 . 0 0 "[ . 1 . 2]" 1
1875 1 102 MET HA 1 102 MET ME . . 3.810 3.074 2.549 3.484 . 0 0 "[ . 1 . 2]" 1
1876 1 102 MET HA 1 103 VAL H . . 2.870 2.144 2.140 2.152 . 0 0 "[ . 1 . 2]" 1
1877 1 102 MET HA 1 103 VAL HB . . 4.660 4.651 4.599 4.666 0.006 4 0 "[ . 1 . 2]" 1
1878 1 102 MET HA 1 103 VAL MG2 . . 4.340 3.623 3.493 3.751 . 0 0 "[ . 1 . 2]" 1
1879 1 102 MET HB2 1 103 VAL H . . 4.870 4.338 4.231 4.409 . 0 0 "[ . 1 . 2]" 1
1880 1 102 MET HB3 1 103 VAL H . . 4.870 4.224 4.101 4.393 . 0 0 "[ . 1 . 2]" 1
1881 1 102 MET ME 1 102 MET HG2 . . 3.670 2.932 2.402 3.116 . 0 0 "[ . 1 . 2]" 1
1882 1 102 MET ME 1 102 MET QG . . 2.940 2.076 1.976 2.389 . 0 0 "[ . 1 . 2]" 1
1883 1 102 MET ME 1 102 MET HG3 . . 3.670 2.213 2.000 3.387 . 0 0 "[ . 1 . 2]" 1
1884 1 102 MET ME 1 103 VAL H . . 3.700 3.010 2.626 3.541 . 0 0 "[ . 1 . 2]" 1
1885 1 102 MET QG 1 104 VAL MG1 . . 3.220 2.520 2.337 2.690 . 0 0 "[ . 1 . 2]" 1
1886 1 102 MET HG2 1 103 VAL H . . 4.740 4.560 4.352 4.681 . 0 0 "[ . 1 . 2]" 1
1887 1 102 MET HG2 1 104 VAL MG1 . . 3.990 3.319 3.113 3.563 . 0 0 "[ . 1 . 2]" 1
1888 1 102 MET HG3 1 103 VAL H . . 4.740 2.983 2.661 3.854 . 0 0 "[ . 1 . 2]" 1
1889 1 102 MET HG3 1 104 VAL MG1 . . 3.990 2.616 2.391 2.800 . 0 0 "[ . 1 . 2]" 1
1890 1 103 VAL H 1 103 VAL HB . . 3.160 2.613 2.554 2.690 . 0 0 "[ . 1 . 2]" 1
1891 1 103 VAL H 1 103 VAL MG1 . . 4.030 3.840 3.814 3.875 . 0 0 "[ . 1 . 2]" 1
1892 1 103 VAL H 1 103 VAL MG2 . . 3.270 2.596 2.496 2.747 . 0 0 "[ . 1 . 2]" 1
1893 1 103 VAL H 1 104 VAL H . . 4.500 4.447 4.348 4.496 . 0 0 "[ . 1 . 2]" 1
1894 1 103 VAL HA 1 103 VAL MG1 . . 3.280 2.397 2.301 2.453 . 0 0 "[ . 1 . 2]" 1
1895 1 103 VAL HA 1 103 VAL MG2 . . 3.330 2.414 2.328 2.477 . 0 0 "[ . 1 . 2]" 1
1896 1 103 VAL HA 1 104 VAL H . . 2.760 2.180 2.147 2.227 . 0 0 "[ . 1 . 2]" 1
1897 1 103 VAL HB 1 104 VAL H . . 4.670 4.061 3.930 4.177 . 0 0 "[ . 1 . 2]" 1
1898 1 103 VAL MG1 1 104 VAL H . . 3.110 2.380 2.168 2.688 . 0 0 "[ . 1 . 2]" 1
1899 1 103 VAL MG1 1 104 VAL HA . . 3.730 3.402 3.171 3.592 . 0 0 "[ . 1 . 2]" 1
1900 1 103 VAL MG2 1 104 VAL H . . 4.120 3.995 3.875 4.102 . 0 0 "[ . 1 . 2]" 1
