NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
461274 |
2dl9   |
11223 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2dl9
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 2121
_Distance_constraint_stats_list.Viol_count 568
_Distance_constraint_stats_list.Viol_total 133.013
_Distance_constraint_stats_list.Viol_max 0.093
_Distance_constraint_stats_list.Viol_rms 0.0023
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0117
_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 PRO 0.008 0.003 4 0 "[ . 1 . 2]"
1 9 PHE 0.005 0.003 2 0 "[ . 1 . 2]"
1 10 ILE 0.012 0.012 17 0 "[ . 1 . 2]"
1 11 MET 0.029 0.010 17 0 "[ . 1 . 2]"
1 12 ASP 0.142 0.036 20 0 "[ . 1 . 2]"
1 13 ALA 0.007 0.004 18 0 "[ . 1 . 2]"
1 14 PRO 0.012 0.012 17 0 "[ . 1 . 2]"
1 15 ARG 0.015 0.005 10 0 "[ . 1 . 2]"
1 16 ASP 0.011 0.005 3 0 "[ . 1 . 2]"
1 17 LEU 0.007 0.005 3 0 "[ . 1 . 2]"
1 18 ASN 0.010 0.003 10 0 "[ . 1 . 2]"
1 19 ILE 0.021 0.005 5 0 "[ . 1 . 2]"
1 20 SER 0.028 0.012 13 0 "[ . 1 . 2]"
1 21 GLU 0.086 0.016 20 0 "[ . 1 . 2]"
1 22 GLY 0.044 0.016 20 0 "[ . 1 . 2]"
1 23 ARG 0.027 0.019 9 0 "[ . 1 . 2]"
1 24 MET 0.029 0.019 9 0 "[ . 1 . 2]"
1 25 ALA 0.007 0.005 6 0 "[ . 1 . 2]"
1 26 GLU 0.007 0.005 19 0 "[ . 1 . 2]"
1 27 LEU 0.001 0.001 19 0 "[ . 1 . 2]"
1 28 LYS 0.080 0.073 9 0 "[ . 1 . 2]"
1 29 CYS 0.094 0.023 7 0 "[ . 1 . 2]"
1 30 ARG 0.299 0.036 20 0 "[ . 1 . 2]"
1 31 THR 0.049 0.028 18 0 "[ . 1 . 2]"
1 32 PRO 1.224 0.071 3 0 "[ . 1 . 2]"
1 33 PRO 1.221 0.071 3 0 "[ . 1 . 2]"
1 34 MET 0.000 0.000 12 0 "[ . 1 . 2]"
1 35 SER 0.049 0.036 10 0 "[ . 1 . 2]"
1 36 SER 0.059 0.024 10 0 "[ . 1 . 2]"
1 37 VAL 0.075 0.024 10 0 "[ . 1 . 2]"
1 38 LYS 0.040 0.009 2 0 "[ . 1 . 2]"
1 39 TRP 0.129 0.015 10 0 "[ . 1 . 2]"
1 40 LEU 1.334 0.093 20 0 "[ . 1 . 2]"
1 41 LEU 0.760 0.056 18 0 "[ . 1 . 2]"
1 42 PRO 0.023 0.008 5 0 "[ . 1 . 2]"
1 43 ASN 0.019 0.016 19 0 "[ . 1 . 2]"
1 44 GLY 0.190 0.035 20 0 "[ . 1 . 2]"
1 45 THR 0.140 0.021 18 0 "[ . 1 . 2]"
1 46 VAL 0.946 0.093 20 0 "[ . 1 . 2]"
1 47 LEU 0.095 0.007 17 0 "[ . 1 . 2]"
1 48 SER 0.029 0.007 11 0 "[ . 1 . 2]"
1 49 HIS 0.011 0.003 11 0 "[ . 1 . 2]"
1 50 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 HIS 0.571 0.036 7 0 "[ . 1 . 2]"
1 54 PRO 0.507 0.035 7 0 "[ . 1 . 2]"
1 55 ARG 0.082 0.012 10 0 "[ . 1 . 2]"
1 56 ILE 1.327 0.037 3 0 "[ . 1 . 2]"
1 57 SER 0.374 0.037 3 0 "[ . 1 . 2]"
1 58 VAL 0.140 0.027 12 0 "[ . 1 . 2]"
1 59 LEU 0.098 0.027 12 0 "[ . 1 . 2]"
1 60 ASN 0.003 0.002 6 0 "[ . 1 . 2]"
1 61 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 GLY 0.001 0.001 11 0 "[ . 1 . 2]"
1 63 THR 0.003 0.002 5 0 "[ . 1 . 2]"
1 64 LEU 0.048 0.016 5 0 "[ . 1 . 2]"
1 65 ASN 0.072 0.016 5 0 "[ . 1 . 2]"
1 66 PHE 0.032 0.005 6 0 "[ . 1 . 2]"
1 67 SER 0.005 0.002 8 0 "[ . 1 . 2]"
1 68 HIS 0.018 0.004 11 0 "[ . 1 . 2]"
1 69 VAL 0.052 0.010 5 0 "[ . 1 . 2]"
1 70 LEU 0.130 0.030 3 0 "[ . 1 . 2]"
1 71 LEU 0.095 0.023 12 0 "[ . 1 . 2]"
1 72 SER 0.010 0.007 7 0 "[ . 1 . 2]"
1 73 ASP 0.008 0.005 7 0 "[ . 1 . 2]"
1 74 THR 0.057 0.022 7 0 "[ . 1 . 2]"
1 75 GLY 0.595 0.065 17 0 "[ . 1 . 2]"
1 76 VAL 0.653 0.065 17 0 "[ . 1 . 2]"
1 77 TYR 0.018 0.007 9 0 "[ . 1 . 2]"
1 78 THR 0.002 0.002 2 0 "[ . 1 . 2]"
1 79 CYS 0.004 0.004 2 0 "[ . 1 . 2]"
1 80 MET 0.033 0.009 2 0 "[ . 1 . 2]"
1 81 VAL 0.009 0.003 4 0 "[ . 1 . 2]"
1 82 THR 0.026 0.025 2 0 "[ . 1 . 2]"
1 83 ASN 0.002 0.001 2 0 "[ . 1 . 2]"
1 84 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 GLY 0.001 0.001 2 0 "[ . 1 . 2]"
1 87 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 ASN 0.000 0.000 15 0 "[ . 1 . 2]"
1 90 ALA 0.004 0.004 18 0 "[ . 1 . 2]"
1 91 SER 0.009 0.005 17 0 "[ . 1 . 2]"
1 92 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 TYR 0.016 0.008 5 0 "[ . 1 . 2]"
1 94 LEU 0.026 0.007 9 0 "[ . 1 . 2]"
1 95 ASN 0.012 0.004 9 0 "[ . 1 . 2]"
1 96 VAL 0.033 0.009 3 0 "[ . 1 . 2]"
1 97 SER 0.002 0.002 13 0 "[ . 1 . 2]"
1 98 SER 0.003 0.003 7 0 "[ . 1 . 2]"
1 99 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 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 PRO QD . . 2.750 1.963 1.867 2.094 . 0 0 "[ . 1 . 2]" 1
2 1 7 GLY QA 1 8 PRO HG2 . . 5.020 4.064 3.984 4.265 . 0 0 "[ . 1 . 2]" 1
3 1 7 GLY QA 1 8 PRO QG . . 4.240 3.727 3.647 3.854 . 0 0 "[ . 1 . 2]" 1
4 1 7 GLY QA 1 8 PRO HG3 . . 5.020 4.340 4.195 4.585 . 0 0 "[ . 1 . 2]" 1
5 1 8 PRO HA 1 9 PHE H . . 3.270 2.619 2.543 2.704 . 0 0 "[ . 1 . 2]" 1
6 1 8 PRO HA 1 10 ILE H . . 4.800 4.380 4.035 4.638 . 0 0 "[ . 1 . 2]" 1
7 1 8 PRO HB2 1 81 VAL MG1 . . 5.500 5.359 5.218 5.503 0.003 4 0 "[ . 1 . 2]" 1
8 1 8 PRO HB3 1 9 PHE H . . 4.600 3.226 3.159 3.293 . 0 0 "[ . 1 . 2]" 1
9 1 8 PRO QD 1 9 PHE H . . 4.860 4.804 4.733 4.863 0.003 2 0 "[ . 1 . 2]" 1
10 1 8 PRO QG 1 88 SER QB . . 4.750 3.527 2.923 4.152 . 0 0 "[ . 1 . 2]" 1
11 1 9 PHE H 1 9 PHE HB2 . . 3.980 2.350 2.218 2.523 . 0 0 "[ . 1 . 2]" 1
12 1 9 PHE H 1 9 PHE QB . . 3.370 2.320 2.196 2.483 . 0 0 "[ . 1 . 2]" 1
13 1 9 PHE H 1 9 PHE HB3 . . 3.980 3.588 3.516 3.707 . 0 0 "[ . 1 . 2]" 1
14 1 9 PHE H 1 9 PHE QD . . 4.420 2.484 1.952 3.170 . 0 0 "[ . 1 . 2]" 1
15 1 9 PHE H 1 10 ILE H . . 3.600 2.838 2.230 3.331 . 0 0 "[ . 1 . 2]" 1
16 1 9 PHE H 1 10 ILE HA . . 5.370 5.047 4.663 5.286 . 0 0 "[ . 1 . 2]" 1
17 1 9 PHE H 1 88 SER QB . . 4.680 2.531 1.888 3.389 . 0 0 "[ . 1 . 2]" 1
18 1 9 PHE HA 1 9 PHE QD . . 3.720 2.987 2.628 3.116 . 0 0 "[ . 1 . 2]" 1
19 1 9 PHE HA 1 9 PHE QE . . 5.080 4.567 4.421 4.696 . 0 0 "[ . 1 . 2]" 1
20 1 9 PHE HA 1 10 ILE H . . 3.540 3.060 2.699 3.534 . 0 0 "[ . 1 . 2]" 1
21 1 9 PHE HA 1 32 PRO QD . . 4.730 4.421 4.039 4.682 . 0 0 "[ . 1 . 2]" 1
22 1 9 PHE HA 1 32 PRO HG3 . . 4.620 4.266 3.734 4.488 . 0 0 "[ . 1 . 2]" 1
23 1 9 PHE QB 1 10 ILE H . . 4.090 3.477 2.642 3.892 . 0 0 "[ . 1 . 2]" 1
24 1 9 PHE QB 1 10 ILE QG . . 4.550 3.499 3.255 3.793 . 0 0 "[ . 1 . 2]" 1
25 1 9 PHE QB 1 32 PRO QD . . 4.820 3.060 2.540 3.540 . 0 0 "[ . 1 . 2]" 1
26 1 9 PHE QB 1 32 PRO HG2 . . 5.340 3.662 3.293 3.988 . 0 0 "[ . 1 . 2]" 1
27 1 9 PHE QB 1 88 SER QB . . 3.700 3.160 2.873 3.498 . 0 0 "[ . 1 . 2]" 1
28 1 9 PHE HB2 1 10 ILE H . . 4.700 3.775 2.754 4.338 . 0 0 "[ . 1 . 2]" 1
29 1 9 PHE HB2 1 81 VAL HB . . 5.500 4.298 3.795 4.590 . 0 0 "[ . 1 . 2]" 1
30 1 9 PHE HB2 1 81 VAL MG1 . . 4.290 3.006 2.672 3.373 . 0 0 "[ . 1 . 2]" 1
31 1 9 PHE HB3 1 10 ILE H . . 4.700 4.125 3.398 4.454 . 0 0 "[ . 1 . 2]" 1
32 1 9 PHE HB3 1 81 VAL HB . . 5.500 5.293 5.085 5.501 0.001 20 0 "[ . 1 . 2]" 1
33 1 9 PHE HB3 1 81 VAL MG1 . . 4.290 3.287 3.069 3.422 . 0 0 "[ . 1 . 2]" 1
34 1 9 PHE QD 1 10 ILE H . . 5.100 4.708 4.184 4.985 . 0 0 "[ . 1 . 2]" 1
35 1 9 PHE QD 1 32 PRO HB3 . . 5.360 4.187 2.849 5.354 . 0 0 "[ . 1 . 2]" 1
36 1 9 PHE QD 1 32 PRO HG2 . . 5.000 4.071 3.088 4.842 . 0 0 "[ . 1 . 2]" 1
37 1 9 PHE QD 1 32 PRO HG3 . . 5.130 2.790 2.033 3.654 . 0 0 "[ . 1 . 2]" 1
38 1 9 PHE QD 1 81 VAL MG1 . . 4.860 4.418 4.117 4.715 . 0 0 "[ . 1 . 2]" 1
39 1 9 PHE QD 1 85 ALA MB . . 4.190 3.662 3.147 4.024 . 0 0 "[ . 1 . 2]" 1
40 1 9 PHE QD 1 88 SER HB2 . . 5.310 4.297 3.305 5.297 . 0 0 "[ . 1 . 2]" 1
41 1 9 PHE QD 1 88 SER QB . . 4.540 3.492 2.319 4.231 . 0 0 "[ . 1 . 2]" 1
42 1 9 PHE QD 1 88 SER HB3 . . 5.310 4.183 2.334 5.238 . 0 0 "[ . 1 . 2]" 1
43 1 9 PHE QE 1 85 ALA HA . . 5.500 4.744 4.307 5.152 . 0 0 "[ . 1 . 2]" 1
44 1 9 PHE QE 1 85 ALA MB . . 3.950 2.226 1.819 2.682 . 0 0 "[ . 1 . 2]" 1
45 1 9 PHE QE 1 86 GLY QA . . 4.340 2.223 2.000 2.384 . 0 0 "[ . 1 . 2]" 1
46 1 9 PHE HZ 1 85 ALA MB . . 3.660 2.211 1.842 2.877 . 0 0 "[ . 1 . 2]" 1
47 1 9 PHE HZ 1 86 GLY HA2 . . 5.500 4.696 3.807 5.380 . 0 0 "[ . 1 . 2]" 1
48 1 9 PHE HZ 1 86 GLY QA . . 4.760 3.321 2.392 3.927 . 0 0 "[ . 1 . 2]" 1
49 1 9 PHE HZ 1 86 GLY HA3 . . 5.500 3.399 2.418 4.035 . 0 0 "[ . 1 . 2]" 1
50 1 10 ILE H 1 10 ILE HB . . 3.570 2.623 2.421 2.739 . 0 0 "[ . 1 . 2]" 1
51 1 10 ILE H 1 10 ILE MD . . 4.450 3.659 3.122 4.065 . 0 0 "[ . 1 . 2]" 1
52 1 10 ILE H 1 10 ILE HG12 . . 4.600 3.846 2.527 4.317 . 0 0 "[ . 1 . 2]" 1
53 1 10 ILE H 1 10 ILE QG . . 3.830 2.558 1.928 3.009 . 0 0 "[ . 1 . 2]" 1
54 1 10 ILE H 1 10 ILE HG13 . . 4.600 2.660 1.940 3.802 . 0 0 "[ . 1 . 2]" 1
55 1 10 ILE H 1 10 ILE MG . . 4.440 3.823 3.749 3.887 . 0 0 "[ . 1 . 2]" 1
56 1 10 ILE H 1 11 MET H . . 5.000 4.003 3.615 4.550 . 0 0 "[ . 1 . 2]" 1
57 1 10 ILE HA 1 10 ILE MD . . 4.070 3.785 2.242 3.903 . 0 0 "[ . 1 . 2]" 1
58 1 10 ILE HA 1 10 ILE HG12 . . 3.990 2.701 2.552 2.961 . 0 0 "[ . 1 . 2]" 1
59 1 10 ILE HA 1 10 ILE QG . . 3.410 2.461 2.378 2.868 . 0 0 "[ . 1 . 2]" 1
60 1 10 ILE HA 1 10 ILE HG13 . . 3.990 2.878 2.646 3.833 . 0 0 "[ . 1 . 2]" 1
61 1 10 ILE HA 1 10 ILE MG . . 3.370 2.379 2.209 2.467 . 0 0 "[ . 1 . 2]" 1
62 1 10 ILE HA 1 11 MET H . . 3.200 2.234 2.167 2.314 . 0 0 "[ . 1 . 2]" 1
63 1 10 ILE HA 1 12 ASP H . . 4.670 3.662 3.348 4.065 . 0 0 "[ . 1 . 2]" 1
64 1 10 ILE HA 1 31 THR HA . . 4.110 3.221 2.887 3.719 . 0 0 "[ . 1 . 2]" 1
65 1 10 ILE HA 1 31 THR MG . . 3.960 3.510 2.885 3.930 . 0 0 "[ . 1 . 2]" 1
66 1 10 ILE HA 1 32 PRO QD . . 4.500 3.293 2.831 3.661 . 0 0 "[ . 1 . 2]" 1
67 1 10 ILE HB 1 10 ILE MD . . 3.250 2.328 2.120 3.204 . 0 0 "[ . 1 . 2]" 1
68 1 10 ILE HB 1 11 MET H . . 5.260 4.433 4.065 4.481 . 0 0 "[ . 1 . 2]" 1
69 1 10 ILE MD 1 13 ALA HA . . 4.560 3.907 3.318 4.335 . 0 0 "[ . 1 . 2]" 1
70 1 10 ILE MD 1 79 CYS QB . . 4.410 3.943 3.355 4.357 . 0 0 "[ . 1 . 2]" 1
71 1 10 ILE MD 1 81 VAL H . . 4.580 4.401 3.970 4.578 . 0 0 "[ . 1 . 2]" 1
72 1 10 ILE MD 1 81 VAL HB . . 4.290 3.143 2.020 3.541 . 0 0 "[ . 1 . 2]" 1
73 1 10 ILE MD 1 81 VAL MG2 . . 3.010 2.178 1.764 2.713 . 0 0 "[ . 1 . 2]" 1
74 1 10 ILE MD 1 88 SER HA . . 4.930 4.145 3.851 4.624 . 0 0 "[ . 1 . 2]" 1
75 1 10 ILE MD 1 88 SER HB2 . . 4.060 2.737 1.975 3.622 . 0 0 "[ . 1 . 2]" 1
76 1 10 ILE MD 1 88 SER QB . . 3.480 2.265 1.964 2.720 . 0 0 "[ . 1 . 2]" 1
77 1 10 ILE MD 1 88 SER HB3 . . 4.060 2.972 2.008 3.963 . 0 0 "[ . 1 . 2]" 1
78 1 10 ILE MD 1 89 ASN HA . . 3.830 2.761 2.116 3.082 . 0 0 "[ . 1 . 2]" 1
79 1 10 ILE MD 1 90 ALA H . . 3.850 3.514 3.113 3.821 . 0 0 "[ . 1 . 2]" 1
80 1 10 ILE MD 1 90 ALA HA . . 5.310 4.075 3.771 4.595 . 0 0 "[ . 1 . 2]" 1
81 1 10 ILE MD 1 90 ALA MB . . 2.910 2.449 2.243 2.706 . 0 0 "[ . 1 . 2]" 1
82 1 10 ILE QG 1 10 ILE MG . . 3.300 2.175 2.009 2.397 . 0 0 "[ . 1 . 2]" 1
83 1 10 ILE QG 1 81 VAL MG2 . . 3.840 2.072 1.759 3.514 . 0 0 "[ . 1 . 2]" 1
84 1 10 ILE QG 1 88 SER QB . . 3.680 2.668 2.103 3.590 . 0 0 "[ . 1 . 2]" 1
85 1 10 ILE MG 1 11 MET H . . 4.030 3.225 2.062 3.557 . 0 0 "[ . 1 . 2]" 1
86 1 10 ILE MG 1 12 ASP H . . 3.830 2.269 1.890 2.856 . 0 0 "[ . 1 . 2]" 1
87 1 10 ILE MG 1 13 ALA H . . 4.130 3.323 2.737 3.853 . 0 0 "[ . 1 . 2]" 1
88 1 10 ILE MG 1 13 ALA HA . . 3.120 2.297 2.001 2.600 . 0 0 "[ . 1 . 2]" 1
89 1 10 ILE MG 1 13 ALA MB . . 3.010 2.556 2.236 2.927 . 0 0 "[ . 1 . 2]" 1
90 1 10 ILE MG 1 14 PRO HD2 . . 4.050 3.639 3.426 4.062 0.012 17 0 "[ . 1 . 2]" 1
91 1 10 ILE MG 1 14 PRO HD3 . . 4.090 3.485 3.253 3.760 . 0 0 "[ . 1 . 2]" 1
92 1 10 ILE MG 1 29 CYS HA . . 4.080 3.600 3.034 3.972 . 0 0 "[ . 1 . 2]" 1
93 1 10 ILE MG 1 30 ARG H . . 3.940 2.836 2.218 3.336 . 0 0 "[ . 1 . 2]" 1
94 1 10 ILE MG 1 31 THR MG . . 3.870 3.346 2.925 3.678 . 0 0 "[ . 1 . 2]" 1
95 1 11 MET H 1 11 MET QB . . 3.640 2.543 2.373 2.649 . 0 0 "[ . 1 . 2]" 1
96 1 11 MET H 1 11 MET ME . . 4.960 3.704 2.712 4.936 . 0 0 "[ . 1 . 2]" 1
97 1 11 MET H 1 11 MET HG2 . . 4.200 2.363 1.902 3.639 . 0 0 "[ . 1 . 2]" 1
98 1 11 MET H 1 11 MET QG . . 3.690 2.061 1.891 2.624 . 0 0 "[ . 1 . 2]" 1
99 1 11 MET H 1 11 MET HG3 . . 4.200 3.122 1.988 3.596 . 0 0 "[ . 1 . 2]" 1