1901 1 104 VAL H 1 104 VAL HB . . 4.000 3.892 3.808 3.972 . 0 0 "[ . 1 . 2]" 1
1902 1 104 VAL H 1 104 VAL MG1 . . 3.640 3.026 2.758 3.235 . 0 0 "[ . 1 . 2]" 1
1903 1 104 VAL H 1 104 VAL MG2 . . 3.040 2.264 2.103 2.494 . 0 0 "[ . 1 . 2]" 1
1904 1 104 VAL H 1 105 GLN HA . . 5.070 4.818 4.672 4.946 . 0 0 "[ . 1 . 2]" 1
1905 1 104 VAL HA 1 104 VAL MG1 . . 3.090 2.338 2.248 2.430 . 0 0 "[ . 1 . 2]" 1
1906 1 104 VAL HA 1 104 VAL MG2 . . 3.280 3.193 3.184 3.203 . 0 0 "[ . 1 . 2]" 1
1907 1 104 VAL HA 1 105 GLN H . . 2.690 2.293 2.181 2.492 . 0 0 "[ . 1 . 2]" 1
1908 1 104 VAL HA 1 105 GLN QG . . 4.240 3.986 3.523 4.243 0.003 14 0 "[ . 1 . 2]" 1
1909 1 104 VAL HB 1 105 GLN H . . 3.120 2.696 2.230 3.071 . 0 0 "[ . 1 . 2]" 1
1910 1 104 VAL MG1 1 105 GLN H . . 3.880 3.780 3.586 3.865 . 0 0 "[ . 1 . 2]" 1
1911 1 105 GLN H 1 105 GLN QB . . 2.950 2.427 2.197 2.813 . 0 0 "[ . 1 . 2]" 1
1912 1 105 GLN H 1 105 GLN QG . . 3.630 2.531 1.886 3.254 . 0 0 "[ . 1 . 2]" 1
1913 1 105 GLN H 1 106 SER H . . 5.230 4.348 3.984 4.581 . 0 0 "[ . 1 . 2]" 1
1914 1 105 GLN HA 1 105 GLN QG . . 3.600 2.607 2.158 3.440 . 0 0 "[ . 1 . 2]" 1
1915 1 105 GLN HA 1 106 SER H . . 3.290 2.186 2.138 2.308 . 0 0 "[ . 1 . 2]" 1
1916 1 105 GLN QB 1 105 GLN HE22 . . 4.880 3.614 3.180 4.135 . 0 0 "[ . 1 . 2]" 1
1917 1 105 GLN QB 1 106 SER H . . 4.080 3.444 2.989 3.834 . 0 0 "[ . 1 . 2]" 1
1918 1 105 GLN QG 1 106 SER H . . 4.490 4.193 3.624 4.497 0.007 12 0 "[ . 1 . 2]" 1
1919 1 106 SER H 1 106 SER QB . . 3.590 2.478 2.194 2.848 . 0 0 "[ . 1 . 2]" 1
1920 1 106 SER H 1 107 GLU H . . 5.500 4.088 2.476 4.631 . 0 0 "[ . 1 . 2]" 1
1921 1 106 SER HB2 1 107 GLU H . . 4.750 3.583 2.085 4.576 . 0 0 "[ . 1 . 2]" 1
1922 1 106 SER HB3 1 107 GLU H . . 4.750 3.877 2.648 4.570 . 0 0 "[ . 1 . 2]" 1
1923 1 107 GLU H 1 107 GLU HB2 . . 3.800 2.835 2.251 3.745 . 0 0 "[ . 1 . 2]" 1
1924 1 107 GLU H 1 107 GLU QB . . 3.320 2.462 2.192 2.997 . 0 0 "[ . 1 . 2]" 1
1925 1 107 GLU H 1 107 GLU HB3 . . 3.800 3.020 2.435 3.782 . 0 0 "[ . 1 . 2]" 1
1926 1 107 GLU H 1 107 GLU QG . . 4.930 3.545 1.995 4.403 . 0 0 "[ . 1 . 2]" 1