100 1 11 MET H 1 12 ASP H . . 3.720 2.869 2.254 3.141 . 0 0 "[ . 1 . 2]" 1
101 1 11 MET H 1 30 ARG QB . . 4.720 3.708 3.064 4.730 0.010 17 0 "[ . 1 . 2]" 1
102 1 11 MET H 1 31 THR MG . . 4.970 4.691 4.108 4.970 . 0 0 "[ . 1 . 2]" 1
103 1 11 MET HA 1 11 MET ME . . 4.340 4.028 3.454 4.348 0.008 18 0 "[ . 1 . 2]" 1
104 1 11 MET HA 1 11 MET HG2 . . 3.940 2.902 2.402 3.754 . 0 0 "[ . 1 . 2]" 1
105 1 11 MET HA 1 11 MET QG . . 3.460 2.767 2.337 3.338 . 0 0 "[ . 1 . 2]" 1
106 1 11 MET HA 1 11 MET HG3 . . 3.940 3.589 2.744 3.831 . 0 0 "[ . 1 . 2]" 1
107 1 11 MET QB 1 12 ASP H . . 4.030 2.631 2.163 3.394 . 0 0 "[ . 1 . 2]" 1
108 1 11 MET QB 1 12 ASP QB . . 4.630 3.386 3.209 3.967 . 0 0 "[ . 1 . 2]" 1
109 1 11 MET HB2 1 12 ASP H . . 4.600 2.704 2.197 3.726 . 0 0 "[ . 1 . 2]" 1
110 1 11 MET HB3 1 12 ASP H . . 4.600 3.687 3.227 4.161 . 0 0 "[ . 1 . 2]" 1
111 1 11 MET ME 1 32 PRO HA . . 4.070 3.581 2.060 4.073 0.003 17 0 "[ . 1 . 2]" 1
112 1 11 MET ME 1 32 PRO QD . . 4.580 3.769 2.425 4.531 . 0 0 "[ . 1 . 2]" 1
113 1 11 MET QG 1 31 THR HA . . 4.270 4.053 3.738 4.277 0.007 18 0 "[ . 1 . 2]" 1
114 1 11 MET QG 1 32 PRO QD . . 4.030 3.513 3.147 4.015 . 0 0 "[ . 1 . 2]" 1
115 1 12 ASP H 1 13 ALA H . . 4.720 4.157 3.759 4.442 . 0 0 "[ . 1 . 2]" 1
116 1 12 ASP H 1 30 ARG H . . 4.110 2.867 2.408 3.151 . 0 0 "[ . 1 . 2]" 1
117 1 12 ASP H 1 30 ARG QB . . 4.090 2.375 1.906 4.004 . 0 0 "[ . 1 . 2]" 1
118 1 12 ASP QB 1 30 ARG H . . 3.630 2.741 1.960 3.262 . 0 0 "[ . 1 . 2]" 1
119 1 12 ASP QB 1 30 ARG QB . . 3.010 2.215 1.856 2.937 . 0 0 "[ . 1 . 2]" 1
120 1 12 ASP QB 1 30 ARG QD . . 3.780 2.830 1.749 3.816 0.036 20 0 "[ . 1 . 2]" 1
121 1 12 ASP QB 1 30 ARG QG . . 3.260 2.551 1.868 3.264 0.004 3 0 "[ . 1 . 2]" 1
122 1 12 ASP HB2 1 13 ALA H . . 4.540 4.376 4.041 4.543 0.003 17 0 "[ . 1 . 2]" 1
123 1 12 ASP HB2 1 30 ARG QB . . 3.520 2.578 1.966 3.508 . 0 0 "[ . 1 . 2]" 1
124 1 12 ASP HB3 1 13 ALA H . . 4.540 3.898 3.000 4.465 . 0 0 "[ . 1 . 2]" 1
125 1 12 ASP HB3 1 30 ARG QB . . 3.520 2.892 2.013 3.553 0.033 18 0 "[ . 1 . 2]" 1
126 1 13 ALA H 1 13 ALA MB . . 2.910 2.278 2.136 2.383 . 0 0 "[ . 1 . 2]" 1
127 1 13 ALA H 1 14 PRO HD2 . . 5.230 4.833 4.817 4.840 . 0 0 "[ . 1 . 2]" 1
128 1 13 ALA H 1 90 ALA MB . . 5.400 5.249 5.007 5.404 0.004 18 0 "[ . 1 . 2]" 1
129 1 13 ALA HA 1 14 PRO HD2 . . 3.200 2.263 2.214 2.317 . 0 0 "[ . 1 . 2]" 1
130 1 13 ALA HA 1 14 PRO HD3 . . 3.170 2.261 2.254 2.272 . 0 0 "[ . 1 . 2]" 1
131 1 13 ALA HA 1 14 PRO HG2 . . 4.540 4.402 4.363 4.445 . 0 0 "[ . 1 . 2]" 1
132 1 13 ALA HA 1 14 PRO HG3 . . 4.680 4.397 4.374 4.424 . 0 0 "[ . 1 . 2]" 1
133 1 13 ALA HA 1 90 ALA MB . . 3.910 3.276 3.074 3.491 . 0 0 "[ . 1 . 2]" 1
134 1 13 ALA MB 1 14 PRO HD2 . . 2.930 2.306 2.129 2.484 . 0 0 "[ . 1 . 2]" 1
135 1 13 ALA MB 1 14 PRO HD3 . . 3.580 3.449 3.361 3.513 . 0 0 "[ . 1 . 2]" 1
136 1 13 ALA MB 1 14 PRO HG2 . . 4.030 3.895 3.777 3.993 . 0 0 "[ . 1 . 2]" 1
137 1 13 ALA MB 1 14 PRO HG3 . . 4.780 4.641 4.544 4.718 . 0 0 "[ . 1 . 2]" 1
138 1 13 ALA MB 1 29 CYS HA . . 5.380 4.947 4.657 5.111 . 0 0 "[ . 1 . 2]" 1
139 1 13 ALA MB 1 90 ALA MB . . 2.920 2.415 2.156 2.596 . 0 0 "[ . 1 . 2]" 1
140 1 14 PRO HB2 1 15 ARG H . . 3.720 2.996 2.809 3.445 . 0 0 "[ . 1 . 2]" 1
141 1 14 PRO HB2 1 27 LEU HB2 . . 5.380 5.104 4.781 5.303 . 0 0 "[ . 1 . 2]" 1
142 1 14 PRO HB2 1 27 LEU HB3 . . 5.210 3.419 3.091 3.624 . 0 0 "[ . 1 . 2]" 1
143 1 14 PRO HB2 1 27 LEU MD1 . . 4.570 4.106 3.660 4.511 . 0 0 "[ . 1 . 2]" 1
144 1 14 PRO HB2 1 27 LEU QD . . 3.530 2.202 2.023 2.499 . 0 0 "[ . 1 . 2]" 1
145 1 14 PRO HB2 1 27 LEU MD2 . . 4.570 2.212 2.029 2.540 . 0 0 "[ . 1 . 2]" 1
146 1 14 PRO HB2 1 39 TRP HH2 . . 3.920 3.298 3.085 3.527 . 0 0 "[ . 1 . 2]" 1
147 1 14 PRO HB2 1 39 TRP HZ3 . . 5.080 4.088 3.802 4.445 . 0 0 "[ . 1 . 2]" 1
148 1 14 PRO HB2 1 92 ALA MB . . 2.960 2.214 2.010 2.411 . 0 0 "[ . 1 . 2]" 1
149 1 14 PRO HB3 1 15 ARG H . . 3.960 3.666 3.558 3.941 . 0 0 "[ . 1 . 2]" 1
150 1 14 PRO HB3 1 27 LEU HB2 . . 4.540 4.283 4.055 4.503 . 0 0 "[ . 1 . 2]" 1
151 1 14 PRO HB3 1 27 LEU HB3 . . 3.660 2.557 2.349 2.748 . 0 0 "[ . 1 . 2]" 1
152 1 14 PRO HB3 1 27 LEU MD1 . . 4.490 4.161 3.774 4.469 . 0 0 "[ . 1 . 2]" 1
153 1 14 PRO HB3 1 27 LEU QD . . 3.750 2.645 2.334 2.933 . 0 0 "[ . 1 . 2]" 1
154 1 14 PRO HB3 1 27 LEU MD2 . . 4.490 2.681 2.353 3.057 . 0 0 "[ . 1 . 2]" 1
155 1 14 PRO HB3 1 28 LYS H . . 4.350 3.807 3.363 4.187 . 0 0 "[ . 1 . 2]" 1
156 1 14 PRO HB3 1 39 TRP HH2 . . 3.680 2.422 2.119 2.661 . 0 0 "[ . 1 . 2]" 1
157 1 14 PRO HB3 1 39 TRP HZ2 . . 5.000 4.166 3.857 4.490 . 0 0 "[ . 1 . 2]" 1
158 1 14 PRO HB3 1 39 TRP HZ3 . . 4.880 4.226 3.846 4.754 . 0 0 "[ . 1 . 2]" 1
159 1 14 PRO HB3 1 90 ALA MB . . 5.210 4.582 4.370 4.995 . 0 0 "[ . 1 . 2]" 1
160 1 14 PRO HB3 1 92 ALA MB . . 3.850 3.658 3.456 3.843 . 0 0 "[ . 1 . 2]" 1
161 1 14 PRO HD2 1 29 CYS HA . . 4.970 4.662 4.442 4.893 . 0 0 "[ . 1 . 2]" 1
162 1 14 PRO HD2 1 90 ALA MB . . 3.110 1.910 1.826 2.047 . 0 0 "[ . 1 . 2]" 1
163 1 14 PRO HD2 1 92 ALA MB . . 5.100 4.729 4.591 4.879 . 0 0 "[ . 1 . 2]" 1
164 1 14 PRO HD3 1 29 CYS HA . . 3.920 3.073 2.814 3.330 . 0 0 "[ . 1 . 2]" 1
165 1 14 PRO HD3 1 29 CYS HB2 . . 4.740 2.643 2.345 3.428 . 0 0 "[ . 1 . 2]" 1
166 1 14 PRO HD3 1 29 CYS HB3 . . 4.830 4.179 3.564 4.472 . 0 0 "[ . 1 . 2]" 1
167 1 14 PRO HD3 1 39 TRP HH2 . . 4.800 3.836 3.573 4.159 . 0 0 "[ . 1 . 2]" 1
168 1 14 PRO HD3 1 90 ALA MB . . 3.510 2.978 2.739 3.382 . 0 0 "[ . 1 . 2]" 1
169 1 14 PRO HG2 1 39 TRP HH2 . . 4.330 3.797 3.411 4.212 . 0 0 "[ . 1 . 2]" 1
170 1 14 PRO HG2 1 39 TRP HZ3 . . 5.500 4.342 4.153 4.614 . 0 0 "[ . 1 . 2]" 1
171 1 14 PRO HG2 1 79 CYS H . . 4.860 4.611 4.362 4.859 . 0 0 "[ . 1 . 2]" 1
172 1 14 PRO HG2 1 90 ALA MB . . 3.660 2.452 2.151 2.730 . 0 0 "[ . 1 . 2]" 1
173 1 14 PRO HG2 1 91 SER HA . . 4.670 4.184 3.830 4.485 . 0 0 "[ . 1 . 2]" 1
174 1 14 PRO HG2 1 92 ALA MB . . 3.370 2.785 2.589 2.943 . 0 0 "[ . 1 . 2]" 1
175 1 14 PRO HG3 1 27 LEU HB3 . . 4.480 3.983 3.726 4.221 . 0 0 "[ . 1 . 2]" 1
176 1 14 PRO HG3 1 29 CYS HB2 . . 4.750 3.311 2.886 4.521 . 0 0 "[ . 1 . 2]" 1
177 1 14 PRO HG3 1 29 CYS HB3 . . 4.890 4.670 4.089 4.889 . 0 0 "[ . 1 . 2]" 1
178 1 14 PRO HG3 1 39 TRP HH2 . . 3.800 2.292 2.000 2.768 . 0 0 "[ . 1 . 2]" 1
179 1 14 PRO HG3 1 39 TRP HZ2 . . 5.410 4.049 3.479 4.481 . 0 0 "[ . 1 . 2]" 1
180 1 14 PRO HG3 1 39 TRP HZ3 . . 4.760 3.438 3.175 3.761 . 0 0 "[ . 1 . 2]" 1
181 1 14 PRO HG3 1 79 CYS H . . 5.010 4.221 3.937 4.650 . 0 0 "[ . 1 . 2]" 1
182 1 14 PRO HG3 1 79 CYS QB . . 4.290 2.896 2.663 3.103 . 0 0 "[ . 1 . 2]" 1
183 1 14 PRO HG3 1 90 ALA MB . . 3.900 2.875 2.534 3.462 . 0 0 "[ . 1 . 2]" 1
184 1 14 PRO HG3 1 91 SER HA . . 5.500 4.969 4.523 5.349 . 0 0 "[ . 1 . 2]" 1
185 1 14 PRO HG3 1 92 ALA MB . . 3.890 3.664 3.421 3.884 . 0 0 "[ . 1 . 2]" 1
186 1 15 ARG H 1 15 ARG QB . . 2.970 2.653 2.480 2.975 0.005 10 0 "[ . 1 . 2]" 1
187 1 15 ARG H 1 15 ARG QD . . 4.890 4.701 4.352 4.891 0.001 5 0 "[ . 1 . 2]" 1
188 1 15 ARG H 1 15 ARG QG . . 4.340 3.866 2.340 4.289 . 0 0 "[ . 1 . 2]" 1
189 1 15 ARG H 1 27 LEU QD . . 3.910 3.380 3.007 3.704 . 0 0 "[ . 1 . 2]" 1
190 1 15 ARG H 1 28 LYS H . . 4.170 3.902 3.329 4.171 0.001 9 0 "[ . 1 . 2]" 1
191 1 15 ARG H 1 92 ALA MB . . 3.970 3.396 3.089 3.842 . 0 0 "[ . 1 . 2]" 1
192 1 15 ARG QB 1 15 ARG QD . . 3.100 2.164 2.064 2.500 . 0 0 "[ . 1 . 2]" 1
193 1 15 ARG QB 1 16 ASP H . . 3.490 3.222 2.305 3.495 0.005 4 0 "[ . 1 . 2]" 1
194 1 15 ARG HB2 1 15 ARG QD . . 3.680 2.543 2.116 3.480 . 0 0 "[ . 1 . 2]" 1
195 1 15 ARG HB2 1 16 ASP H . . 4.240 3.806 2.326 4.210 . 0 0 "[ . 1 . 2]" 1
196 1 15 ARG HB3 1 15 ARG QD . . 3.680 2.468 2.096 2.898 . 0 0 "[ . 1 . 2]" 1
197 1 15 ARG HB3 1 16 ASP H . . 4.240 3.652 2.571 3.928 . 0 0 "[ . 1 . 2]" 1
198 1 15 ARG QD 1 16 ASP H . . 4.530 4.015 2.226 4.494 . 0 0 "[ . 1 . 2]" 1
199 1 15 ARG QG 1 16 ASP H . . 3.740 2.429 1.887 3.362 . 0 0 "[ . 1 . 2]" 1
200 1 15 ARG QG 1 16 ASP QB . . 5.030 3.712 2.860 5.028 . 0 0 "[ . 1 . 2]" 1
201 1 16 ASP H 1 16 ASP HB2 . . 3.700 3.272 2.198 3.623 . 0 0 "[ . 1 . 2]" 1
202 1 16 ASP H 1 16 ASP QB . . 3.130 2.371 2.147 2.820 . 0 0 "[ . 1 . 2]" 1
203 1 16 ASP H 1 16 ASP HB3 . . 3.700 2.581 2.186 3.591 . 0 0 "[ . 1 . 2]" 1
204 1 16 ASP H 1 92 ALA MB . . 3.870 3.419 3.118 3.724 . 0 0 "[ . 1 . 2]" 1
205 1 16 ASP H 1 93 TYR H . . 4.860 3.725 3.405 4.127 . 0 0 "[ . 1 . 2]" 1
206 1 16 ASP HA 1 93 TYR QB . . 4.760 3.363 3.122 3.610 . 0 0 "[ . 1 . 2]" 1
207 1 16 ASP QB 1 17 LEU H . . 3.480 3.164 2.761 3.485 0.005 3 0 "[ . 1 . 2]" 1
208 1 16 ASP QB 1 92 ALA MB . . 4.610 4.204 3.846 4.609 . 0 0 "[ . 1 . 2]" 1
209 1 16 ASP QB 1 93 TYR H . . 3.950 2.924 2.016 3.726 . 0 0 "[ . 1 . 2]" 1
210 1 16 ASP HB2 1 92 ALA MB . . 5.270 4.880 4.370 5.250 . 0 0 "[ . 1 . 2]" 1
211 1 16 ASP HB3 1 92 ALA MB . . 5.270 4.650 4.039 5.238 . 0 0 "[ . 1 . 2]" 1
212 1 17 LEU H 1 17 LEU HB2 . . 4.000 3.277 3.129 3.400 . 0 0 "[ . 1 . 2]" 1
213 1 17 LEU H 1 17 LEU QB . . 3.250 2.509 2.356 2.608 . 0 0 "[ . 1 . 2]" 1
214 1 17 LEU H 1 17 LEU HB3 . . 4.000 2.606 2.432 2.709 . 0 0 "[ . 1 . 2]" 1
215 1 17 LEU H 1 17 LEU MD1 . . 4.630 4.464 4.359 4.561 . 0 0 "[ . 1 . 2]" 1
216 1 17 LEU H 1 17 LEU MD2 . . 4.630 4.388 4.200 4.561 . 0 0 "[ . 1 . 2]" 1
217 1 17 LEU H 1 17 LEU HG . . 4.730 4.339 4.263 4.418 . 0 0 "[ . 1 . 2]" 1
218 1 17 LEU H 1 27 LEU QD . . 4.410 4.250 4.024 4.402 . 0 0 "[ . 1 . 2]" 1
219 1 17 LEU H 1 92 ALA MB . . 4.370 4.061 3.697 4.334 . 0 0 "[ . 1 . 2]" 1
220 1 17 LEU H 1 93 TYR H . . 4.310 3.980 3.643 4.259 . 0 0 "[ . 1 . 2]" 1
221 1 17 LEU H 1 94 LEU HA . . 3.550 2.962 2.713 3.210 . 0 0 "[ . 1 . 2]" 1
222 1 17 LEU H 1 94 LEU HB2 . . 5.060 4.359 4.033 4.739 . 0 0 "[ . 1 . 2]" 1
223 1 17 LEU H 1 94 LEU MD1 . . 4.230 3.973 3.634 4.213 . 0 0 "[ . 1 . 2]" 1
224 1 17 LEU H 1 95 ASN H . . 4.300 4.108 3.774 4.299 . 0 0 "[ . 1 . 2]" 1
225 1 17 LEU QB 1 17 LEU QD . . 2.770 1.863 1.808 1.945 . 0 0 "[ . 1 . 2]" 1
226 1 17 LEU QB 1 18 ASN H . . 3.900 3.609 3.442 3.728 . 0 0 "[ . 1 . 2]" 1
227 1 17 LEU QB 1 94 LEU HA . . 4.150 3.440 3.187 3.775 . 0 0 "[ . 1 . 2]" 1
228 1 17 LEU QB 1 94 LEU MD1 . . 3.510 2.716 2.580 2.836 . 0 0 "[ . 1 . 2]" 1
229 1 17 LEU HB2 1 18 ASN H . . 4.570 3.987 3.830 4.140 . 0 0 "[ . 1 . 2]" 1
230 1 17 LEU HB2 1 94 LEU MD1 . . 4.240 4.191 4.024 4.241 0.001 18 0 "[ . 1 . 2]" 1
231 1 17 LEU HB3 1 18 ASN H . . 4.570 4.124 3.841 4.268 . 0 0 "[ . 1 . 2]" 1
232 1 17 LEU HB3 1 94 LEU MD1 . . 4.240 2.752 2.611 2.881 . 0 0 "[ . 1 . 2]" 1
233 1 17 LEU QD 1 18 ASN H . . 3.160 2.434 1.943 2.924 . 0 0 "[ . 1 . 2]" 1
234 1 17 LEU QD 1 18 ASN HA . . 4.750 4.178 4.052 4.298 . 0 0 "[ . 1 . 2]" 1
235 1 17 LEU QD 1 18 ASN QB . . 4.900 4.440 3.940 4.704 . 0 0 "[ . 1 . 2]" 1
236 1 17 LEU QD 1 19 ILE H . . 4.530 4.084 3.850 4.258 . 0 0 "[ . 1 . 2]" 1
237 1 17 LEU QD 1 19 ILE HB . . 3.360 2.842 2.537 3.019 . 0 0 "[ . 1 . 2]" 1
238 1 17 LEU QD 1 25 ALA HA . . 3.880 3.078 2.802 3.286 . 0 0 "[ . 1 . 2]" 1
239 1 17 LEU QD 1 26 GLU H . . 3.400 2.359 2.023 2.619 . 0 0 "[ . 1 . 2]" 1
240 1 17 LEU QD 1 66 PHE QD . . 5.440 4.883 4.587 5.194 . 0 0 "[ . 1 . 2]" 1
241 1 17 LEU QD 1 94 LEU HA . . 4.670 4.284 3.894 4.658 . 0 0 "[ . 1 . 2]" 1
242 1 17 LEU QD 1 94 LEU MD1 . . 2.810 2.332 1.932 2.721 . 0 0 "[ . 1 . 2]" 1
243 1 17 LEU QD 1 94 LEU MD2 . . 4.530 4.164 3.761 4.502 . 0 0 "[ . 1 . 2]" 1
244 1 17 LEU MD1 1 19 ILE H . . 5.250 4.737 4.449 4.923 . 0 0 "[ . 1 . 2]" 1
245 1 17 LEU MD1 1 19 ILE HB . . 3.980 3.525 3.204 3.866 . 0 0 "[ . 1 . 2]" 1
246 1 17 LEU MD1 1 26 GLU H . . 4.380 3.914 3.325 4.365 . 0 0 "[ . 1 . 2]" 1
247 1 17 LEU MD2 1 19 ILE H . . 5.250 4.484 4.057 4.793 . 0 0 "[ . 1 . 2]" 1
248 1 17 LEU MD2 1 19 ILE HB . . 3.980 3.029 2.586 3.442 . 0 0 "[ . 1 . 2]" 1
249 1 17 LEU MD2 1 26 GLU H . . 4.380 2.380 2.037 2.652 . 0 0 "[ . 1 . 2]" 1
250 1 17 LEU HG 1 18 ASN H . . 4.040 2.721 2.307 3.121 . 0 0 "[ . 1 . 2]" 1
251 1 17 LEU HG 1 18 ASN HA . . 4.760 3.711 3.501 3.919 . 0 0 "[ . 1 . 2]" 1
252 1 17 LEU HG 1 19 ILE H . . 3.940 3.721 3.550 3.876 . 0 0 "[ . 1 . 2]" 1
253 1 17 LEU HG 1 19 ILE HB . . 3.500 3.162 2.902 3.363 . 0 0 "[ . 1 . 2]" 1
254 1 17 LEU HG 1 19 ILE MG . . 4.040 3.307 2.999 3.562 . 0 0 "[ . 1 . 2]" 1
255 1 17 LEU HG 1 94 LEU MD1 . . 3.310 3.042 2.711 3.253 . 0 0 "[ . 1 . 2]" 1
256 1 18 ASN H 1 18 ASN QB . . 3.310 2.918 2.398 3.142 . 0 0 "[ . 1 . 2]" 1
257 1 18 ASN H 1 18 ASN QD . . 4.510 3.510 2.453 4.312 . 0 0 "[ . 1 . 2]" 1
258 1 18 ASN HA 1 19 ILE H . . 2.720 2.152 2.140 2.160 . 0 0 "[ . 1 . 2]" 1
259 1 18 ASN HA 1 19 ILE HB . . 4.810 4.695 4.611 4.813 0.003 10 0 "[ . 1 . 2]" 1
260 1 18 ASN HA 1 19 ILE MG . . 4.150 3.810 3.616 3.962 . 0 0 "[ . 1 . 2]" 1
261 1 18 ASN HA 1 94 LEU HA . . 4.360 4.215 3.990 4.359 . 0 0 "[ . 1 . 2]" 1
262 1 18 ASN HA 1 94 LEU MD1 . . 4.600 3.926 3.680 4.137 . 0 0 "[ . 1 . 2]" 1
263 1 18 ASN HA 1 94 LEU HG . . 5.500 5.064 4.796 5.260 . 0 0 "[ . 1 . 2]" 1
264 1 18 ASN HA 1 95 ASN H . . 3.680 2.661 2.497 2.776 . 0 0 "[ . 1 . 2]" 1
265 1 18 ASN HA 1 95 ASN HA . . 4.860 4.743 4.378 4.862 0.002 9 0 "[ . 1 . 2]" 1
266 1 18 ASN HA 1 95 ASN HB2 . . 4.080 3.872 3.644 4.077 . 0 0 "[ . 1 . 2]" 1
267 1 18 ASN HA 1 95 ASN HB3 . . 3.420 2.344 2.000 2.562 . 0 0 "[ . 1 . 2]" 1
268 1 18 ASN HA 1 95 ASN HD21 . . 4.780 4.293 3.638 4.781 0.001 10 0 "[ . 1 . 2]" 1
269 1 18 ASN QB 1 19 ILE H . . 3.830 3.517 3.388 3.832 0.002 8 0 "[ . 1 . 2]" 1
270 1 18 ASN QB 1 95 ASN HB3 . . 4.480 2.785 2.264 3.022 . 0 0 "[ . 1 . 2]" 1
271 1 19 ILE H 1 19 ILE HB . . 3.560 3.192 3.068 3.294 . 0 0 "[ . 1 . 2]" 1
272 1 19 ILE H 1 19 ILE MD . . 4.800 4.745 4.683 4.797 . 0 0 "[ . 1 . 2]" 1
273 1 19 ILE H 1 19 ILE HG12 . . 4.680 4.535 4.399 4.636 . 0 0 "[ . 1 . 2]" 1
274 1 19 ILE H 1 19 ILE HG13 . . 4.680 4.619 4.579 4.678 . 0 0 "[ . 1 . 2]" 1
275 1 19 ILE H 1 19 ILE MG . . 3.060 2.137 1.960 2.375 . 0 0 "[ . 1 . 2]" 1
276 1 19 ILE H 1 20 SER H . . 4.490 4.447 4.422 4.479 . 0 0 "[ . 1 . 2]" 1
277 1 19 ILE H 1 25 ALA MB . . 5.500 5.065 4.833 5.235 . 0 0 "[ . 1 . 2]" 1
278 1 19 ILE H 1 69 VAL MG2 . . 5.320 4.605 4.323 4.899 . 0 0 "[ . 1 . 2]" 1
279 1 19 ILE H 1 94 LEU MD1 . . 4.100 3.320 3.072 3.592 . 0 0 "[ . 1 . 2]" 1
280 1 19 ILE H 1 94 LEU HG . . 5.210 4.409 4.187 4.556 . 0 0 "[ . 1 . 2]" 1
281 1 19 ILE H 1 95 ASN H . . 4.140 3.484 3.151 3.710 . 0 0 "[ . 1 . 2]" 1
282 1 19 ILE H 1 95 ASN HB2 . . 5.430 5.115 4.758 5.409 . 0 0 "[ . 1 . 2]" 1
283 1 19 ILE H 1 95 ASN HB3 . . 4.320 3.533 3.099 3.864 . 0 0 "[ . 1 . 2]" 1
284 1 19 ILE H 1 96 VAL HA . . 4.020 3.819 3.645 4.013 . 0 0 "[ . 1 . 2]" 1
285 1 19 ILE H 1 96 VAL MG2 . . 4.430 4.174 4.012 4.293 . 0 0 "[ . 1 . 2]" 1
286 1 19 ILE HA 1 19 ILE MD . . 3.700 3.626 3.513 3.701 0.001 16 0 "[ . 1 . 2]" 1
287 1 19 ILE HA 1 19 ILE HG12 . . 3.840 3.286 3.159 3.391 . 0 0 "[ . 1 . 2]" 1
288 1 19 ILE HA 1 19 ILE HG13 . . 3.310 2.348 2.246 2.453 . 0 0 "[ . 1 . 2]" 1
289 1 19 ILE HA 1 19 ILE MG . . 3.400 3.193 3.181 3.202 . 0 0 "[ . 1 . 2]" 1
290 1 19 ILE HA 1 20 SER H . . 2.750 2.337 2.261 2.415 . 0 0 "[ . 1 . 2]" 1
291 1 19 ILE HB 1 19 ILE MD . . 3.220 2.229 2.134 2.325 . 0 0 "[ . 1 . 2]" 1
292 1 19 ILE HB 1 20 SER H . . 3.950 3.853 3.777 3.926 . 0 0 "[ . 1 . 2]" 1
293 1 19 ILE HB 1 25 ALA MB . . 3.700 3.144 2.857 3.477 . 0 0 "[ . 1 . 2]" 1
294 1 19 ILE HB 1 69 VAL MG1 . . 5.070 4.698 4.431 5.003 . 0 0 "[ . 1 . 2]" 1
295 1 19 ILE HB 1 69 VAL MG2 . . 5.080 4.274 3.983 4.494 . 0 0 "[ . 1 . 2]" 1
296 1 19 ILE HB 1 94 LEU MD1 . . 4.470 3.673 3.512 3.856 . 0 0 "[ . 1 . 2]" 1
297 1 19 ILE HB 1 96 VAL MG2 . . 5.500 5.428 5.246 5.505 0.005 5 0 "[ . 1 . 2]" 1
298 1 19 ILE MD 1 19 ILE MG . . 2.960 2.289 2.075 2.431 . 0 0 "[ . 1 . 2]" 1
299 1 19 ILE MD 1 20 SER H . . 3.740 3.592 3.457 3.730 . 0 0 "[ . 1 . 2]" 1
300 1 19 ILE MD 1 23 ARG H . . 4.300 3.856 3.476 4.252 . 0 0 "[ . 1 . 2]" 1
301 1 19 ILE MD 1 23 ARG HA . . 4.470 4.000 3.777 4.256 . 0 0 "[ . 1 . 2]" 1
302 1 19 ILE MD 1 23 ARG HB2 . . 3.360 2.219 1.997 2.447 . 0 0 "[ . 1 . 2]" 1
303 1 19 ILE MD 1 23 ARG HB3 . . 3.450 2.358 2.125 2.729 . 0 0 "[ . 1 . 2]" 1
304 1 19 ILE MD 1 23 ARG QD . . 3.730 3.262 3.078 3.497 . 0 0 "[ . 1 . 2]" 1
305 1 19 ILE MD 1 23 ARG HG3 . . 4.330 4.128 3.922 4.300 . 0 0 "[ . 1 . 2]" 1
306 1 19 ILE MD 1 24 MET H . . 4.420 3.119 2.921 3.385 . 0 0 "[ . 1 . 2]" 1
307 1 19 ILE MD 1 24 MET HA . . 4.570 3.702 3.470 3.899 . 0 0 "[ . 1 . 2]" 1
308 1 19 ILE MD 1 25 ALA H . . 4.760 3.496 3.278 3.825 . 0 0 "[ . 1 . 2]" 1
309 1 19 ILE MD 1 25 ALA HA . . 3.120 2.537 2.306 2.769 . 0 0 "[ . 1 . 2]" 1
310 1 19 ILE MD 1 26 GLU H . . 4.650 4.248 4.005 4.419 . 0 0 "[ . 1 . 2]" 1
311 1 19 ILE MD 1 69 VAL MG1 . . 3.570 3.272 3.029 3.499 . 0 0 "[ . 1 . 2]" 1
312 1 19 ILE MD 1 94 LEU MD1 . . 4.200 4.003 3.871 4.144 . 0 0 "[ . 1 . 2]" 1
313 1 19 ILE HG12 1 19 ILE MG . . 3.000 2.195 2.044 2.345 . 0 0 "[ . 1 . 2]" 1
314 1 19 ILE HG12 1 20 SER H . . 3.520 2.387 1.957 2.809 . 0 0 "[ . 1 . 2]" 1
315 1 19 ILE HG12 1 23 ARG H . . 4.610 4.047 3.865 4.429 . 0 0 "[ . 1 . 2]" 1
316 1 19 ILE HG12 1 23 ARG HB2 . . 3.980 2.159 1.998 2.390 . 0 0 "[ . 1 . 2]" 1
317 1 19 ILE HG12 1 23 ARG HB3 . . 4.450 3.493 3.208 3.784 . 0 0 "[ . 1 . 2]" 1
318 1 19 ILE HG12 1 23 ARG QD . . 4.320 3.439 3.180 3.644 . 0 0 "[ . 1 . 2]" 1
319 1 19 ILE HG12 1 23 ARG HG3 . . 4.310 3.754 3.554 3.943 . 0 0 "[ . 1 . 2]" 1
320 1 19 ILE HG12 1 69 VAL MG1 . . 4.470 4.156 3.896 4.309 . 0 0 "[ . 1 . 2]" 1
321 1 19 ILE HG12 1 69 VAL MG2 . . 3.930 2.739 2.484 2.955 . 0 0 "[ . 1 . 2]" 1
322 1 19 ILE HG12 1 94 LEU MD1 . . 5.000 4.806 4.609 4.929 . 0 0 "[ . 1 . 2]" 1
323 1 19 ILE HG12 1 96 VAL MG2 . . 5.090 4.877 4.573 5.086 . 0 0 "[ . 1 . 2]" 1
324 1 19 ILE HG13 1 19 ILE MG . . 3.510 3.167 3.127 3.194 . 0 0 "[ . 1 . 2]" 1
325 1 19 ILE HG13 1 20 SER H . . 3.200 1.994 1.899 2.207 . 0 0 "[ . 1 . 2]" 1
326 1 19 ILE HG13 1 20 SER QB . . 4.470 3.771 3.600 3.953 . 0 0 "[ . 1 . 2]" 1
327 1 19 ILE HG13 1 23 ARG HB2 . . 4.170 2.946 2.611 3.337 . 0 0 "[ . 1 . 2]" 1
328 1 19 ILE HG13 1 23 ARG HB3 . . 4.500 3.513 3.189 3.933 . 0 0 "[ . 1 . 2]" 1
329 1 19 ILE HG13 1 23 ARG QD . . 4.050 2.887 2.674 3.246 . 0 0 "[ . 1 . 2]" 1
330 1 19 ILE HG13 1 69 VAL MG1 . . 5.500 5.376 5.230 5.505 0.005 3 0 "[ . 1 . 2]" 1
331 1 19 ILE HG13 1 69 VAL MG2 . . 4.600 4.190 3.940 4.371 . 0 0 "[ . 1 . 2]" 1
332 1 19 ILE HG13 1 94 LEU MD1 . . 5.500 5.453 5.376 5.501 0.001 16 0 "[ . 1 . 2]" 1
333 1 19 ILE MG 1 20 SER H . . 3.820 3.539 3.287 3.801 . 0 0 "[ . 1 . 2]" 1
334 1 19 ILE MG 1 23 ARG H . . 4.930 4.616 4.427 4.886 . 0 0 "[ . 1 . 2]" 1
335 1 19 ILE MG 1 23 ARG HB2 . . 4.390 3.797 3.635 4.001 . 0 0 "[ . 1 . 2]" 1
336 1 19 ILE MG 1 23 ARG HB3 . . 5.170 4.935 4.679 5.136 . 0 0 "[ . 1 . 2]" 1
337 1 19 ILE MG 1 23 ARG QD . . 5.130 4.908 4.715 5.049 . 0 0 "[ . 1 . 2]" 1
338 1 19 ILE MG 1 25 ALA H . . 5.400 4.821 4.641 5.005 . 0 0 "[ . 1 . 2]" 1
339 1 19 ILE MG 1 25 ALA MB . . 3.160 2.153 1.906 2.349 . 0 0 "[ . 1 . 2]" 1
340 1 19 ILE MG 1 69 VAL H . . 5.500 4.338 4.190 4.632 . 0 0 "[ . 1 . 2]" 1
341 1 19 ILE MG 1 69 VAL HB . . 4.670 3.583 3.315 3.826 . 0 0 "[ . 1 . 2]" 1
342 1 19 ILE MG 1 69 VAL MG1 . . 3.170 2.469 2.139 2.741 . 0 0 "[ . 1 . 2]" 1
343 1 19 ILE MG 1 94 LEU MD1 . . 2.890 1.894 1.795 1.990 . 0 0 "[ . 1 . 2]" 1
344 1 19 ILE MG 1 94 LEU MD2 . . 3.830 3.379 3.167 3.529 . 0 0 "[ . 1 . 2]" 1
345 1 19 ILE MG 1 94 LEU HG . . 3.490 3.319 3.186 3.492 0.002 5 0 "[ . 1 . 2]" 1
346 1 19 ILE MG 1 95 ASN H . . 4.580 4.092 3.490 4.459 . 0 0 "[ . 1 . 2]" 1
347 1 19 ILE MG 1 96 VAL HA . . 3.520 3.303 3.069 3.476 . 0 0 "[ . 1 . 2]" 1
348 1 20 SER H 1 20 SER HB2 . . 3.620 2.426 2.243 2.620 . 0 0 "[ . 1 . 2]" 1
349 1 20 SER H 1 20 SER QB . . 3.000 2.342 2.219 2.486 . 0 0 "[ . 1 . 2]" 1
350 1 20 SER H 1 20 SER HB3 . . 3.620 3.362 2.593 3.632 0.012 13 0 "[ . 1 . 2]" 1
351 1 20 SER H 1 21 GLU H . . 4.640 4.589 4.564 4.615 . 0 0 "[ . 1 . 2]" 1
352 1 20 SER H 1 23 ARG QD . . 4.070 2.733 2.468 3.134 . 0 0 "[ . 1 . 2]" 1
353 1 20 SER H 1 23 ARG HG3 . . 4.450 3.786 3.467 4.162 . 0 0 "[ . 1 . 2]" 1
354 1 20 SER HA 1 97 SER H . . 3.130 2.248 2.052 2.433 . 0 0 "[ . 1 . 2]" 1
355 1 20 SER QB 1 21 GLU H . . 3.260 2.608 2.265 3.196 . 0 0 "[ . 1 . 2]" 1
356 1 20 SER QB 1 21 GLU QB . . 4.730 4.131 3.888 4.654 . 0 0 "[ . 1 . 2]" 1
357 1 20 SER QB 1 23 ARG HB2 . . 4.560 3.655 3.425 3.885 . 0 0 "[ . 1 . 2]" 1
358 1 20 SER QB 1 23 ARG QD . . 3.640 2.239 2.035 2.586 . 0 0 "[ . 1 . 2]" 1
359 1 20 SER QB 1 23 ARG HG2 . . 3.980 3.764 3.497 3.928 . 0 0 "[ . 1 . 2]" 1
360 1 20 SER QB 1 23 ARG HG3 . . 3.590 2.420 2.147 2.649 . 0 0 "[ . 1 . 2]" 1
361 1 20 SER QB 1 97 SER H . . 4.450 4.248 3.941 4.417 . 0 0 "[ . 1 . 2]" 1
362 1 20 SER HB2 1 21 GLU H . . 3.880 3.751 3.428 3.880 . 0 0 "[ . 1 . 2]" 1
363 1 20 SER HB2 1 23 ARG QD . . 4.240 2.473 2.044 3.418 . 0 0 "[ . 1 . 2]" 1
364 1 20 SER HB2 1 23 ARG HG3 . . 4.180 2.911 2.175 4.163 . 0 0 "[ . 1 . 2]" 1
365 1 20 SER HB3 1 21 GLU H . . 3.880 2.680 2.293 3.425 . 0 0 "[ . 1 . 2]" 1
366 1 20 SER HB3 1 23 ARG QD . . 4.240 3.467 2.252 4.008 . 0 0 "[ . 1 . 2]" 1
367 1 20 SER HB3 1 23 ARG HG3 . . 4.180 3.108 2.236 3.735 . 0 0 "[ . 1 . 2]" 1
368 1 21 GLU H 1 21 GLU HB2 . . 3.190 2.781 2.655 2.975 . 0 0 "[ . 1 . 2]" 1
369 1 21 GLU H 1 21 GLU HB3 . . 3.190 2.333 2.180 2.423 . 0 0 "[ . 1 . 2]" 1
370 1 21 GLU H 1 21 GLU HG2 . . 4.850 4.314 4.062 4.461 . 0 0 "[ . 1 . 2]" 1
371 1 21 GLU H 1 21 GLU QG . . 4.150 3.954 3.791 4.052 . 0 0 "[ . 1 . 2]" 1
372 1 21 GLU H 1 21 GLU HG3 . . 4.850 4.598 4.540 4.653 . 0 0 "[ . 1 . 2]" 1
373 1 21 GLU H 1 22 GLY H . . 4.610 4.574 4.492 4.626 0.016 20 0 "[ . 1 . 2]" 1
374 1 21 GLU H 1 69 VAL MG2 . . 4.420 4.213 3.988 4.371 . 0 0 "[ . 1 . 2]" 1
375 1 21 GLU H 1 71 LEU QD . . 4.260 4.054 3.507 4.249 . 0 0 "[ . 1 . 2]" 1
376 1 21 GLU H 1 96 VAL MG1 . . 3.300 2.955 2.615 3.179 . 0 0 "[ . 1 . 2]" 1
377 1 21 GLU H 1 97 SER H . . 3.690 3.173 2.833 3.508 . 0 0 "[ . 1 . 2]" 1
378 1 21 GLU H 1 98 SER HA . . 3.790 3.588 3.295 3.756 . 0 0 "[ . 1 . 2]" 1
379 1 21 GLU HA 1 21 GLU HG2 . . 3.630 2.979 2.565 3.457 . 0 0 "[ . 1 . 2]" 1
380 1 21 GLU HA 1 21 GLU HG3 . . 3.630 3.027 2.762 3.641 0.011 3 0 "[ . 1 . 2]" 1
381 1 21 GLU HA 1 22 GLY H . . 2.850 2.189 2.144 2.268 . 0 0 "[ . 1 . 2]" 1
382 1 21 GLU HA 1 22 GLY HA3 . . 4.620 4.443 4.396 4.508 . 0 0 "[ . 1 . 2]" 1
383 1 21 GLU HA 1 23 ARG H . . 4.140 3.647 3.384 3.813 . 0 0 "[ . 1 . 2]" 1
384 1 21 GLU HA 1 69 VAL MG1 . . 5.120 4.940 4.673 5.107 . 0 0 "[ . 1 . 2]" 1
385 1 21 GLU HA 1 69 VAL MG2 . . 3.000 2.268 1.960 2.451 . 0 0 "[ . 1 . 2]" 1
386 1 21 GLU HA 1 70 LEU HA . . 4.580 3.512 3.252 3.817 . 0 0 "[ . 1 . 2]" 1
387 1 21 GLU HA 1 71 LEU QD . . 4.710 4.359 3.898 4.654 . 0 0 "[ . 1 . 2]" 1
388 1 21 GLU HA 1 96 VAL MG1 . . 3.150 2.139 1.988 2.411 . 0 0 "[ . 1 . 2]" 1
389 1 21 GLU HA 1 96 VAL MG2 . . 4.980 3.989 3.671 4.338 . 0 0 "[ . 1 . 2]" 1
390 1 21 GLU QB 1 22 GLY H . . 3.840 3.654 3.499 3.818 . 0 0 "[ . 1 . 2]" 1
391 1 21 GLU QB 1 71 LEU H . . 4.500 3.550 2.955 3.756 . 0 0 "[ . 1 . 2]" 1
392 1 21 GLU QB 1 71 LEU HA . . 5.340 4.063 3.611 4.388 . 0 0 "[ . 1 . 2]" 1
393 1 21 GLU QB 1 71 LEU QD . . 3.510 2.516 2.070 2.810 . 0 0 "[ . 1 . 2]" 1
394 1 21 GLU QB 1 99 GLY H . . 4.330 2.998 2.105 3.879 . 0 0 "[ . 1 . 2]" 1
395 1 21 GLU HB2 1 22 GLY H . . 4.380 4.020 3.868 4.222 . 0 0 "[ . 1 . 2]" 1