1927 1 107 GLU H 1 108 ILE H . . 4.780 4.052 2.583 4.641 . 0 0 "[ . 1 . 2]" 1
1928 1 107 GLU HA 1 107 GLU QG . . 3.480 2.689 2.229 3.446 . 0 0 "[ . 1 . 2]" 1
1929 1 107 GLU HA 1 108 ILE H . . 3.210 2.313 2.138 2.914 . 0 0 "[ . 1 . 2]" 1
1930 1 107 GLU QB 1 108 ILE H . . 4.110 3.608 2.648 4.041 . 0 0 "[ . 1 . 2]" 1
1931 1 107 GLU HB2 1 108 ILE H . . 4.900 4.215 3.127 4.644 . 0 0 "[ . 1 . 2]" 1
1932 1 107 GLU HB3 1 108 ILE H . . 4.900 4.044 2.688 4.637 . 0 0 "[ . 1 . 2]" 1
1933 1 108 ILE H 1 108 ILE HB . . 3.590 2.832 2.491 3.611 0.021 19 0 "[ . 1 . 2]" 1
1934 1 108 ILE H 1 108 ILE HG12 . . 4.240 3.266 2.040 4.235 . 0 0 "[ . 1 . 2]" 1
1935 1 108 ILE H 1 108 ILE QG . . 3.700 2.556 1.968 3.468 . 0 0 "[ . 1 . 2]" 1
1936 1 108 ILE H 1 108 ILE HG13 . . 4.240 3.145 1.978 4.126 . 0 0 "[ . 1 . 2]" 1
1937 1 108 ILE H 1 108 ILE MG . . 4.460 3.434 1.890 3.899 . 0 0 "[ . 1 . 2]" 1
1938 1 108 ILE H 1 109 GLY H . . 4.440 3.159 2.261 4.510 0.070 10 0 "[ . 1 . 2]" 1
1939 1 108 ILE HA 1 108 ILE MD . . 3.940 3.185 1.974 3.940 . 0 0 "[ . 1 . 2]" 1
1940 1 108 ILE HA 1 108 ILE HG12 . . 4.250 3.035 2.620 4.222 . 0 0 "[ . 1 . 2]" 1
1941 1 108 ILE HA 1 108 ILE QG . . 3.680 2.810 2.432 3.449 . 0 0 "[ . 1 . 2]" 1
1942 1 108 ILE HA 1 108 ILE HG13 . . 4.250 3.405 2.692 4.248 . 0 0 "[ . 1 . 2]" 1
1943 1 108 ILE HA 1 108 ILE MG . . 3.300 2.382 2.241 2.530 . 0 0 "[ . 1 . 2]" 1
1944 1 108 ILE HB 1 109 GLY H . . 4.530 3.107 2.123 4.431 . 0 0 "[ . 1 . 2]" 1
1945 1 108 ILE HB 1 109 GLY QA . . 5.080 4.191 3.767 4.634 . 0 0 "[ . 1 . 2]" 1
1946 1 108 ILE QG 1 108 ILE MG . . 3.330 2.251 1.983 2.426 . 0 0 "[ . 1 . 2]" 1
1947 1 108 ILE MG 1 109 GLY H . . 4.470 3.186 2.144 4.097 . 0 0 "[ . 1 . 2]" 1
1948 1 110 ASP HA 1 111 SER HA . . 4.760 4.430 4.296 4.675 . 0 0 "[ . 1 . 2]" 1
1949 1 110 ASP QB 1 111 SER H . . 4.000 3.331 2.372 3.998 . 0 0 "[ . 1 . 2]" 1
1950 1 110 ASP HB2 1 111 SER H . . 4.670 3.864 2.395 4.598 . 0 0 "[ . 1 . 2]" 1
1951 1 110 ASP HB3 1 111 SER H . . 4.670 3.829 2.493 4.533 . 0 0 "[ . 1 . 2]" 1
1952 1 112 GLY QA 1 113 PRO QD . . 3.070 1.989 1.905 2.092 . 0 0 "[ . 1 . 2]" 1
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