396 1 21 GLU HB2 1 70 LEU HA . . 4.960 3.517 2.880 3.971 . 0 0 "[ . 1 . 2]" 1
397 1 21 GLU HB2 1 71 LEU H . . 5.120 3.635 3.004 3.864 . 0 0 "[ . 1 . 2]" 1
398 1 21 GLU HB2 1 71 LEU MD1 . . 4.910 4.214 3.956 4.390 . 0 0 "[ . 1 . 2]" 1
399 1 21 GLU HB2 1 71 LEU MD2 . . 4.910 2.625 2.112 3.034 . 0 0 "[ . 1 . 2]" 1
400 1 21 GLU HB2 1 96 VAL MG1 . . 3.710 2.033 1.865 2.355 . 0 0 "[ . 1 . 2]" 1
401 1 21 GLU HB2 1 98 SER HA . . 3.780 3.082 2.716 3.721 . 0 0 "[ . 1 . 2]" 1
402 1 21 GLU HB3 1 22 GLY H . . 4.380 4.201 3.993 4.380 0.000 4 0 "[ . 1 . 2]" 1
403 1 21 GLU HB3 1 70 LEU HA . . 4.960 4.733 4.326 4.957 . 0 0 "[ . 1 . 2]" 1
404 1 21 GLU HB3 1 71 LEU H . . 5.120 4.986 4.396 5.127 0.007 3 0 "[ . 1 . 2]" 1
405 1 21 GLU HB3 1 71 LEU MD1 . . 4.910 4.549 4.058 4.810 . 0 0 "[ . 1 . 2]" 1
406 1 21 GLU HB3 1 71 LEU MD2 . . 4.910 3.561 2.847 4.028 . 0 0 "[ . 1 . 2]" 1
407 1 21 GLU HB3 1 96 VAL MG1 . . 3.710 3.337 2.897 3.711 0.001 7 0 "[ . 1 . 2]" 1
408 1 21 GLU HB3 1 98 SER HA . . 3.780 2.244 2.004 2.479 . 0 0 "[ . 1 . 2]" 1
409 1 21 GLU QG 1 22 GLY HA2 . . 4.640 3.599 3.458 3.735 . 0 0 "[ . 1 . 2]" 1
410 1 21 GLU QG 1 69 VAL MG2 . . 4.870 3.855 3.533 4.117 . 0 0 "[ . 1 . 2]" 1
411 1 21 GLU QG 1 70 LEU HA . . 3.230 2.096 1.980 2.305 . 0 0 "[ . 1 . 2]" 1
412 1 21 GLU QG 1 70 LEU HB3 . . 4.450 3.606 3.342 3.850 . 0 0 "[ . 1 . 2]" 1
413 1 21 GLU QG 1 70 LEU QD . . 3.600 2.943 2.323 3.613 0.013 7 0 "[ . 1 . 2]" 1
414 1 21 GLU QG 1 71 LEU H . . 3.730 2.932 2.476 3.327 . 0 0 "[ . 1 . 2]" 1
415 1 21 GLU QG 1 71 LEU QD . . 4.010 3.555 2.921 3.982 . 0 0 "[ . 1 . 2]" 1
416 1 21 GLU QG 1 71 LEU HG . . 4.700 3.219 2.481 3.727 . 0 0 "[ . 1 . 2]" 1
417 1 21 GLU QG 1 96 VAL MG1 . . 3.680 2.977 2.625 3.313 . 0 0 "[ . 1 . 2]" 1
418 1 21 GLU QG 1 98 SER HA . . 4.070 3.873 3.545 4.073 0.003 7 0 "[ . 1 . 2]" 1
419 1 21 GLU HG2 1 22 GLY H . . 3.870 2.716 2.038 3.480 . 0 0 "[ . 1 . 2]" 1
420 1 21 GLU HG2 1 22 GLY HA3 . . 5.060 3.371 3.186 3.802 . 0 0 "[ . 1 . 2]" 1
421 1 21 GLU HG2 1 70 LEU HA . . 3.990 3.323 2.311 3.964 . 0 0 "[ . 1 . 2]" 1
422 1 21 GLU HG2 1 71 LEU MD1 . . 5.500 5.349 5.089 5.491 . 0 0 "[ . 1 . 2]" 1
423 1 21 GLU HG2 1 71 LEU MD2 . . 5.500 4.899 4.178 5.391 . 0 0 "[ . 1 . 2]" 1
424 1 21 GLU HG2 1 71 LEU HG . . 5.500 4.534 3.994 4.908 . 0 0 "[ . 1 . 2]" 1
425 1 21 GLU HG2 1 96 VAL MG1 . . 4.260 3.868 3.092 4.258 . 0 0 "[ . 1 . 2]" 1
426 1 21 GLU HG3 1 22 GLY H . . 3.870 3.328 2.836 3.870 0.000 3 0 "[ . 1 . 2]" 1
427 1 21 GLU HG3 1 22 GLY HA3 . . 5.060 4.743 3.981 5.060 0.000 11 0 "[ . 1 . 2]" 1
428 1 21 GLU HG3 1 70 LEU HA . . 3.990 2.224 1.996 3.044 . 0 0 "[ . 1 . 2]" 1
429 1 21 GLU HG3 1 71 LEU MD1 . . 5.500 4.516 3.699 5.110 . 0 0 "[ . 1 . 2]" 1
430 1 21 GLU HG3 1 71 LEU MD2 . . 5.500 4.014 3.043 4.726 . 0 0 "[ . 1 . 2]" 1
431 1 21 GLU HG3 1 71 LEU HG . . 5.500 3.309 2.505 3.915 . 0 0 "[ . 1 . 2]" 1
432 1 21 GLU HG3 1 96 VAL MG1 . . 4.260 3.134 2.687 3.469 . 0 0 "[ . 1 . 2]" 1
433 1 22 GLY H 1 23 ARG H . . 3.270 2.438 2.251 2.673 . 0 0 "[ . 1 . 2]" 1
434 1 22 GLY H 1 68 HIS HB2 . . 4.920 3.692 3.440 3.876 . 0 0 "[ . 1 . 2]" 1
435 1 22 GLY H 1 68 HIS HB3 . . 5.470 5.266 4.925 5.452 . 0 0 "[ . 1 . 2]" 1
436 1 22 GLY H 1 69 VAL H . . 3.870 3.435 3.150 3.838 . 0 0 "[ . 1 . 2]" 1
437 1 22 GLY H 1 69 VAL MG1 . . 5.070 4.821 4.574 5.068 . 0 0 "[ . 1 . 2]" 1
438 1 22 GLY H 1 69 VAL MG2 . . 3.210 2.500 2.037 3.209 . 0 0 "[ . 1 . 2]" 1
439 1 22 GLY H 1 70 LEU HA . . 4.540 3.633 3.321 3.918 . 0 0 "[ . 1 . 2]" 1
440 1 22 GLY H 1 96 VAL MG1 . . 4.020 3.663 3.470 3.937 . 0 0 "[ . 1 . 2]" 1
441 1 22 GLY HA2 1 68 HIS HA . . 4.450 3.514 3.293 3.701 . 0 0 "[ . 1 . 2]" 1
442 1 22 GLY HA2 1 68 HIS HB2 . . 3.780 2.095 1.998 2.252 . 0 0 "[ . 1 . 2]" 1
443 1 22 GLY HA2 1 68 HIS HB3 . . 4.160 3.567 3.248 3.826 . 0 0 "[ . 1 . 2]" 1
444 1 22 GLY HA2 1 68 HIS HD2 . . 4.650 3.788 3.355 4.093 . 0 0 "[ . 1 . 2]" 1
445 1 22 GLY HA2 1 69 VAL H . . 4.270 4.125 3.996 4.266 . 0 0 "[ . 1 . 2]" 1
446 1 22 GLY HA2 1 69 VAL MG2 . . 4.700 4.200 3.937 4.703 0.003 7 0 "[ . 1 . 2]" 1
447 1 22 GLY HA2 1 70 LEU QD . . 4.600 3.739 3.397 4.433 . 0 0 "[ . 1 . 2]" 1
448 1 22 GLY HA3 1 68 HIS HB2 . . 3.920 3.773 3.594 3.916 . 0 0 "[ . 1 . 2]" 1
449 1 22 GLY HA3 1 68 HIS HB3 . . 5.290 5.050 4.788 5.274 . 0 0 "[ . 1 . 2]" 1
450 1 22 GLY HA3 1 68 HIS HD2 . . 5.500 5.217 4.760 5.498 . 0 0 "[ . 1 . 2]" 1
451 1 23 ARG H 1 23 ARG HB2 . . 3.040 2.700 2.501 2.806 . 0 0 "[ . 1 . 2]" 1
452 1 23 ARG H 1 23 ARG HB3 . . 3.890 3.812 3.695 3.872 . 0 0 "[ . 1 . 2]" 1
453 1 23 ARG H 1 23 ARG QD . . 4.810 4.694 4.549 4.777 . 0 0 "[ . 1 . 2]" 1
454 1 23 ARG H 1 23 ARG HG2 . . 3.850 3.763 3.701 3.830 . 0 0 "[ . 1 . 2]" 1
455 1 23 ARG H 1 23 ARG HG3 . . 3.460 3.286 3.153 3.423 . 0 0 "[ . 1 . 2]" 1
456 1 23 ARG H 1 24 MET H . . 4.480 4.448 4.424 4.499 0.019 9 0 "[ . 1 . 2]" 1
457 1 23 ARG H 1 69 VAL H . . 3.770 2.697 2.522 2.940 . 0 0 "[ . 1 . 2]" 1
458 1 23 ARG H 1 69 VAL MG1 . . 4.310 4.228 4.045 4.315 0.005 5 0 "[ . 1 . 2]" 1
459 1 23 ARG H 1 69 VAL MG2 . . 3.220 2.534 2.313 2.927 . 0 0 "[ . 1 . 2]" 1
460 1 23 ARG HA 1 23 ARG QD . . 3.770 3.691 3.645 3.750 . 0 0 "[ . 1 . 2]" 1
461 1 23 ARG HA 1 23 ARG HG2 . . 3.490 2.387 2.324 2.448 . 0 0 "[ . 1 . 2]" 1
462 1 23 ARG HA 1 23 ARG HG3 . . 3.770 3.396 3.345 3.452 . 0 0 "[ . 1 . 2]" 1
463 1 23 ARG HA 1 24 MET H . . 2.680 2.448 2.417 2.498 . 0 0 "[ . 1 . 2]" 1
464 1 23 ARG HB2 1 23 ARG QD . . 3.650 2.671 2.615 2.730 . 0 0 "[ . 1 . 2]" 1
465 1 23 ARG HB2 1 24 MET H . . 3.590 3.541 3.389 3.590 0.000 7 0 "[ . 1 . 2]" 1
466 1 23 ARG HB2 1 69 VAL MG2 . . 4.590 3.232 3.009 3.410 . 0 0 "[ . 1 . 2]" 1
467 1 23 ARG HB3 1 23 ARG QD . . 3.520 2.179 2.060 2.249 . 0 0 "[ . 1 . 2]" 1
468 1 23 ARG HB3 1 24 MET H . . 3.530 2.335 2.225 2.405 . 0 0 "[ . 1 . 2]" 1
469 1 23 ARG HB3 1 69 VAL MG2 . . 4.780 4.560 4.275 4.763 . 0 0 "[ . 1 . 2]" 1
470 1 23 ARG QD 1 24 MET H . . 4.070 3.995 3.849 4.069 . 0 0 "[ . 1 . 2]" 1
471 1 23 ARG HG2 1 24 MET H . . 4.210 4.119 3.993 4.209 . 0 0 "[ . 1 . 2]" 1
472 1 23 ARG HG3 1 24 MET H . . 4.990 4.939 4.865 4.990 . 0 0 "[ . 1 . 2]" 1
473 1 23 ARG HG3 1 69 VAL MG2 . . 4.910 4.304 4.138 4.565 . 0 0 "[ . 1 . 2]" 1
474 1 24 MET H 1 24 MET HB2 . . 3.040 2.390 2.335 2.430 . 0 0 "[ . 1 . 2]" 1
475 1 24 MET H 1 24 MET HB3 . . 2.970 2.824 2.802 2.840 . 0 0 "[ . 1 . 2]" 1
476 1 24 MET H 1 24 MET HG2 . . 4.690 4.622 4.562 4.654 . 0 0 "[ . 1 . 2]" 1
477 1 24 MET H 1 24 MET HG3 . . 4.340 4.319 4.273 4.343 0.003 16 0 "[ . 1 . 2]" 1
478 1 24 MET H 1 69 VAL MG2 . . 5.500 5.233 4.978 5.452 . 0 0 "[ . 1 . 2]" 1
479 1 24 MET HA 1 24 MET ME . . 4.430 4.232 3.976 4.338 . 0 0 "[ . 1 . 2]" 1
480 1 24 MET HA 1 24 MET HG2 . . 3.620 2.993 2.757 3.126 . 0 0 "[ . 1 . 2]" 1
481 1 24 MET HA 1 24 MET HG3 . . 3.580 2.276 2.189 2.460 . 0 0 "[ . 1 . 2]" 1
482 1 24 MET HA 1 25 ALA H . . 2.760 2.156 2.141 2.199 . 0 0 "[ . 1 . 2]" 1
483 1 24 MET HA 1 25 ALA MB . . 4.120 3.921 3.818 3.991 . 0 0 "[ . 1 . 2]" 1
484 1 24 MET HA 1 66 PHE HB2 . . 4.760 4.247 4.156 4.377 . 0 0 "[ . 1 . 2]" 1
485 1 24 MET HA 1 66 PHE HB3 . . 5.040 4.906 4.697 5.041 0.001 7 0 "[ . 1 . 2]" 1
486 1 24 MET HA 1 67 SER HA . . 4.300 3.667 3.399 3.952 . 0 0 "[ . 1 . 2]" 1
487 1 24 MET HA 1 68 HIS H . . 5.070 4.693 4.508 4.875 . 0 0 "[ . 1 . 2]" 1
488 1 24 MET HA 1 68 HIS HA . . 4.150 3.688 3.435 3.905 . 0 0 "[ . 1 . 2]" 1
489 1 24 MET HA 1 69 VAL H . . 4.620 4.363 4.138 4.613 . 0 0 "[ . 1 . 2]" 1
490 1 24 MET HA 1 69 VAL MG1 . . 4.740 4.332 4.088 4.599 . 0 0 "[ . 1 . 2]" 1
491 1 24 MET HB2 1 25 ALA H . . 4.600 4.402 4.292 4.467 . 0 0 "[ . 1 . 2]" 1
492 1 24 MET HB2 1 67 SER HA . . 4.760 4.552 4.276 4.761 0.001 9 0 "[ . 1 . 2]" 1
493 1 24 MET HB3 1 25 ALA H . . 4.090 3.933 3.741 4.046 . 0 0 "[ . 1 . 2]" 1
494 1 24 MET HB3 1 25 ALA MB . . 5.330 5.141 4.998 5.221 . 0 0 "[ . 1 . 2]" 1
495 1 24 MET ME 1 24 MET HG2 . . 3.330 2.675 2.529 2.886 . 0 0 "[ . 1 . 2]" 1
496 1 24 MET ME 1 24 MET HG3 . . 3.590 2.257 2.093 2.424 . 0 0 "[ . 1 . 2]" 1
497 1 24 MET ME 1 25 ALA H . . 4.910 4.779 4.600 4.910 0.000 3 0 "[ . 1 . 2]" 1
498 1 24 MET ME 1 65 ASN HD21 . . 3.460 3.275 2.917 3.461 0.001 20 0 "[ . 1 . 2]" 1
499 1 24 MET ME 1 65 ASN HD22 . . 3.430 2.021 1.766 2.408 . 0 0 "[ . 1 . 2]" 1
500 1 24 MET ME 1 67 SER HA . . 3.760 2.860 2.156 3.157 . 0 0 "[ . 1 . 2]" 1
501 1 24 MET HG2 1 25 ALA H . . 3.630 3.214 2.725 3.547 . 0 0 "[ . 1 . 2]" 1
502 1 24 MET HG2 1 25 ALA HA . . 4.750 4.531 4.347 4.674 . 0 0 "[ . 1 . 2]" 1
503 1 24 MET HG2 1 65 ASN HD21 . . 4.460 3.816 3.300 4.354 . 0 0 "[ . 1 . 2]" 1
504 1 24 MET HG2 1 65 ASN HD22 . . 4.160 2.427 1.989 2.851 . 0 0 "[ . 1 . 2]" 1
505 1 24 MET HG2 1 66 PHE H . . 5.090 3.970 3.703 4.178 . 0 0 "[ . 1 . 2]" 1
506 1 24 MET HG2 1 67 SER HA . . 4.390 4.264 4.118 4.389 . 0 0 "[ . 1 . 2]" 1
507 1 24 MET HG3 1 25 ALA H . . 3.810 3.326 3.025 3.602 . 0 0 "[ . 1 . 2]" 1
508 1 24 MET HG3 1 65 ASN HD22 . . 4.140 3.236 2.737 3.638 . 0 0 "[ . 1 . 2]" 1
509 1 24 MET HG3 1 66 PHE H . . 5.050 4.147 3.922 4.618 . 0 0 "[ . 1 . 2]" 1
510 1 24 MET HG3 1 67 SER HA . . 3.780 2.650 2.429 2.845 . 0 0 "[ . 1 . 2]" 1
511 1 25 ALA H 1 25 ALA MB . . 3.230 2.483 2.366 2.593 . 0 0 "[ . 1 . 2]" 1
512 1 25 ALA H 1 65 ASN HA . . 4.930 4.657 4.400 4.900 . 0 0 "[ . 1 . 2]" 1
513 1 25 ALA H 1 66 PHE H . . 3.640 2.769 2.527 2.946 . 0 0 "[ . 1 . 2]" 1
514 1 25 ALA H 1 66 PHE HB2 . . 3.300 2.635 2.447 2.792 . 0 0 "[ . 1 . 2]" 1
515 1 25 ALA H 1 66 PHE HB3 . . 4.080 3.931 3.632 4.080 0.000 8 0 "[ . 1 . 2]" 1
516 1 25 ALA H 1 66 PHE QD . . 4.340 4.213 4.040 4.345 0.005 6 0 "[ . 1 . 2]" 1
517 1 25 ALA H 1 69 VAL MG1 . . 4.130 3.541 3.260 3.862 . 0 0 "[ . 1 . 2]" 1
518 1 25 ALA HA 1 26 GLU H . . 2.720 2.387 2.272 2.484 . 0 0 "[ . 1 . 2]" 1
519 1 25 ALA HA 1 26 GLU HG2 . . 5.330 4.942 4.712 5.323 . 0 0 "[ . 1 . 2]" 1
520 1 25 ALA HA 1 26 GLU QG . . 4.640 3.619 3.389 4.275 . 0 0 "[ . 1 . 2]" 1
521 1 25 ALA HA 1 26 GLU HG3 . . 5.330 3.728 3.457 4.504 . 0 0 "[ . 1 . 2]" 1
522 1 25 ALA HA 1 69 VAL MG1 . . 4.840 4.514 4.123 4.770 . 0 0 "[ . 1 . 2]" 1
523 1 25 ALA MB 1 26 GLU H . . 3.070 2.507 2.294 2.789 . 0 0 "[ . 1 . 2]" 1
524 1 25 ALA MB 1 26 GLU HA . . 4.380 3.820 3.720 3.923 . 0 0 "[ . 1 . 2]" 1
525 1 25 ALA MB 1 66 PHE H . . 4.200 3.596 3.187 3.946 . 0 0 "[ . 1 . 2]" 1
526 1 25 ALA MB 1 66 PHE HB2 . . 3.350 2.225 1.980 2.510 . 0 0 "[ . 1 . 2]" 1
527 1 25 ALA MB 1 66 PHE HB3 . . 3.770 3.544 3.221 3.752 . 0 0 "[ . 1 . 2]" 1
528 1 25 ALA MB 1 66 PHE QD . . 3.520 3.114 2.773 3.472 . 0 0 "[ . 1 . 2]" 1
529 1 25 ALA MB 1 66 PHE QE . . 4.740 4.444 4.226 4.682 . 0 0 "[ . 1 . 2]" 1
530 1 25 ALA MB 1 69 VAL MG1 . . 2.810 2.126 1.812 2.398 . 0 0 "[ . 1 . 2]" 1
531 1 25 ALA MB 1 94 LEU MD1 . . 3.340 2.690 2.496 2.794 . 0 0 "[ . 1 . 2]" 1
532 1 26 GLU H 1 26 GLU HB2 . . 3.430 2.921 2.752 3.001 . 0 0 "[ . 1 . 2]" 1
533 1 26 GLU H 1 26 GLU HB3 . . 3.970 3.930 3.832 3.975 0.005 19 0 "[ . 1 . 2]" 1
534 1 26 GLU H 1 26 GLU HG2 . . 4.670 4.232 3.970 4.656 . 0 0 "[ . 1 . 2]" 1
535 1 26 GLU H 1 26 GLU QG . . 4.040 3.290 3.101 3.728 . 0 0 "[ . 1 . 2]" 1
536 1 26 GLU H 1 26 GLU HG3 . . 4.670 3.433 3.197 3.929 . 0 0 "[ . 1 . 2]" 1
537 1 26 GLU H 1 27 LEU H . . 4.560 4.310 4.242 4.385 . 0 0 "[ . 1 . 2]" 1
538 1 26 GLU HA 1 26 GLU HG2 . . 4.090 2.672 2.359 3.688 . 0 0 "[ . 1 . 2]" 1
539 1 26 GLU HA 1 26 GLU QG . . 3.430 2.414 2.292 2.520 . 0 0 "[ . 1 . 2]" 1
540 1 26 GLU HA 1 26 GLU HG3 . . 4.090 3.057 2.477 3.278 . 0 0 "[ . 1 . 2]" 1
541 1 26 GLU HA 1 27 LEU H . . 2.890 2.249 2.186 2.341 . 0 0 "[ . 1 . 2]" 1
542 1 26 GLU HA 1 27 LEU HB2 . . 4.710 4.280 4.208 4.365 . 0 0 "[ . 1 . 2]" 1
543 1 26 GLU HA 1 27 LEU HG . . 4.850 4.306 4.059 4.489 . 0 0 "[ . 1 . 2]" 1
544 1 26 GLU HA 1 63 THR MG . . 3.930 3.385 3.164 3.592 . 0 0 "[ . 1 . 2]" 1
545 1 26 GLU HA 1 64 LEU H . . 4.970 4.521 4.305 4.758 . 0 0 "[ . 1 . 2]" 1
546 1 26 GLU HA 1 65 ASN HA . . 3.480 2.295 2.052 2.448 . 0 0 "[ . 1 . 2]" 1
547 1 26 GLU HA 1 66 PHE H . . 4.110 3.641 3.413 3.803 . 0 0 "[ . 1 . 2]" 1
548 1 26 GLU HA 1 66 PHE QD . . 4.050 3.150 3.001 3.495 . 0 0 "[ . 1 . 2]" 1
549 1 26 GLU HB2 1 27 LEU H . . 4.080 3.921 3.744 4.066 . 0 0 "[ . 1 . 2]" 1
550 1 26 GLU HB2 1 63 THR MG . . 3.900 3.711 3.444 3.902 0.002 5 0 "[ . 1 . 2]" 1
551 1 26 GLU HB2 1 65 ASN HA . . 4.830 4.644 4.508 4.828 . 0 0 "[ . 1 . 2]" 1
552 1 26 GLU HB3 1 27 LEU H . . 3.980 2.850 2.573 3.080 . 0 0 "[ . 1 . 2]" 1
553 1 26 GLU HB3 1 63 THR MG . . 3.080 2.353 2.105 2.546 . 0 0 "[ . 1 . 2]" 1
554 1 26 GLU HB3 1 65 ASN HA . . 4.310 3.780 3.574 4.117 . 0 0 "[ . 1 . 2]" 1
555 1 26 GLU QG 1 27 LEU H . . 4.290 3.998 3.804 4.211 . 0 0 "[ . 1 . 2]" 1
556 1 26 GLU QG 1 63 THR MG . . 3.700 3.330 2.899 3.585 . 0 0 "[ . 1 . 2]" 1
557 1 26 GLU QG 1 65 ASN HA . . 3.240 2.263 1.992 2.626 . 0 0 "[ . 1 . 2]" 1
558 1 26 GLU QG 1 65 ASN HD21 . . 3.690 2.213 1.861 2.656 . 0 0 "[ . 1 . 2]" 1
559 1 26 GLU QG 1 65 ASN HD22 . . 3.860 3.004 2.711 3.363 . 0 0 "[ . 1 . 2]" 1
560 1 26 GLU QG 1 66 PHE H . . 3.520 3.255 3.070 3.473 . 0 0 "[ . 1 . 2]" 1
561 1 26 GLU HG2 1 65 ASN HD21 . . 4.270 2.321 1.936 2.817 . 0 0 "[ . 1 . 2]" 1
562 1 26 GLU HG3 1 65 ASN HD21 . . 4.270 3.046 2.413 3.879 . 0 0 "[ . 1 . 2]" 1
563 1 27 LEU H 1 27 LEU HB2 . . 3.660 2.363 2.306 2.483 . 0 0 "[ . 1 . 2]" 1
564 1 27 LEU H 1 27 LEU HB3 . . 3.890 3.583 3.527 3.660 . 0 0 "[ . 1 . 2]" 1
565 1 27 LEU H 1 27 LEU MD1 . . 4.570 3.780 3.603 4.042 . 0 0 "[ . 1 . 2]" 1
566 1 27 LEU H 1 27 LEU QD . . 4.010 3.548 3.436 3.662 . 0 0 "[ . 1 . 2]" 1
567 1 27 LEU H 1 27 LEU MD2 . . 4.570 4.311 4.168 4.406 . 0 0 "[ . 1 . 2]" 1
568 1 27 LEU H 1 27 LEU HG . . 4.150 3.400 3.197 3.588 . 0 0 "[ . 1 . 2]" 1
569 1 27 LEU H 1 63 THR HA . . 4.590 4.387 4.116 4.555 . 0 0 "[ . 1 . 2]" 1
570 1 27 LEU H 1 63 THR MG . . 3.620 2.369 2.116 2.685 . 0 0 "[ . 1 . 2]" 1
571 1 27 LEU H 1 64 LEU H . . 3.650 2.753 2.555 2.949 . 0 0 "[ . 1 . 2]" 1
572 1 27 LEU H 1 64 LEU HA . . 5.430 4.612 4.426 4.717 . 0 0 "[ . 1 . 2]" 1
573 1 27 LEU H 1 64 LEU HB2 . . 4.590 4.386 4.192 4.561 . 0 0 "[ . 1 . 2]" 1
574 1 27 LEU H 1 64 LEU HB3 . . 4.000 3.325 3.115 3.497 . 0 0 "[ . 1 . 2]" 1
575 1 27 LEU H 1 64 LEU QD . . 4.970 4.654 4.516 4.745 . 0 0 "[ . 1 . 2]" 1
576 1 27 LEU H 1 65 ASN HA . . 4.360 3.834 3.647 4.029 . 0 0 "[ . 1 . 2]" 1
577 1 27 LEU H 1 66 PHE QD . . 4.690 4.414 4.259 4.599 . 0 0 "[ . 1 . 2]" 1
578 1 27 LEU H 1 66 PHE QE . . 4.930 4.108 3.866 4.535 . 0 0 "[ . 1 . 2]" 1
579 1 27 LEU HA 1 27 LEU MD1 . . 4.320 3.827 3.794 3.862 . 0 0 "[ . 1 . 2]" 1
580 1 27 LEU HA 1 27 LEU QD . . 2.860 2.347 1.991 2.550 . 0 0 "[ . 1 . 2]" 1
581 1 27 LEU HA 1 27 LEU MD2 . . 4.320 2.370 1.997 2.588 . 0 0 "[ . 1 . 2]" 1
582 1 27 LEU HB2 1 39 TRP HH2 . . 4.020 3.337 2.977 3.863 . 0 0 "[ . 1 . 2]" 1
583 1 27 LEU HB2 1 39 TRP HZ2 . . 5.290 3.782 3.487 4.043 . 0 0 "[ . 1 . 2]" 1
584 1 27 LEU HB2 1 63 THR MG . . 4.030 3.534 3.294 3.960 . 0 0 "[ . 1 . 2]" 1
585 1 27 LEU HB2 1 64 LEU H . . 4.200 2.607 2.441 2.897 . 0 0 "[ . 1 . 2]" 1
586 1 27 LEU HB2 1 64 LEU HB2 . . 4.450 3.058 2.870 3.384 . 0 0 "[ . 1 . 2]" 1
587 1 27 LEU HB2 1 64 LEU HB3 . . 4.050 2.286 2.048 2.485 . 0 0 "[ . 1 . 2]" 1
588 1 27 LEU HB2 1 64 LEU QD . . 4.020 3.544 3.361 3.742 . 0 0 "[ . 1 . 2]" 1
589 1 27 LEU HB2 1 66 PHE QE . . 5.500 3.699 3.422 3.946 . 0 0 "[ . 1 . 2]" 1
590 1 27 LEU HB3 1 27 LEU QD . . 2.880 2.055 1.949 2.152 . 0 0 "[ . 1 . 2]" 1
591 1 27 LEU HB3 1 39 TRP HH2 . . 3.870 2.245 2.003 2.626 . 0 0 "[ . 1 . 2]" 1
592 1 27 LEU HB3 1 39 TRP HZ2 . . 5.430 3.542 3.228 4.068 . 0 0 "[ . 1 . 2]" 1
593 1 27 LEU HB3 1 39 TRP HZ3 . . 5.060 3.684 3.273 4.203 . 0 0 "[ . 1 . 2]" 1
594 1 27 LEU HB3 1 64 LEU H . . 4.450 3.793 3.517 4.110 . 0 0 "[ . 1 . 2]" 1
595 1 27 LEU HB3 1 64 LEU HB2 . . 4.840 4.273 4.050 4.708 . 0 0 "[ . 1 . 2]" 1
596 1 27 LEU HB3 1 64 LEU HB3 . . 4.130 3.893 3.652 4.124 . 0 0 "[ . 1 . 2]" 1
597 1 27 LEU HB3 1 64 LEU QD . . 4.720 4.427 4.222 4.644 . 0 0 "[ . 1 . 2]" 1
598 1 27 LEU HB3 1 66 PHE QE . . 5.370 5.188 4.963 5.371 0.001 19 0 "[ . 1 . 2]" 1
599 1 27 LEU QD 1 28 LYS H . . 3.740 3.423 2.974 3.668 . 0 0 "[ . 1 . 2]" 1
600 1 27 LEU QD 1 39 TRP HE3 . . 4.730 3.112 2.827 3.368 . 0 0 "[ . 1 . 2]" 1
601 1 27 LEU QD 1 39 TRP HZ3 . . 3.580 2.089 1.916 2.278 . 0 0 "[ . 1 . 2]" 1
602 1 27 LEU QD 1 64 LEU HB2 . . 4.990 2.969 2.556 3.449 . 0 0 "[ . 1 . 2]" 1
603 1 27 LEU QD 1 64 LEU QD . . 3.190 2.039 1.817 2.301 . 0 0 "[ . 1 . 2]" 1
604 1 27 LEU QD 1 66 PHE QE . . 3.900 2.349 2.004 2.753 . 0 0 "[ . 1 . 2]" 1
605 1 27 LEU QD 1 66 PHE HZ . . 4.390 3.015 2.727 3.270 . 0 0 "[ . 1 . 2]" 1
606 1 27 LEU QD 1 77 TYR H . . 4.890 4.149 3.906 4.311 . 0 0 "[ . 1 . 2]" 1
607 1 27 LEU QD 1 77 TYR HA . . 5.090 4.699 4.495 4.946 . 0 0 "[ . 1 . 2]" 1
608 1 27 LEU QD 1 77 TYR QB . . 3.330 2.376 2.189 2.623 . 0 0 "[ . 1 . 2]" 1
609 1 27 LEU QD 1 77 TYR QD . . 4.680 3.257 3.115 3.408 . 0 0 "[ . 1 . 2]" 1
610 1 27 LEU QD 1 92 ALA MB . . 3.110 2.057 1.844 2.427 . 0 0 "[ . 1 . 2]" 1
611 1 27 LEU QD 1 94 LEU HB3 . . 4.900 4.674 4.486 4.885 . 0 0 "[ . 1 . 2]" 1
612 1 27 LEU MD1 1 39 TRP HH2 . . 4.220 2.921 2.688 3.148 . 0 0 "[ . 1 . 2]" 1
613 1 27 LEU MD1 1 39 TRP HZ3 . . 4.520 2.147 1.947 2.418 . 0 0 "[ . 1 . 2]" 1
614 1 27 LEU MD1 1 66 PHE QE . . 5.260 2.357 2.007 2.772 . 0 0 "[ . 1 . 2]" 1
615 1 27 LEU MD1 1 92 ALA MB . . 3.700 3.347 2.999 3.697 . 0 0 "[ . 1 . 2]" 1
616 1 27 LEU MD2 1 39 TRP HH2 . . 4.220 3.031 2.615 3.516 . 0 0 "[ . 1 . 2]" 1
617 1 27 LEU MD2 1 39 TRP HZ3 . . 4.520 3.032 2.569 3.634 . 0 0 "[ . 1 . 2]" 1
618 1 27 LEU MD2 1 66 PHE QE . . 5.260 4.718 4.255 4.974 . 0 0 "[ . 1 . 2]" 1
619 1 27 LEU MD2 1 92 ALA MB . . 3.700 2.079 1.853 2.483 . 0 0 "[ . 1 . 2]" 1
620 1 27 LEU HG 1 39 TRP HH2 . . 4.970 4.790 4.538 4.942 . 0 0 "[ . 1 . 2]" 1
621 1 27 LEU HG 1 64 LEU HB2 . . 5.350 5.142 4.747 5.344 . 0 0 "[ . 1 . 2]" 1
622 1 27 LEU HG 1 64 LEU QD . . 5.000 4.183 3.877 4.437 . 0 0 "[ . 1 . 2]" 1
623 1 27 LEU HG 1 66 PHE QE . . 4.300 3.612 3.046 3.932 . 0 0 "[ . 1 . 2]" 1
624 1 27 LEU HG 1 66 PHE HZ . . 5.500 5.099 4.700 5.498 . 0 0 "[ . 1 . 2]" 1
625 1 28 LYS H 1 28 LYS HB2 . . 3.880 2.448 2.221 3.589 . 0 0 "[ . 1 . 2]" 1
626 1 28 LYS H 1 28 LYS QB . . 3.140 2.360 2.198 2.559 . 0 0 "[ . 1 . 2]" 1
627 1 28 LYS H 1 28 LYS HB3 . . 3.880 3.518 2.540 3.596 . 0 0 "[ . 1 . 2]" 1
628 1 28 LYS H 1 28 LYS QD . . 4.160 3.437 1.826 4.152 . 0 0 "[ . 1 . 2]" 1
629 1 28 LYS H 1 28 LYS HG2 . . 3.950 2.751 1.961 3.947 . 0 0 "[ . 1 . 2]" 1
630 1 28 LYS H 1 28 LYS QG . . 3.300 2.565 1.945 3.307 0.007 8 0 "[ . 1 . 2]" 1
631 1 28 LYS H 1 28 LYS HG3 . . 3.950 3.502 3.001 3.832 . 0 0 "[ . 1 . 2]" 1
632 1 28 LYS HA 1 28 LYS HD2 . . 4.420 3.130 2.021 4.107 . 0 0 "[ . 1 . 2]" 1
633 1 28 LYS HA 1 28 LYS QD . . 3.790 2.556 2.002 3.706 . 0 0 "[ . 1 . 2]" 1
634 1 28 LYS HA 1 28 LYS HD3 . . 4.420 3.184 2.164 4.272 . 0 0 "[ . 1 . 2]" 1
635 1 28 LYS HA 1 28 LYS HG2 . . 4.150 2.940 2.546 3.632 . 0 0 "[ . 1 . 2]" 1
636 1 28 LYS HA 1 28 LYS QG . . 3.620 2.628 2.271 3.432 . 0 0 "[ . 1 . 2]" 1
637 1 28 LYS HA 1 28 LYS HG3 . . 4.150 3.479 2.297 4.223 0.073 9 0 "[ . 1 . 2]" 1
638 1 28 LYS HA 1 29 CYS H . . 2.880 2.162 2.140 2.199 . 0 0 "[ . 1 . 2]" 1
639 1 28 LYS HA 1 63 THR MG . . 3.960 3.388 2.793 3.838 . 0 0 "[ . 1 . 2]" 1
640 1 28 LYS HA 1 64 LEU H . . 5.500 5.358 4.835 5.493 . 0 0 "[ . 1 . 2]" 1
641 1 28 LYS QB 1 29 CYS H . . 3.680 3.507 3.017 3.661 . 0 0 "[ . 1 . 2]" 1
642 1 28 LYS QB 1 29 CYS HA . . 4.580 4.110 4.030 4.186 . 0 0 "[ . 1 . 2]" 1
643 1 28 LYS QD 1 29 CYS H . . 5.340 4.133 3.339 5.253 . 0 0 "[ . 1 . 2]" 1
644 1 28 LYS QE 1 28 LYS QG . . 3.450 2.258 2.099 2.609 . 0 0 "[ . 1 . 2]" 1
645 1 28 LYS QG 1 29 CYS H . . 4.750 4.477 3.981 4.739 . 0 0 "[ . 1 . 2]" 1
646 1 29 CYS H 1 29 CYS HB2 . . 4.200 3.523 3.198 3.995 . 0 0 "[ . 1 . 2]" 1
647 1 29 CYS H 1 29 CYS HB3 . . 4.150 2.891 2.732 3.139 . 0 0 "[ . 1 . 2]" 1
648 1 29 CYS H 1 30 ARG H . . 4.140 4.127 4.027 4.163 0.023 7 0 "[ . 1 . 2]" 1
649 1 29 CYS H 1 39 TRP HZ2 . . 4.840 4.693 4.450 4.838 . 0 0 "[ . 1 . 2]" 1
650 1 29 CYS H 1 63 THR HA . . 3.950 3.471 3.094 3.677 . 0 0 "[ . 1 . 2]" 1
651 1 29 CYS H 1 63 THR MG . . 4.610 3.596 3.207 4.091 . 0 0 "[ . 1 . 2]" 1
652 1 29 CYS H 1 64 LEU H . . 5.240 4.900 4.546 5.241 0.001 12 0 "[ . 1 . 2]" 1
653 1 29 CYS HA 1 30 ARG H . . 3.060 2.148 2.145 2.156 . 0 0 "[ . 1 . 2]" 1
654 1 29 CYS HA 1 30 ARG QB . . 4.710 4.242 4.150 4.405 . 0 0 "[ . 1 . 2]" 1
655 1 29 CYS HA 1 30 ARG QG . . 5.050 4.331 3.774 5.054 0.004 15 0 "[ . 1 . 2]" 1
656 1 29 CYS HA 1 39 TRP HZ2 . . 4.870 4.667 4.462 4.874 0.004 15 0 "[ . 1 . 2]" 1
657 1 29 CYS HB2 1 30 ARG H . . 5.500 4.079 3.350 4.374 . 0 0 "[ . 1 . 2]" 1
658 1 29 CYS HB2 1 39 TRP HE1 . . 5.210 4.957 4.540 5.193 . 0 0 "[ . 1 . 2]" 1
659 1 29 CYS HB2 1 39 TRP HH2 . . 4.460 3.046 2.601 4.334 . 0 0 "[ . 1 . 2]" 1
660 1 29 CYS HB2 1 39 TRP HZ2 . . 3.560 2.527 2.163 2.990 . 0 0 "[ . 1 . 2]" 1
661 1 29 CYS HB2 1 79 CYS HB2 . . 4.740 4.305 4.132 4.583 . 0 0 "[ . 1 . 2]" 1
662 1 29 CYS HB2 1 79 CYS QB . . 4.140 3.937 3.780 4.102 . 0 0 "[ . 1 . 2]" 1
663 1 29 CYS HB2 1 79 CYS HB3 . . 4.740 4.573 4.133 4.724 . 0 0 "[ . 1 . 2]" 1
664 1 29 CYS HB3 1 30 ARG H . . 5.140 4.299 4.059 4.381 . 0 0 "[ . 1 . 2]" 1
665 1 29 CYS HB3 1 37 VAL QG . . 4.910 4.657 4.384 4.912 0.002 8 0 "[ . 1 . 2]" 1
666 1 29 CYS HB3 1 39 TRP HE1 . . 4.250 4.056 3.791 4.252 0.002 12 0 "[ . 1 . 2]" 1
667 1 29 CYS HB3 1 39 TRP HH2 . . 4.720 3.716 3.319 4.052 . 0 0 "[ . 1 . 2]" 1
668 1 29 CYS HB3 1 39 TRP HZ2 . . 3.600 2.106 1.994 2.276 . 0 0 "[ . 1 . 2]" 1
669 1 29 CYS HB3 1 79 CYS QB . . 5.170 4.635 4.242 4.862 . 0 0 "[ . 1 . 2]" 1
670 1 30 ARG H 1 30 ARG QB . . 3.290 2.509 2.351 2.880 . 0 0 "[ . 1 . 2]" 1
671 1 30 ARG H 1 30 ARG HD2 . . 5.500 4.451 2.673 5.499 . 0 0 "[ . 1 . 2]" 1
672 1 30 ARG H 1 30 ARG HD3 . . 5.500 4.761 2.845 5.502 0.002 2 0 "[ . 1 . 2]" 1
673 1 30 ARG H 1 30 ARG QG . . 4.010 3.310 2.538 3.914 . 0 0 "[ . 1 . 2]" 1
674 1 30 ARG HA 1 30 ARG HD2 . . 4.810 3.755 2.406 4.831 0.021 17 0 "[ . 1 . 2]" 1
675 1 30 ARG HA 1 30 ARG HD3 . . 4.810 3.993 2.416 4.699 . 0 0 "[ . 1 . 2]" 1
676 1 30 ARG HA 1 30 ARG HG2 . . 4.120 2.878 2.183 3.837 . 0 0 "[ . 1 . 2]" 1
677 1 30 ARG HA 1 30 ARG QG . . 3.550 2.399 2.147 3.309 . 0 0 "[ . 1 . 2]" 1
678 1 30 ARG HA 1 30 ARG HG3 . . 4.120 3.019 2.193 3.727 . 0 0 "[ . 1 . 2]" 1
679 1 30 ARG HA 1 31 THR H . . 2.890 2.162 2.140 2.194 . 0 0 "[ . 1 . 2]" 1
680 1 30 ARG HA 1 31 THR MG . . 4.070 3.886 3.658 4.067 . 0 0 "[ . 1 . 2]" 1
681 1 30 ARG QB 1 30 ARG QD . . 3.160 2.202 2.059 2.524 . 0 0 "[ . 1 . 2]" 1
682 1 30 ARG QB 1 31 THR H . . 3.650 3.174 2.977 3.379 . 0 0 "[ . 1 . 2]" 1
683 1 30 ARG QD 1 31 THR H . . 5.340 4.622 3.378 5.309 . 0 0 "[ . 1 . 2]" 1
684 1 30 ARG QG 1 31 THR H . . 4.370 4.011 3.629 4.398 0.028 18 0 "[ . 1 . 2]" 1
685 1 31 THR H 1 31 THR MG . . 3.720 3.040 2.758 3.271 . 0 0 "[ . 1 . 2]" 1
686 1 31 THR HA 1 31 THR MG . . 3.370 2.241 2.105 2.355 . 0 0 "[ . 1 . 2]" 1
687 1 31 THR HA 1 32 PRO QD . . 3.250 2.057 2.009 2.114 . 0 0 "[ . 1 . 2]" 1
688 1 31 THR HB 1 32 PRO QD . . 3.410 2.115 1.997 2.307 . 0 0 "[ . 1 . 2]" 1
689 1 31 THR HB 1 32 PRO HG2 . . 4.650 3.852 3.697 4.012 . 0 0 "[ . 1 . 2]" 1
690 1 31 THR HB 1 32 PRO HG3 . . 5.000 4.761 4.631 4.934 . 0 0 "[ . 1 . 2]" 1
691 1 31 THR HB 1 35 SER HB2 . . 4.270 3.510 3.010 4.109 . 0 0 "[ . 1 . 2]" 1
692 1 31 THR HB 1 35 SER HB3 . . 4.270 3.852 3.154 4.220 . 0 0 "[ . 1 . 2]" 1
693 1 31 THR HB 1 81 VAL MG1 . . 4.240 2.931 2.245 3.566 . 0 0 "[ . 1 . 2]" 1
694 1 31 THR HB 1 81 VAL MG2 . . 5.070 3.824 3.330 4.344 . 0 0 "[ . 1 . 2]" 1
695 1 31 THR MG 1 32 PRO QD . . 3.800 2.901 2.490 3.185 . 0 0 "[ . 1 . 2]" 1
696 1 31 THR MG 1 35 SER QB . . 4.150 4.025 3.812 4.151 0.001 11 0 "[ . 1 . 2]" 1
697 1 31 THR MG 1 81 VAL MG2 . . 2.910 1.995 1.731 2.219 . 0 0 "[ . 1 . 2]" 1
698 1 32 PRO HB2 1 33 PRO HD2 . . 4.040 2.019 1.994 2.143 . 0 0 "[ . 1 . 2]" 1
699 1 32 PRO HB2 1 33 PRO QD . . 3.400 2.007 1.982 2.127 . 0 0 "[ . 1 . 2]" 1
700 1 32 PRO HB2 1 33 PRO HD3 . . 4.040 3.466 3.445 3.570 . 0 0 "[ . 1 . 2]" 1
701 1 32 PRO HB2 1 35 SER QB . . 5.340 4.075 3.382 4.714 . 0 0 "[ . 1 . 2]" 1
702 1 32 PRO HB3 1 33 PRO HD2 . . 4.040 2.697 2.685 2.756 . 0 0 "[ . 1 . 2]" 1
703 1 32 PRO HB3 1 33 PRO QD . . 3.370 2.639 2.627 2.695 . 0 0 "[ . 1 . 2]" 1
704 1 32 PRO HB3 1 33 PRO HD3 . . 4.040 3.740 3.725 3.810 . 0 0 "[ . 1 . 2]" 1
705 1 32 PRO QD 1 35 SER QB . . 3.610 3.257 3.040 3.485 . 0 0 "[ . 1 . 2]" 1
706 1 32 PRO QD 1 81 VAL MG1 . . 4.720 2.680 2.279 3.177 . 0 0 "[ . 1 . 2]" 1
707 1 32 PRO QD 1 81 VAL MG2 . . 4.800 3.957 3.417 4.421 . 0 0 "[ . 1 . 2]" 1
708 1 32 PRO HG2 1 33 PRO HA . . 5.500 5.561 5.559 5.571 0.071 3 0 "[ . 1 . 2]" 1
709 1 32 PRO HG2 1 35 SER H . . 5.500 5.183 4.792 5.496 . 0 0 "[ . 1 . 2]" 1
710 1 32 PRO HG2 1 35 SER QB . . 4.850 2.678 2.022 3.232 . 0 0 "[ . 1 . 2]" 1
711 1 33 PRO HA 1 34 MET H . . 3.340 2.267 2.203 2.349 . 0 0 "[ . 1 . 2]" 1
712 1 33 PRO HA 1 34 MET HA . . 4.640 4.441 4.405 4.476 . 0 0 "[ . 1 . 2]" 1
713 1 33 PRO HA 1 34 MET HG2 . . 4.980 4.885 4.606 4.980 . 0 0 "[ . 1 . 2]" 1
714 1 33 PRO HA 1 34 MET QG . . 4.350 4.104 3.827 4.271 . 0 0 "[ . 1 . 2]" 1
715 1 33 PRO HA 1 34 MET HG3 . . 4.980 4.413 4.090 4.653 . 0 0 "[ . 1 . 2]" 1
716 1 33 PRO HA 1 35 SER H . . 4.020 3.654 3.430 3.938 . 0 0 "[ . 1 . 2]" 1
717 1 33 PRO HB2 1 34 MET HG2 . . 4.070 3.680 3.214 4.070 . 0 0 "[ . 1 . 2]" 1
718 1 33 PRO HB2 1 34 MET HG3 . . 4.070 2.553 2.298 2.773 . 0 0 "[ . 1 . 2]" 1
719 1 33 PRO HB2 1 35 SER H . . 5.500 5.254 5.037 5.460 . 0 0 "[ . 1 . 2]" 1
720 1 33 PRO HB3 1 34 MET H . . 4.490 3.667 3.526 3.804 . 0 0 "[ . 1 . 2]" 1
721 1 34 MET H 1 34 MET HG2 . . 4.460 3.002 2.861 3.137 . 0 0 "[ . 1 . 2]" 1
722 1 34 MET H 1 34 MET HG3 . . 4.460 3.226 3.050 3.383 . 0 0 "[ . 1 . 2]" 1
723 1 34 MET H 1 35 SER H . . 3.830 2.723 2.586 2.897 . 0 0 "[ . 1 . 2]" 1
724 1 34 MET HA 1 34 MET ME . . 4.550 4.073 3.257 4.550 0.000 12 0 "[ . 1 . 2]" 1
725 1 34 MET HA 1 34 MET HG2 . . 3.630 2.484 2.386 2.678 . 0 0 "[ . 1 . 2]" 1
726 1 34 MET HA 1 34 MET QG . . 3.140 2.429 2.341 2.599 . 0 0 "[ . 1 . 2]" 1
727 1 34 MET HA 1 34 MET HG3 . . 3.630 3.441 3.360 3.511 . 0 0 "[ . 1 . 2]" 1
728 1 34 MET HA 1 35 SER H . . 3.390 2.781 2.627 2.888 . 0 0 "[ . 1 . 2]" 1
729 1 34 MET QB 1 34 MET QG . . 2.360 2.068 2.060 2.078 . 0 0 "[ . 1 . 2]" 1
730 1 34 MET QB 1 84 VAL MG1 . . 4.460 3.911 3.346 4.439 . 0 0 "[ . 1 . 2]" 1
731 1 34 MET HB2 1 84 VAL MG1 . . 5.110 4.297 3.542 4.996 . 0 0 "[ . 1 . 2]" 1
732 1 34 MET HB3 1 84 VAL MG1 . . 5.110 4.518 4.026 4.968 . 0 0 "[ . 1 . 2]" 1
733 1 35 SER H 1 35 SER HB2 . . 3.890 3.327 2.647 3.878 . 0 0 "[ . 1 . 2]" 1
734 1 35 SER H 1 35 SER QB . . 3.140 2.787 2.440 3.123 . 0 0 "[ . 1 . 2]" 1
735 1 35 SER H 1 35 SER HB3 . . 3.890 3.353 2.491 3.891 0.001 4 0 "[ . 1 . 2]" 1
736 1 35 SER H 1 35 SER HG . . 3.740 2.904 2.097 3.776 0.036 10 0 "[ . 1 . 2]" 1
737 1 35 SER H 1 37 VAL QG . . 5.300 4.972 4.681 5.301 0.001 1 0 "[ . 1 . 2]" 1
738 1 35 SER HA 1 36 SER H . . 3.130 2.297 2.191 2.475 . 0 0 "[ . 1 . 2]" 1
739 1 35 SER HA 1 81 VAL MG1 . . 5.110 4.807 4.268 5.111 0.001 18 0 "[ . 1 . 2]" 1
740 1 35 SER HA 1 83 ASN HA . . 3.850 3.124 2.763 3.564 . 0 0 "[ . 1 . 2]" 1
741 1 35 SER HA 1 83 ASN QB . . 4.040 3.735 2.110 4.024 . 0 0 "[ . 1 . 2]" 1
742 1 35 SER HA 1 83 ASN QD . . 4.520 3.561 2.144 4.512 . 0 0 "[ . 1 . 2]" 1
743 1 35 SER QB 1 36 SER H . . 3.560 2.729 2.262 3.540 . 0 0 "[ . 1 . 2]" 1
744 1 35 SER QB 1 37 VAL QG . . 4.700 4.121 3.241 4.705 0.005 17 0 "[ . 1 . 2]" 1
745 1 35 SER QB 1 81 VAL MG1 . . 3.310 2.876 2.441 3.304 . 0 0 "[ . 1 . 2]" 1
746 1 36 SER H 1 36 SER QB . . 3.290 2.340 2.171 2.798 . 0 0 "[ . 1 . 2]" 1
747 1 36 SER H 1 37 VAL H . . 4.560 4.425 4.167 4.541 . 0 0 "[ . 1 . 2]" 1
748 1 36 SER H 1 37 VAL QG . . 5.410 4.700 4.336 5.157 . 0 0 "[ . 1 . 2]" 1
749 1 36 SER H 1 81 VAL MG1 . . 4.570 4.233 3.843 4.570 0.000 18 0 "[ . 1 . 2]" 1
750 1 36 SER H 1 82 THR H . . 3.800 3.147 2.631 3.685 . 0 0 "[ . 1 . 2]" 1
751 1 36 SER H 1 82 THR HB . . 4.340 3.487 2.751 4.155 . 0 0 "[ . 1 . 2]" 1
752 1 36 SER HA 1 37 VAL H . . 2.730 2.160 2.139 2.234 . 0 0 "[ . 1 . 2]" 1
753 1 36 SER HA 1 37 VAL HB . . 4.920 4.667 4.537 4.920 . 16 0 "[ . 1 . 2]" 1
754 1 36 SER HA 1 37 VAL QG . . 3.820 3.629 3.349 3.818 . 0 0 "[ . 1 . 2]" 1
755 1 36 SER QB 1 37 VAL H . . 3.820 3.634 3.147 3.844 0.024 10 0 "[ . 1 . 2]" 1
756 1 36 SER QB 1 37 VAL QG . . 5.440 4.603 4.389 4.805 . 0 0 "[ . 1 . 2]" 1
757 1 36 SER QB 1 82 THR H . . 4.070 3.179 2.691 3.915 . 0 0 "[ . 1 . 2]" 1
758 1 36 SER QB 1 82 THR HB . . 3.580 2.517 2.028 3.578 . 0 0 "[ . 1 . 2]" 1
759 1 36 SER QB 1 82 THR MG . . 4.310 3.787 3.391 4.253 . 0 0 "[ . 1 . 2]" 1
760 1 37 VAL H 1 37 VAL HB . . 3.310 2.741 2.457 3.176 . 0 0 "[ . 1 . 2]" 1
761 1 37 VAL H 1 37 VAL MG1 . . 4.000 3.182 1.881 3.851 . 0 0 "[ . 1 . 2]" 1
762 1 37 VAL H 1 37 VAL QG . . 3.200 2.417 1.877 2.733 . 0 0 "[ . 1 . 2]" 1
763 1 37 VAL H 1 37 VAL MG2 . . 4.000 3.081 2.420 3.840 . 0 0 "[ . 1 . 2]" 1
764 1 37 VAL HB 1 38 LYS H . . 4.490 4.169 3.959 4.293 . 0 0 "[ . 1 . 2]" 1
765 1 37 VAL HB 1 58 VAL MG1 . . 4.820 3.554 2.656 4.819 . 0 0 "[ . 1 . 2]" 1
766 1 37 VAL HB 1 62 GLY QA . . 4.090 3.716 2.985 4.091 0.001 11 0 "[ . 1 . 2]" 1
767 1 37 VAL QG 1 38 LYS H . . 3.240 2.477 2.017 2.779 . 0 0 "[ . 1 . 2]" 1
768 1 37 VAL QG 1 38 LYS HA . . 3.660 3.355 3.153 3.558 . 0 0 "[ . 1 . 2]" 1
769 1 37 VAL QG 1 39 TRP HD1 . . 3.380 2.903 2.528 3.257 . 0 0 "[ . 1 . 2]" 1
770 1 37 VAL QG 1 39 TRP HE1 . . 3.240 2.697 2.537 2.971 . 0 0 "[ . 1 . 2]" 1
771 1 37 VAL QG 1 39 TRP HZ2 . . 4.580 4.388 4.198 4.579 . 0 0 "[ . 1 . 2]" 1
772 1 37 VAL QG 1 58 VAL MG1 . . 3.130 2.155 1.833 2.431 . 0 0 "[ . 1 . 2]" 1
773 1 37 VAL QG 1 62 GLY H . . 4.190 3.994 3.733 4.148 . 0 0 "[ . 1 . 2]" 1
774 1 37 VAL QG 1 62 GLY QA . . 3.110 2.061 1.872 2.379 . 0 0 "[ . 1 . 2]" 1
775 1 37 VAL QG 1 80 MET H . . 4.570 4.352 3.939 4.569 . 0 0 "[ . 1 . 2]" 1
776 1 37 VAL MG1 1 38 LYS H . . 4.370 3.074 2.371 4.154 . 0 0 "[ . 1 . 2]" 1
777 1 37 VAL MG1 1 39 TRP HE1 . . 4.790 3.315 2.549 4.683 . 0 0 "[ . 1 . 2]" 1
778 1 37 VAL MG1 1 62 GLY H . . 5.000 4.397 4.065 4.554 . 0 0 "[ . 1 . 2]" 1
779 1 37 VAL MG1 1 62 GLY HA2 . . 5.340 2.353 2.033 2.840 . 0 0 "[ . 1 . 2]" 1
780 1 37 VAL MG1 1 62 GLY HA3 . . 5.340 3.074 2.115 4.007 . 0 0 "[ . 1 . 2]" 1
781 1 37 VAL MG2 1 38 LYS H . . 4.370 3.460 2.022 4.095 . 0 0 "[ . 1 . 2]" 1
782 1 37 VAL MG2 1 39 TRP HE1 . . 4.790 4.092 2.695 4.791 0.001 6 0 "[ . 1 . 2]" 1
783 1 37 VAL MG2 1 62 GLY H . . 5.000 4.594 4.340 4.860 . 0 0 "[ . 1 . 2]" 1
784 1 37 VAL MG2 1 62 GLY HA2 . . 5.340 2.727 2.172 3.205 . 0 0 "[ . 1 . 2]" 1
785 1 37 VAL MG2 1 62 GLY HA3 . . 5.340 2.792 2.511 3.320 . 0 0 "[ . 1 . 2]" 1
786 1 38 LYS H 1 38 LYS HB2 . . 3.730 2.703 2.576 2.882 . 0 0 "[ . 1 . 2]" 1
787 1 38 LYS H 1 38 LYS HB3 . . 4.180 3.775 3.647 3.912 . 0 0 "[ . 1 . 2]" 1
788 1 38 LYS H 1 38 LYS HG2 . . 4.610 4.043 3.674 4.606 . 0 0 "[ . 1 . 2]" 1
789 1 38 LYS H 1 38 LYS QG . . 3.980 3.347 3.054 3.624 . 0 0 "[ . 1 . 2]" 1
790 1 38 LYS H 1 38 LYS HG3 . . 4.610 3.617 3.230 4.491 . 0 0 "[ . 1 . 2]" 1
791 1 38 LYS H 1 39 TRP H . . 4.500 4.412 4.371 4.461 . 0 0 "[ . 1 . 2]" 1
792 1 38 LYS H 1 80 MET H . . 3.730 3.170 2.831 3.331 . 0 0 "[ . 1 . 2]" 1
793 1 38 LYS H 1 80 MET HB2 . . 3.910 3.370 2.957 3.818 . 0 0 "[ . 1 . 2]" 1
794 1 38 LYS H 1 80 MET HB3 . . 5.150 4.880 4.485 5.150 0.000 2 0 "[ . 1 . 2]" 1
795 1 38 LYS HA 1 38 LYS HG2 . . 3.980 2.348 2.190 2.490 . 0 0 "[ . 1 . 2]" 1
796 1 38 LYS HA 1 38 LYS QG . . 3.430 2.291 2.152 2.430 . 0 0 "[ . 1 . 2]" 1
797 1 38 LYS HA 1 38 LYS HG3 . . 3.980 3.246 2.678 3.611 . 0 0 "[ . 1 . 2]" 1
798 1 38 LYS HA 1 39 TRP H . . 2.890 2.404 2.215 2.623 . 0 0 "[ . 1 . 2]" 1
799 1 38 LYS HA 1 46 VAL QG . . 4.660 3.816 3.463 4.212 . 0 0 "[ . 1 . 2]" 1
800 1 38 LYS HA 1 48 SER QB . . 4.150 3.232 2.432 3.780 . 0 0 "[ . 1 . 2]" 1
801 1 38 LYS HA 1 58 VAL MG1 . . 4.500 3.959 3.470 4.412 . 0 0 "[ . 1 . 2]" 1
802 1 38 LYS HA 1 58 VAL MG2 . . 4.230 3.817 3.473 4.236 0.006 15 0 "[ . 1 . 2]" 1
803 1 38 LYS HB2 1 38 LYS QE . . 5.020 3.366 2.269 4.457 . 0 0 "[ . 1 . 2]" 1
804 1 38 LYS HB2 1 39 TRP H . . 4.200 3.739 3.245 4.195 . 0 0 "[ . 1 . 2]" 1
805 1 38 LYS HB2 1 39 TRP HA . . 5.500 4.782 4.496 5.107 . 0 0 "[ . 1 . 2]" 1
806 1 38 LYS HB2 1 46 VAL QG . . 4.180 3.477 2.993 4.182 0.002 2 0 "[ . 1 . 2]" 1
807 1 38 LYS HB2 1 48 SER HA . . 5.500 5.338 4.968 5.501 0.001 20 0 "[ . 1 . 2]" 1
808 1 38 LYS HB2 1 80 MET H . . 4.310 3.525 3.157 4.074 . 0 0 "[ . 1 . 2]" 1
809 1 38 LYS HB2 1 80 MET HB2 . . 3.750 2.178 1.996 2.568 . 0 0 "[ . 1 . 2]" 1
810 1 38 LYS HB2 1 80 MET HG2 . . 4.980 4.754 4.407 4.989 0.009 2 0 "[ . 1 . 2]" 1
811 1 38 LYS HB2 1 80 MET HG3 . . 4.910 3.464 3.007 4.072 . 0 0 "[ . 1 . 2]" 1
812 1 38 LYS HB3 1 38 LYS QD . . 3.540 2.185 2.070 2.481 . 0 0 "[ . 1 . 2]" 1
813 1 38 LYS HB3 1 38 LYS QE . . 4.850 3.196 2.270 4.032 . 0 0 "[ . 1 . 2]" 1
814 1 38 LYS HB3 1 39 TRP H . . 3.470 2.486 1.992 3.028 . 0 0 "[ . 1 . 2]" 1
815 1 38 LYS HB3 1 46 VAL QG . . 3.030 2.324 2.009 2.820 . 0 0 "[ . 1 . 2]" 1
816 1 38 LYS HB3 1 48 SER QB . . 4.580 3.815 2.780 4.523 . 0 0 "[ . 1 . 2]" 1
817 1 38 LYS HB3 1 80 MET HB2 . . 4.290 3.498 2.341 4.209 . 0 0 "[ . 1 . 2]" 1
818 1 38 LYS HB3 1 80 MET ME . . 4.560 3.157 2.381 3.716 . 0 0 "[ . 1 . 2]" 1
819 1 38 LYS QD 1 39 TRP H . . 4.780 3.989 2.785 4.730 . 0 0 "[ . 1 . 2]" 1
820 1 38 LYS QD 1 46 VAL QG . . 2.820 2.224 1.776 2.753 . 0 0 "[ . 1 . 2]" 1
821 1 38 LYS QD 1 48 SER HA . . 5.500 4.527 3.045 5.304 . 0 0 "[ . 1 . 2]" 1
822 1 38 LYS QD 1 48 SER QB . . 3.970 2.835 1.974 3.884 . 0 0 "[ . 1 . 2]" 1
823 1 38 LYS QD 1 80 MET ME . . 4.250 3.340 2.194 4.237 . 0 0 "[ . 1 . 2]" 1
824 1 38 LYS QE 1 38 LYS HG2 . . 3.780 2.744 2.079 3.454 . 0 0 "[ . 1 . 2]" 1
825 1 38 LYS QE 1 38 LYS HG3 . . 3.780 2.654 2.131 3.244 . 0 0 "[ . 1 . 2]" 1
826 1 38 LYS QE 1 46 VAL MG1 . . 4.490 3.038 2.110 4.008 . 0 0 "[ . 1 . 2]" 1
827 1 38 LYS QE 1 46 VAL QG . . 3.320 2.823 2.106 3.329 0.009 15 0 "[ . 1 . 2]" 1
828 1 38 LYS QE 1 46 VAL MG2 . . 4.490 3.997 3.330 4.491 0.001 14 0 "[ . 1 . 2]" 1
829 1 38 LYS QE 1 48 SER QB . . 4.130 3.056 1.872 4.137 0.007 11 0 "[ . 1 . 2]" 1
830 1 38 LYS QG 1 39 TRP H . . 4.260 3.736 3.212 4.046 . 0 0 "[ . 1 . 2]" 1
831 1 38 LYS QG 1 48 SER HA . . 4.120 3.188 2.747 3.833 . 0 0 "[ . 1 . 2]" 1
832 1 38 LYS QG 1 48 SER QB . . 3.300 2.113 1.824 2.851 . 0 0 "[ . 1 . 2]" 1
833 1 39 TRP H 1 39 TRP HB2 . . 3.260 2.690 2.493 2.799 . 0 0 "[ . 1 . 2]" 1
834 1 39 TRP H 1 39 TRP HB3 . . 3.830 3.778 3.674 3.845 0.015 10 0 "[ . 1 . 2]" 1
835 1 39 TRP H 1 39 TRP HD1 . . 3.920 3.602 3.305 3.863 . 0 0 "[ . 1 . 2]" 1
836 1 39 TRP H 1 46 VAL HA . . 4.750 4.390 4.059 4.757 0.007 18 0 "[ . 1 . 2]" 1
837 1 39 TRP H 1 46 VAL QG . . 3.610 2.472 2.227 2.704 . 0 0 "[ . 1 . 2]" 1
838 1 39 TRP H 1 47 LEU H . . 3.480 3.062 2.605 3.475 . 0 0 "[ . 1 . 2]" 1
839 1 39 TRP H 1 47 LEU QB . . 4.320 3.886 3.542 4.148 . 0 0 "[ . 1 . 2]" 1
840 1 39 TRP H 1 48 SER HA . . 4.120 3.781 3.191 4.125 0.005 4 0 "[ . 1 . 2]" 1
841 1 39 TRP H 1 58 VAL MG1 . . 5.500 5.090 4.889 5.424 . 0 0 "[ . 1 . 2]" 1
842 1 39 TRP H 1 58 VAL MG2 . . 4.180 4.091 3.744 4.186 0.006 9 0 "[ . 1 . 2]" 1
843 1 39 TRP H 1 64 LEU MD1 . . 5.500 4.617 4.232 4.869 . 0 0 "[ . 1 . 2]" 1
844 1 39 TRP H 1 64 LEU QD . . 4.610 4.291 3.962 4.468 . 0 0 "[ . 1 . 2]" 1
845 1 39 TRP H 1 64 LEU MD2 . . 5.500 5.109 4.774 5.412 . 0 0 "[ . 1 . 2]" 1
846 1 39 TRP HA 1 39 TRP HD1 . . 4.970 3.957 3.836 4.065 . 0 0 "[ . 1 . 2]" 1
847 1 39 TRP HA 1 39 TRP HE3 . . 4.040 3.305 3.113 3.514 . 0 0 "[ . 1 . 2]" 1
848 1 39 TRP HA 1 40 LEU H . . 2.890 2.154 2.141 2.183 . 0 0 "[ . 1 . 2]" 1
849 1 39 TRP HA 1 40 LEU HB2 . . 4.860 4.390 4.281 4.863 0.003 19 0 "[ . 1 . 2]" 1
850 1 39 TRP HA 1 40 LEU HB3 . . 5.170 4.784 4.365 4.878 . 0 0 "[ . 1 . 2]" 1
851 1 39 TRP HA 1 46 VAL QG . . 5.440 3.705 3.510 3.886 . 0 0 "[ . 1 . 2]" 1
852 1 39 TRP HA 1 64 LEU MD1 . . 5.440 4.688 4.574 4.984 . 0 0 "[ . 1 . 2]" 1
853 1 39 TRP HA 1 64 LEU QD . . 4.510 3.875 3.770 4.004 . 0 0 "[ . 1 . 2]" 1
854 1 39 TRP HA 1 64 LEU MD2 . . 5.440 4.137 3.982 4.345 . 0 0 "[ . 1 . 2]" 1
855 1 39 TRP HA 1 78 THR H . . 5.070 4.705 4.300 5.055 . 0 0 "[ . 1 . 2]" 1
856 1 39 TRP HA 1 79 CYS HA . . 3.540 2.444 2.236 2.850 . 0 0 "[ . 1 . 2]" 1
857 1 39 TRP HA 1 79 CYS QB . . 5.340 4.084 3.816 4.567 . 0 0 "[ . 1 . 2]" 1
858 1 39 TRP HA 1 80 MET H . . 3.810 3.302 3.072 3.792 . 0 0 "[ . 1 . 2]" 1
859 1 39 TRP HA 1 80 MET ME . . 4.260 4.136 3.690 4.262 0.002 20 0 "[ . 1 . 2]" 1
860 1 39 TRP HA 1 80 MET HG2 . . 5.500 5.368 5.153 5.502 0.002 15 0 "[ . 1 . 2]" 1
861 1 39 TRP HA 1 80 MET HG3 . . 4.640 3.900 3.757 4.018 . 0 0 "[ . 1 . 2]" 1
862 1 39 TRP HB2 1 40 LEU H . . 4.570 4.410 4.235 4.524 . 0 0 "[ . 1 . 2]" 1
863 1 39 TRP HB2 1 41 LEU MD1 . . 4.580 4.286 4.044 4.541 . 0 0 "[ . 1 . 2]" 1
864 1 39 TRP HB2 1 41 LEU MD2 . . 4.610 4.330 3.914 4.615 0.005 16 0 "[ . 1 . 2]" 1
865 1 39 TRP HB2 1 47 LEU H . . 4.630 3.639 3.472 3.839 . 0 0 "[ . 1 . 2]" 1
866 1 39 TRP HB2 1 47 LEU QB . . 4.110 3.260 3.069 3.410 . 0 0 "[ . 1 . 2]" 1
867 1 39 TRP HB2 1 47 LEU MD1 . . 4.910 4.430 4.220 4.729 . 0 0 "[ . 1 . 2]" 1
868 1 39 TRP HB2 1 58 VAL MG2 . . 3.910 3.228 2.949 3.494 . 0 0 "[ . 1 . 2]" 1
869 1 39 TRP HB2 1 64 LEU MD1 . . 4.220 2.500 2.282 2.681 . 0 0 "[ . 1 . 2]" 1
870 1 39 TRP HB2 1 64 LEU QD . . 3.610 2.335 2.148 2.529 . 0 0 "[ . 1 . 2]" 1
871 1 39 TRP HB2 1 64 LEU MD2 . . 4.220 2.834 2.455 3.098 . 0 0 "[ . 1 . 2]" 1
872 1 39 TRP HB3 1 39 TRP HE3 . . 3.880 2.557 2.491 2.637 . 0 0 "[ . 1 . 2]" 1
873 1 39 TRP HB3 1 40 LEU H . . 3.920 3.516 3.142 3.811 . 0 0 "[ . 1 . 2]" 1
874 1 39 TRP HB3 1 41 LEU MD1 . . 3.720 3.500 3.264 3.651 . 0 0 "[ . 1 . 2]" 1
875 1 39 TRP HB3 1 41 LEU MD2 . . 4.390 4.036 3.565 4.379 . 0 0 "[ . 1 . 2]" 1
876 1 39 TRP HB3 1 47 LEU H . . 5.070 4.403 4.227 4.547 . 0 0 "[ . 1 . 2]" 1
877 1 39 TRP HB3 1 47 LEU QB . . 4.510 4.426 4.166 4.516 0.006 17 0 "[ . 1 . 2]" 1
878 1 39 TRP HB3 1 58 VAL MG2 . . 4.810 4.502 4.153 4.797 . 0 0 "[ . 1 . 2]" 1
879 1 39 TRP HB3 1 64 LEU MD1 . . 4.140 3.060 2.874 3.334 . 0 0 "[ . 1 . 2]" 1
880 1 39 TRP HB3 1 64 LEU QD . . 3.480 2.073 1.949 2.281 . 0 0 "[ . 1 . 2]" 1
881 1 39 TRP HB3 1 64 LEU MD2 . . 4.140 2.112 1.971 2.355 . 0 0 "[ . 1 . 2]" 1
882 1 39 TRP HD1 1 47 LEU QB . . 5.070 4.853 4.630 5.052 . 0 0 "[ . 1 . 2]" 1
883 1 39 TRP HD1 1 58 VAL MG1 . . 3.110 2.729 2.442 3.041 . 0 0 "[ . 1 . 2]" 1
884 1 39 TRP HD1 1 58 VAL MG2 . . 2.930 2.312 1.986 2.606 . 0 0 "[ . 1 . 2]" 1
885 1 39 TRP HD1 1 64 LEU HB2 . . 5.270 4.102 3.587 4.505 . 0 0 "[ . 1 . 2]" 1
886 1 39 TRP HD1 1 64 LEU QD . . 3.870 2.557 2.242 2.855 . 0 0 "[ . 1 . 2]" 1
887 1 39 TRP HE1 1 58 VAL MG1 . . 3.500 3.121 2.681 3.499 . 0 0 "[ . 1 . 2]" 1
888 1 39 TRP HE1 1 58 VAL MG2 . . 4.160 3.875 3.505 4.161 0.001 4 0 "[ . 1 . 2]" 1
889 1 39 TRP HE1 1 62 GLY QA . . 4.100 3.738 3.478 3.992 . 0 0 "[ . 1 . 2]" 1
890 1 39 TRP HE1 1 63 THR HA . . 4.200 3.984 3.674 4.199 . 0 0 "[ . 1 . 2]" 1
891 1 39 TRP HE1 1 64 LEU H . . 4.430 4.171 3.789 4.431 0.001 4 0 "[ . 1 . 2]" 1
892 1 39 TRP HE1 1 64 LEU HB2 . . 4.090 3.302 2.847 3.585 . 0 0 "[ . 1 . 2]" 1
893 1 39 TRP HE1 1 64 LEU HB3 . . 5.330 5.025 4.518 5.313 . 0 0 "[ . 1 . 2]" 1
894 1 39 TRP HE1 1 64 LEU QD . . 4.400 3.216 2.960 3.447 . 0 0 "[ . 1 . 2]" 1
895 1 39 TRP HE3 1 40 LEU H . . 4.260 3.910 3.510 4.239 . 0 0 "[ . 1 . 2]" 1
896 1 39 TRP HE3 1 41 LEU MD1 . . 5.040 4.571 4.174 4.877 . 0 0 "[ . 1 . 2]" 1
897 1 39 TRP HE3 1 64 LEU QD . . 3.630 2.522 2.264 2.901 . 0 0 "[ . 1 . 2]" 1
898 1 39 TRP HE3 1 77 TYR HB2 . . 4.130 3.680 3.357 4.130 0.000 2 0 "[ . 1 . 2]" 1
899 1 39 TRP HE3 1 77 TYR QB . . 3.630 2.295 2.019 2.600 . 0 0 "[ . 1 . 2]" 1
900 1 39 TRP HE3 1 77 TYR HB3 . . 4.130 2.319 2.035 2.628 . 0 0 "[ . 1 . 2]" 1
901 1 39 TRP HE3 1 78 THR H . . 4.390 3.853 3.198 4.247 . 0 0 "[ . 1 . 2]" 1
902 1 39 TRP HE3 1 79 CYS H . . 5.230 4.518 4.251 4.987 . 0 0 "[ . 1 . 2]" 1
903 1 39 TRP HE3 1 79 CYS HA . . 4.770 3.754 3.558 4.058 . 0 0 "[ . 1 . 2]" 1
904 1 39 TRP HH2 1 64 LEU HB2 . . 5.500 4.325 3.727 4.768 . 0 0 "[ . 1 . 2]" 1
905 1 39 TRP HH2 1 64 LEU HB3 . . 5.200 4.707 4.297 5.083 . 0 0 "[ . 1 . 2]" 1
906 1 39 TRP HH2 1 79 CYS QB . . 4.190 3.072 2.893 3.388 . 0 0 "[ . 1 . 2]" 1
907 1 39 TRP HH2 1 92 ALA MB . . 4.680 4.196 3.539 4.651 . 0 0 "[ . 1 . 2]" 1
908 1 39 TRP HZ2 1 63 THR HA . . 4.230 3.354 3.020 3.709 . 0 0 "[ . 1 . 2]" 1
909 1 39 TRP HZ2 1 64 LEU H . . 3.930 3.465 3.107 3.800 . 0 0 "[ . 1 . 2]" 1
910 1 39 TRP HZ2 1 64 LEU HB2 . . 4.760 3.435 3.113 3.668 . 0 0 "[ . 1 . 2]" 1
911 1 39 TRP HZ2 1 64 LEU HB3 . . 5.010 4.544 4.235 4.761 . 0 0 "[ . 1 . 2]" 1
912 1 39 TRP HZ2 1 79 CYS QB . . 4.520 3.376 2.968 3.773 . 0 0 "[ . 1 . 2]" 1
913 1 39 TRP HZ3 1 64 LEU QD . . 5.290 3.601 3.172 4.013 . 0 0 "[ . 1 . 2]" 1
914 1 39 TRP HZ3 1 77 TYR HB2 . . 4.080 3.066 2.770 3.367 . 0 0 "[ . 1 . 2]" 1
915 1 39 TRP HZ3 1 77 TYR HB3 . . 4.080 2.989 2.475 3.359 . 0 0 "[ . 1 . 2]" 1
916 1 39 TRP HZ3 1 79 CYS H . . 4.960 4.166 3.821 4.775 . 0 0 "[ . 1 . 2]" 1
917 1 39 TRP HZ3 1 79 CYS HB2 . . 5.110 3.322 2.900 5.092 . 0 0 "[ . 1 . 2]" 1
918 1 39 TRP HZ3 1 79 CYS QB . . 4.400 3.169 2.851 3.561 . 0 0 "[ . 1 . 2]" 1
919 1 39 TRP HZ3 1 79 CYS HB3 . . 5.110 4.484 3.347 5.083 . 0 0 "[ . 1 . 2]" 1
920 1 39 TRP HZ3 1 92 ALA MB . . 4.580 3.593 3.181 3.844 . 0 0 "[ . 1 . 2]" 1
921 1 40 LEU H 1 40 LEU HB2 . . 3.610 2.555 2.371 2.901 . 0 0 "[ . 1 . 2]" 1
922 1 40 LEU H 1 40 LEU HB3 . . 3.430 2.657 2.240 2.733 . 0 0 "[ . 1 . 2]" 1
923 1 40 LEU H 1 40 LEU MD1 . . 4.830 4.268 4.166 4.398 . 0 0 "[ . 1 . 2]" 1
924 1 40 LEU H 1 40 LEU QD . . 3.980 3.751 3.710 3.791 . 0 0 "[ . 1 . 2]" 1
925 1 40 LEU H 1 40 LEU MD2 . . 4.830 4.162 4.027 4.226 . 0 0 "[ . 1 . 2]" 1
926 1 40 LEU H 1 40 LEU HG . . 4.550 4.464 4.256 4.559 0.009 12 0 "[ . 1 . 2]" 1
927 1 40 LEU H 1 41 LEU H . . 5.010 4.540 4.444 4.589 . 0 0 "[ . 1 . 2]" 1
928 1 40 LEU H 1 46 VAL QG . . 4.960 3.203 2.883 3.372 . 0 0 "[ . 1 . 2]" 1
929 1 40 LEU H 1 78 THR H . . 3.810 3.280 2.821 3.764 . 0 0 "[ . 1 . 2]" 1
930 1 40 LEU H 1 78 THR HB . . 4.010 3.576 3.136 4.006 . 0 0 "[ . 1 . 2]" 1
931 1 40 LEU H 1 78 THR MG . . 4.620 4.341 4.187 4.542 . 0 0 "[ . 1 . 2]" 1
932 1 40 LEU H 1 79 CYS HA . . 4.590 3.465 3.187 3.829 . 0 0 "[ . 1 . 2]" 1
933 1 40 LEU H 1 80 MET H . . 5.240 4.282 4.010 4.931 . 0 0 "[ . 1 . 2]" 1
934 1 40 LEU H 1 80 MET ME . . 3.670 3.338 2.829 3.667 . 0 0 "[ . 1 . 2]" 1
935 1 40 LEU H 1 80 MET HG2 . . 5.300 4.889 4.458 5.238 . 0 0 "[ . 1 . 2]" 1
936 1 40 LEU H 1 80 MET HG3 . . 4.580 3.669 3.223 4.047 . 0 0 "[ . 1 . 2]" 1
937 1 40 LEU HA 1 40 LEU MD1 . . 4.460 3.576 2.630 3.785 . 0 0 "[ . 1 . 2]" 1
938 1 40 LEU HA 1 40 LEU QD . . 3.120 2.915 2.597 3.027 . 0 0 "[ . 1 . 2]" 1
939 1 40 LEU HA 1 40 LEU MD2 . . 4.460 3.151 2.763 4.018 . 0 0 "[ . 1 . 2]" 1
940 1 40 LEU HA 1 40 LEU HG . . 3.950 2.415 2.329 3.100 . 0 0 "[ . 1 . 2]" 1
941 1 40 LEU HA 1 41 LEU H . . 2.850 2.209 2.146 2.274 . 0 0 "[ . 1 . 2]" 1
942 1 40 LEU HA 1 41 LEU HA . . 4.510 4.373 4.364 4.388 . 0 0 "[ . 1 . 2]" 1
943 1 40 LEU HA 1 41 LEU HB2 . . 4.730 4.670 4.586 4.747 0.017 16 0 "[ . 1 . 2]" 1
944 1 40 LEU HA 1 41 LEU MD2 . . 3.430 2.555 2.350 2.728 . 0 0 "[ . 1 . 2]" 1
945 1 40 LEU HA 1 41 LEU HG . . 5.500 5.475 5.338 5.556 0.056 18 0 "[ . 1 . 2]" 1
946 1 40 LEU HA 1 46 VAL HA . . 3.390 2.137 2.020 2.283 . 0 0 "[ . 1 . 2]" 1
947 1 40 LEU HA 1 46 VAL HB . . 4.240 3.511 2.304 4.333 0.093 20 0 "[ . 1 . 2]" 1
948 1 40 LEU HA 1 46 VAL MG1 . . 3.870 3.397 2.777 3.907 0.037 18 0 "[ . 1 . 2]" 1
949 1 40 LEU HA 1 46 VAL MG2 . . 3.870 2.020 1.934 2.280 . 0 0 "[ . 1 . 2]" 1
950 1 40 LEU HA 1 80 MET ME . . 3.750 3.490 3.187 3.718 . 0 0 "[ . 1 . 2]" 1
951 1 40 LEU HB2 1 40 LEU MD1 . . 3.310 2.149 1.996 2.364 . 0 0 "[ . 1 . 2]" 1
952 1 40 LEU HB2 1 40 LEU MD2 . . 3.310 3.122 2.602 3.178 . 0 0 "[ . 1 . 2]" 1
953 1 40 LEU HB2 1 41 LEU H . . 4.550 4.201 3.865 4.388 . 0 0 "[ . 1 . 2]" 1
954 1 40 LEU HB2 1 46 VAL HA . . 4.940 4.368 4.117 4.691 . 0 0 "[ . 1 . 2]" 1
955 1 40 LEU HB2 1 46 VAL QG . . 4.830 2.312 1.939 2.782 . 0 0 "[ . 1 . 2]" 1
956 1 40 LEU HB2 1 78 THR H . . 4.880 4.473 4.101 4.758 . 0 0 "[ . 1 . 2]" 1
957 1 40 LEU HB2 1 78 THR HB . . 3.770 3.435 3.120 3.772 0.002 2 0 "[ . 1 . 2]" 1
958 1 40 LEU HB2 1 78 THR MG . . 5.440 4.296 4.040 4.510 . 0 0 "[ . 1 . 2]" 1
959 1 40 LEU HB2 1 80 MET HG2 . . 4.760 4.336 3.989 4.590 . 0 0 "[ . 1 . 2]" 1
960 1 40 LEU HB2 1 80 MET HG3 . . 4.850 3.520 3.020 3.909 . 0 0 "[ . 1 . 2]" 1
961 1 40 LEU HB3 1 40 LEU MD1 . . 3.440 2.587 2.335 3.120 . 0 0 "[ . 1 . 2]" 1
962 1 40 LEU HB3 1 40 LEU QD . . 2.970 2.076 1.990 2.116 . 0 0 "[ . 1 . 2]" 1
963 1 40 LEU HB3 1 40 LEU MD2 . . 3.440 2.193 2.093 2.260 . 0 0 "[ . 1 . 2]" 1
964 1 40 LEU HB3 1 41 LEU H . . 4.860 3.863 3.672 4.159 . 0 0 "[ . 1 . 2]" 1
965 1 40 LEU HB3 1 78 THR H . . 3.890 3.070 2.794 3.283 . 0 0 "[ . 1 . 2]" 1
966 1 40 LEU HB3 1 78 THR HB . . 3.230 2.397 2.107 2.628 . 0 0 "[ . 1 . 2]" 1
967 1 40 LEU HB3 1 78 THR MG . . 4.030 3.895 3.433 4.028 . 0 0 "[ . 1 . 2]" 1
968 1 40 LEU QD 1 41 LEU H . . 4.960 2.462 1.983 2.965 . 0 0 "[ . 1 . 2]" 1
969 1 40 LEU QD 1 42 PRO HA . . 4.410 3.539 3.362 4.042 . 0 0 "[ . 1 . 2]" 1
970 1 40 LEU QD 1 43 ASN H . . 4.490 4.048 3.875 4.506 0.016 19 0 "[ . 1 . 2]" 1
971 1 40 LEU QD 1 44 GLY H . . 3.450 3.193 2.951 3.401 . 0 0 "[ . 1 . 2]" 1
972 1 40 LEU QD 1 44 GLY HA2 . . 3.100 3.095 3.003 3.135 0.035 20 0 "[ . 1 . 2]" 1
973 1 40 LEU QD 1 45 THR H . . 4.150 3.227 2.532 4.123 . 0 0 "[ . 1 . 2]" 1
974 1 40 LEU QD 1 45 THR HA . . 4.490 4.359 4.079 4.511 0.021 18 0 "[ . 1 . 2]" 1
975 1 40 LEU QD 1 78 THR H . . 4.690 3.718 3.422 4.026 . 0 0 "[ . 1 . 2]" 1
976 1 40 LEU QD 1 78 THR HB . . 3.440 3.159 2.091 3.363 . 0 0 "[ . 1 . 2]" 1
977 1 40 LEU QD 1 80 MET ME . . 2.830 2.072 1.837 2.486 . 0 0 "[ . 1 . 2]" 1
978 1 40 LEU QD 1 80 MET HG2 . . 4.560 4.345 4.118 4.563 0.003 20 0 "[ . 1 . 2]" 1
979 1 40 LEU QD 1 80 MET HG3 . . 4.940 4.229 3.846 4.537 . 0 0 "[ . 1 . 2]" 1
980 1 40 LEU MD1 1 78 THR H . . 5.500 5.044 4.822 5.330 . 0 0 "[ . 1 . 2]" 1
981 1 40 LEU MD1 1 78 THR HB . . 4.580 3.588 3.136 4.337 . 0 0 "[ . 1 . 2]" 1
982 1 40 LEU MD2 1 78 THR H . . 5.500 3.833 3.478 4.211 . 0 0 "[ . 1 . 2]" 1
983 1 40 LEU MD2 1 78 THR HB . . 4.580 3.631 2.096 4.045 . 0 0 "[ . 1 . 2]" 1
984 1 40 LEU HG 1 41 LEU H . . 4.050 2.856 2.478 3.487 . 0 0 "[ . 1 . 2]" 1
985 1 40 LEU HG 1 44 GLY HA2 . . 5.300 4.809 4.402 5.252 . 0 0 "[ . 1 . 2]" 1
986 1 40 LEU HG 1 46 VAL HA . . 4.590 3.692 3.439 4.602 0.012 19 0 "[ . 1 . 2]" 1
987 1 41 LEU H 1 41 LEU HB2 . . 3.360 2.558 2.462 2.676 . 0 0 "[ . 1 . 2]" 1
988 1 41 LEU H 1 41 LEU HB3 . . 3.860 3.673 3.614 3.740 . 0 0 "[ . 1 . 2]" 1
989 1 41 LEU H 1 41 LEU MD1 . . 3.870 3.330 3.079 3.600 . 0 0 "[ . 1 . 2]" 1
990 1 41 LEU H 1 41 LEU MD2 . . 3.170 1.898 1.747 2.024 . 0 0 "[ . 1 . 2]" 1
991 1 41 LEU H 1 41 LEU HG . . 4.040 3.965 3.770 4.096 0.056 16 0 "[ . 1 . 2]" 1
992 1 41 LEU H 1 42 PRO HD2 . . 5.150 4.807 4.791 4.819 . 0 0 "[ . 1 . 2]" 1
993 1 41 LEU H 1 43 ASN H . . 4.670 4.399 4.311 4.526 . 0 0 "[ . 1 . 2]" 1
994 1 41 LEU H 1 44 GLY H . . 4.730 4.152 3.869 4.551 . 0 0 "[ . 1 . 2]" 1
995 1 41 LEU H 1 45 THR H . . 4.470 3.407 2.699 4.479 0.009 19 0 "[ . 1 . 2]" 1
996 1 41 LEU H 1 45 THR HB . . 4.600 4.004 3.555 4.449 . 0 0 "[ . 1 . 2]" 1
997 1 41 LEU H 1 45 THR MG . . 5.130 4.718 4.078 4.940 . 0 0 "[ . 1 . 2]" 1
998 1 41 LEU H 1 46 VAL HA . . 4.020 2.979 2.418 3.448 . 0 0 "[ . 1 . 2]" 1
999 1 41 LEU H 1 46 VAL MG1 . . 5.500 4.756 4.603 5.077 . 0 0 "[ . 1 . 2]" 1
1000 1 41 LEU H 1 46 VAL QG . . 4.400 3.418 3.104 3.845 . 0 0 "[ . 1 . 2]" 1
1001 1 41 LEU H 1 46 VAL MG2 . . 5.500 3.518 3.151 4.059 . 0 0 "[ . 1 . 2]" 1
1002 1 41 LEU HA 1 41 LEU MD1 . . 3.180 2.132 2.035 2.219 . 0 0 "[ . 1 . 2]" 1
1003 1 41 LEU HA 1 41 LEU MD2 . . 3.330 3.120 2.820 3.324 . 0 0 "[ . 1 . 2]" 1
1004 1 41 LEU HA 1 41 LEU HG . . 4.050 3.787 3.738 3.813 . 0 0 "[ . 1 . 2]" 1
1005 1 41 LEU HA 1 42 PRO HD2 . . 3.310 2.377 2.347 2.395 . 0 0 "[ . 1 . 2]" 1
1006 1 41 LEU HA 1 42 PRO HD3 . . 2.950 2.292 2.281 2.298 . 0 0 "[ . 1 . 2]" 1
1007 1 41 LEU HA 1 42 PRO HG2 . . 4.690 4.494 4.469 4.509 . 0 0 "[ . 1 . 2]" 1
1008 1 41 LEU HA 1 43 ASN H . . 4.000 3.825 3.807 3.834 . 0 0 "[ . 1 . 2]" 1
1009 1 41 LEU HA 1 77 TYR QD . . 4.610 3.460 3.292 3.671 . 0 0 "[ . 1 . 2]" 1
1010 1 41 LEU HA 1 77 TYR QE . . 4.250 3.960 3.815 4.120 . 0 0 "[ . 1 . 2]" 1
1011 1 41 LEU HB2 1 41 LEU MD1 . . 3.250 3.184 3.174 3.194 . 0 0 "[ . 1 . 2]" 1
1012 1 41 LEU HB2 1 41 LEU MD2 . . 3.450 2.219 2.139 2.340 . 0 0 "[ . 1 . 2]" 1
1013 1 41 LEU HB2 1 42 PRO HD2 . . 4.070 3.528 3.440 3.574 . 0 0 "[ . 1 . 2]" 1
1014 1 41 LEU HB2 1 43 ASN H . . 4.290 2.728 2.607 2.823 . 0 0 "[ . 1 . 2]" 1
1015 1 41 LEU HB2 1 44 GLY H . . 4.080 3.258 2.777 3.637 . 0 0 "[ . 1 . 2]" 1
1016 1 41 LEU HB2 1 45 THR H . . 3.720 3.039 2.677 3.314 . 0 0 "[ . 1 . 2]" 1
1017 1 41 LEU HB2 1 45 THR HB . . 3.830 3.005 2.563 3.137 . 0 0 "[ . 1 . 2]" 1
1018 1 41 LEU HB3 1 41 LEU MD1 . . 3.280 2.363 2.251 2.452 . 0 0 "[ . 1 . 2]" 1
1019 1 41 LEU HB3 1 42 PRO HD2 . . 3.160 2.000 1.971 2.063 . 0 0 "[ . 1 . 2]" 1
1020 1 41 LEU HB3 1 43 ASN H . . 3.300 2.701 2.605 2.828 . 0 0 "[ . 1 . 2]" 1
1021 1 41 LEU HB3 1 43 ASN QD . . 4.660 2.934 1.921 4.335 . 0 0 "[ . 1 . 2]" 1
1022 1 41 LEU HB3 1 44 GLY H . . 4.480 4.223 3.906 4.493 0.013 17 0 "[ . 1 . 2]" 1
1023 1 41 LEU HB3 1 45 THR H . . 4.830 4.600 4.252 4.841 0.011 14 0 "[ . 1 . 2]" 1
1024 1 41 LEU HB3 1 45 THR HB . . 4.590 4.489 4.153 4.603 0.013 11 0 "[ . 1 . 2]" 1
1025 1 41 LEU HB3 1 77 TYR QE . . 5.230 4.210 4.015 4.442 . 0 0 "[ . 1 . 2]" 1
1026 1 41 LEU MD1 1 42 PRO HD2 . . 3.920 2.765 2.426 3.077 . 0 0 "[ . 1 . 2]" 1
1027 1 41 LEU MD1 1 42 PRO HD3 . . 4.190 3.339 3.066 3.566 . 0 0 "[ . 1 . 2]" 1
1028 1 41 LEU MD1 1 43 ASN H . . 5.070 4.569 4.406 4.703 . 0 0 "[ . 1 . 2]" 1
1029 1 41 LEU MD1 1 45 THR HB . . 4.830 4.710 4.536 4.847 0.017 18 0 "[ . 1 . 2]" 1
1030 1 41 LEU MD1 1 47 LEU H . . 4.940 4.266 3.892 4.710 . 0 0 "[ . 1 . 2]" 1
1031 1 41 LEU MD1 1 47 LEU QB . . 4.470 4.223 3.782 4.477 0.007 17 0 "[ . 1 . 2]" 1
1032 1 41 LEU MD1 1 47 LEU MD1 . . 3.210 3.071 2.797 3.213 0.003 1 0 "[ . 1 . 2]" 1
1033 1 41 LEU MD1 1 47 LEU HG . . 4.230 3.972 3.693 4.218 . 0 0 "[ . 1 . 2]" 1
1034 1 41 LEU MD1 1 56 ILE HB . . 4.550 4.531 4.387 4.560 0.010 19 0 "[ . 1 . 2]" 1
1035 1 41 LEU MD1 1 56 ILE MD . . 3.030 1.936 1.782 2.104 . 0 0 "[ . 1 . 2]" 1
1036 1 41 LEU MD1 1 56 ILE HG12 . . 4.140 3.590 3.293 3.886 . 0 0 "[ . 1 . 2]" 1
1037 1 41 LEU MD1 1 56 ILE MG . . 3.230 2.949 2.642 3.232 0.002 3 0 "[ . 1 . 2]" 1
1038 1 41 LEU MD1 1 64 LEU MD1 . . 4.540 4.218 3.972 4.458 . 0 0 "[ . 1 . 2]" 1
1039 1 41 LEU MD1 1 64 LEU QD . . 3.230 3.048 2.889 3.224 . 0 0 "[ . 1 . 2]" 1
1040 1 41 LEU MD1 1 64 LEU MD2 . . 4.540 3.128 2.954 3.330 . 0 0 "[ . 1 . 2]" 1
1041 1 41 LEU MD1 1 66 PHE QE . . 4.210 3.590 3.313 3.806 . 0 0 "[ . 1 . 2]" 1
1042 1 41 LEU MD1 1 66 PHE HZ . . 4.790 3.725 3.283 4.004 . 0 0 "[ . 1 . 2]" 1
1043 1 41 LEU MD1 1 77 TYR QD . . 3.680 2.405 2.255 2.506 . 0 0 "[ . 1 . 2]" 1
1044 1 41 LEU MD1 1 77 TYR QE . . 3.100 1.970 1.894 2.077 . 0 0 "[ . 1 . 2]" 1
1045 1 41 LEU MD1 1 77 TYR HH . . 4.610 4.205 4.020 4.407 . 0 0 "[ . 1 . 2]" 1
1046 1 41 LEU MD2 1 42 PRO HD2 . . 4.760 4.507 4.344 4.599 . 0 0 "[ . 1 . 2]" 1
1047 1 41 LEU MD2 1 43 ASN HD21 . . 5.470 4.277 3.644 5.243 . 0 0 "[ . 1 . 2]" 1
1048 1 41 LEU MD2 1 43 ASN QD . . 4.760 3.231 2.824 4.042 . 0 0 "[ . 1 . 2]" 1
1049 1 41 LEU MD2 1 43 ASN HD22 . . 5.470 3.412 2.878 5.472 0.002 6 0 "[ . 1 . 2]" 1
1050 1 41 LEU MD2 1 45 THR H . . 4.680 3.485 2.902 4.238 . 0 0 "[ . 1 . 2]" 1
1051 1 41 LEU MD2 1 45 THR HA . . 4.750 3.994 3.741 4.341 . 0 0 "[ . 1 . 2]" 1
1052 1 41 LEU MD2 1 45 THR HB . . 3.240 2.312 1.966 2.827 . 0 0 "[ . 1 . 2]" 1
1053 1 41 LEU MD2 1 46 VAL H . . 4.280 3.290 2.986 3.479 . 0 0 "[ . 1 . 2]" 1
1054 1 41 LEU MD2 1 46 VAL HA . . 3.310 2.179 1.852 2.532 . 0 0 "[ . 1 . 2]" 1
1055 1 41 LEU MD2 1 47 LEU H . . 3.640 2.762 2.219 3.233 . 0 0 "[ . 1 . 2]" 1
1056 1 41 LEU MD2 1 47 LEU HG . . 3.070 2.280 1.975 2.550 . 0 0 "[ . 1 . 2]" 1
1057 1 41 LEU MD2 1 56 ILE MD . . 3.390 3.138 2.892 3.394 0.004 19 0 "[ . 1 . 2]" 1
1058 1 41 LEU MD2 1 56 ILE MG . . 4.290 3.899 3.584 4.105 . 0 0 "[ . 1 . 2]" 1
1059 1 41 LEU MD2 1 77 TYR QE . . 4.690 4.519 4.193 4.693 0.003 6 0 "[ . 1 . 2]" 1
1060 1 41 LEU HG 1 45 THR HB . . 4.260 3.541 3.150 3.791 . 0 0 "[ . 1 . 2]" 1
1061 1 41 LEU HG 1 47 LEU MD1 . . 4.780 3.825 3.432 4.144 . 0 0 "[ . 1 . 2]" 1
1062 1 41 LEU HG 1 56 ILE MD . . 4.520 2.936 2.702 3.258 . 0 0 "[ . 1 . 2]" 1
1063 1 41 LEU HG 1 77 TYR QD . . 5.320 5.214 5.002 5.323 0.003 18 0 "[ . 1 . 2]" 1
1064 1 41 LEU HG 1 77 TYR QE . . 4.370 4.276 4.021 4.373 0.003 11 0 "[ . 1 . 2]" 1
1065 1 42 PRO HA 1 44 GLY H . . 4.750 3.883 3.556 4.530 . 0 0 "[ . 1 . 2]" 1
1066 1 42 PRO HA 1 76 VAL H . . 5.090 4.164 4.076 4.263 . 0 0 "[ . 1 . 2]" 1
1067 1 42 PRO HB2 1 43 ASN H . . 4.010 3.983 3.952 4.000 . 0 0 "[ . 1 . 2]" 1
1068 1 42 PRO HB2 1 43 ASN HA . . 4.690 4.369 4.345 4.390 . 0 0 "[ . 1 . 2]" 1
1069 1 42 PRO HB2 1 75 GLY HA2 . . 4.500 4.439 4.314 4.508 0.008 5 0 "[ . 1 . 2]" 1
1070 1 42 PRO HB2 1 75 GLY HA3 . . 4.050 3.225 3.113 3.366 . 0 0 "[ . 1 . 2]" 1
1071 1 42 PRO HB2 1 76 VAL H . . 3.340 3.054 2.850 3.262 . 0 0 "[ . 1 . 2]" 1
1072 1 42 PRO HB3 1 43 ASN H . . 4.530 4.515 4.497 4.524 . 0 0 "[ . 1 . 2]" 1
1073 1 42 PRO HB3 1 75 GLY HA2 . . 4.520 4.404 4.210 4.525 0.005 9 0 "[ . 1 . 2]" 1
1074 1 42 PRO HB3 1 75 GLY HA3 . . 3.970 3.242 2.973 3.451 . 0 0 "[ . 1 . 2]" 1
1075 1 42 PRO HB3 1 76 VAL H . . 3.860 1.919 1.895 2.024 . 0 0 "[ . 1 . 2]" 1
1076 1 42 PRO HD2 1 43 ASN H . . 3.820 3.053 3.011 3.078 . 0 0 "[ . 1 . 2]" 1
1077 1 42 PRO HD2 1 77 TYR HA . . 4.910 4.600 4.310 4.788 . 0 0 "[ . 1 . 2]" 1
1078 1 42 PRO HD2 1 77 TYR QE . . 4.340 3.796 3.624 4.017 . 0 0 "[ . 1 . 2]" 1
1079 1 42 PRO HD2 1 77 TYR HH . . 4.780 4.088 3.855 4.244 . 0 0 "[ . 1 . 2]" 1
1080 1 42 PRO HD3 1 43 ASN H . . 4.940 4.057 4.034 4.070 . 0 0 "[ . 1 . 2]" 1
1081 1 42 PRO HD3 1 77 TYR HA . . 4.390 3.014 2.672 3.272 . 0 0 "[ . 1 . 2]" 1
1082 1 42 PRO HD3 1 77 TYR QE . . 4.370 3.859 3.666 4.007 . 0 0 "[ . 1 . 2]" 1
1083 1 42 PRO HD3 1 77 TYR HH . . 4.770 4.548 4.416 4.724 . 0 0 "[ . 1 . 2]" 1
1084 1 42 PRO HG2 1 43 ASN H . . 4.450 3.383 3.322 3.416 . 0 0 "[ . 1 . 2]" 1
1085 1 42 PRO HG2 1 75 GLY HA2 . . 5.080 5.001 4.807 5.082 0.002 6 0 "[ . 1 . 2]" 1
1086 1 42 PRO HG2 1 75 GLY HA3 . . 3.560 3.305 3.098 3.401 . 0 0 "[ . 1 . 2]" 1
1087 1 42 PRO HG2 1 76 VAL H . . 4.010 3.801 3.541 3.971 . 0 0 "[ . 1 . 2]" 1
1088 1 42 PRO HG2 1 77 TYR HH . . 4.730 4.426 4.161 4.659 . 0 0 "[ . 1 . 2]" 1
1089 1 42 PRO HG3 1 43 ASN H . . 4.860 4.645 4.599 4.670 . 0 0 "[ . 1 . 2]" 1
1090 1 42 PRO HG3 1 75 GLY HA2 . . 4.250 3.970 3.805 4.148 . 0 0 "[ . 1 . 2]" 1
1091 1 42 PRO HG3 1 75 GLY HA3 . . 3.610 2.274 2.120 2.485 . 0 0 "[ . 1 . 2]" 1
1092 1 42 PRO HG3 1 76 VAL H . . 4.310 2.363 2.032 2.671 . 0 0 "[ . 1 . 2]" 1
1093 1 42 PRO HG3 1 76 VAL HB . . 4.930 4.767 4.545 4.932 0.002 20 0 "[ . 1 . 2]" 1
1094 1 42 PRO HG3 1 77 TYR QE . . 4.250 3.757 3.351 4.095 . 0 0 "[ . 1 . 2]" 1
1095 1 42 PRO HG3 1 77 TYR HH . . 4.340 4.016 3.835 4.294 . 0 0 "[ . 1 . 2]" 1
1096 1 43 ASN H 1 43 ASN HB2 . . 3.850 3.601 3.218 3.705 . 0 0 "[ . 1 . 2]" 1
1097 1 43 ASN H 1 43 ASN QB . . 3.140 2.742 2.212 3.016 . 0 0 "[ . 1 . 2]" 1
1098 1 43 ASN H 1 43 ASN HB3 . . 3.850 2.871 2.253 3.266 . 0 0 "[ . 1 . 2]" 1
1099 1 43 ASN H 1 44 GLY H . . 2.970 2.187 2.116 2.287 . 0 0 "[ . 1 . 2]" 1
1100 1 43 ASN H 1 44 GLY HA2 . . 4.670 4.577 4.480 4.670 0.000 9 0 "[ . 1 . 2]" 1
1101 1 43 ASN QB 1 44 GLY H . . 4.240 3.631 2.785 3.878 . 0 0 "[ . 1 . 2]" 1
1102 1 43 ASN HB2 1 44 GLY H . . 5.040 4.097 3.754 4.457 . 0 0 "[ . 1 . 2]" 1
1103 1 43 ASN HB3 1 44 GLY H . . 5.040 4.147 2.834 4.533 . 0 0 "[ . 1 . 2]" 1
1104 1 43 ASN QD 1 45 THR MG . . 4.400 3.592 3.353 3.979 . 0 0 "[ . 1 . 2]" 1
1105 1 43 ASN HD21 1 45 THR MG . . 5.240 4.540 3.852 5.241 0.001 20 0 "[ . 1 . 2]" 1
1106 1 43 ASN HD22 1 45 THR MG . . 5.240 3.827 3.478 4.662 . 0 0 "[ . 1 . 2]" 1
1107 1 44 GLY H 1 44 GLY HA2 . . 2.900 2.446 2.343 2.572 . 0 0 "[ . 1 . 2]" 1
1108 1 44 GLY H 1 45 THR H . . 3.080 2.438 1.933 2.896 . 0 0 "[ . 1 . 2]" 1
1109 1 44 GLY H 1 45 THR HA . . 5.390 4.945 4.599 5.155 . 0 0 "[ . 1 . 2]" 1
1110 1 44 GLY H 1 45 THR HB . . 5.500 4.678 4.178 5.092 . 0 0 "[ . 1 . 2]" 1
1111 1 44 GLY HA2 1 45 THR HA . . 4.910 4.475 4.309 4.755 . 0 0 "[ . 1 . 2]" 1
1112 1 45 THR H 1 45 THR HB . . 3.370 2.984 2.641 3.258 . 0 0 "[ . 1 . 2]" 1
1113 1 45 THR H 1 45 THR MG . . 4.160 3.931 3.736 4.068 . 0 0 "[ . 1 . 2]" 1
1114 1 45 THR H 1 46 VAL H . . 4.730 4.452 4.353 4.607 . 0 0 "[ . 1 . 2]" 1
1115 1 45 THR HA 1 45 THR MG . . 2.890 2.168 2.040 2.339 . 0 0 "[ . 1 . 2]" 1
1116 1 45 THR HA 1 46 VAL H . . 2.690 2.482 2.393 2.585 . 0 0 "[ . 1 . 2]" 1
1117 1 45 THR HA 1 46 VAL HA . . 5.060 4.533 4.485 4.613 . 0 0 "[ . 1 . 2]" 1
1118 1 45 THR HA 1 46 VAL HB . . 4.610 4.404 4.245 4.601 . 0 0 "[ . 1 . 2]" 1
1119 1 45 THR HA 1 46 VAL QG . . 3.670 3.402 3.235 3.625 . 0 0 "[ . 1 . 2]" 1
1120 1 45 THR HB 1 46 VAL H . . 3.720 3.202 2.821 3.519 . 0 0 "[ . 1 . 2]" 1
1121 1 45 THR HB 1 46 VAL HA . . 5.430 4.258 4.002 4.505 . 0 0 "[ . 1 . 2]" 1
1122 1 45 THR MG 1 46 VAL H . . 3.180 1.776 1.743 1.832 . 0 0 "[ . 1 . 2]" 1
1123 1 45 THR MG 1 46 VAL HA . . 4.560 3.711 3.353 3.958 . 0 0 "[ . 1 . 2]" 1
1124 1 45 THR MG 1 46 VAL HB . . 4.780 4.306 4.023 4.662 . 0 0 "[ . 1 . 2]" 1
1125 1 45 THR MG 1 47 LEU H . . 4.880 4.497 4.180 4.818 . 0 0 "[ . 1 . 2]" 1
1126 1 45 THR MG 1 47 LEU HA . . 4.670 4.404 4.199 4.593 . 0 0 "[ . 1 . 2]" 1
1127 1 45 THR MG 1 47 LEU MD2 . . 3.230 3.127 2.951 3.233 0.003 20 0 "[ . 1 . 2]" 1
1128 1 45 THR MG 1 47 LEU HG . . 3.750 3.566 3.004 3.755 0.005 19 0 "[ . 1 . 2]" 1
1129 1 45 THR MG 1 53 HIS HD2 . . 5.470 5.298 4.703 5.473 0.003 8 0 "[ . 1 . 2]" 1
1130 1 46 VAL H 1 46 VAL HB . . 3.430 3.084 2.758 3.489 0.059 15 0 "[ . 1 . 2]" 1
1131 1 46 VAL H 1 46 VAL MG1 . . 4.090 3.256 2.188 3.965 . 0 0 "[ . 1 . 2]" 1
1132 1 46 VAL H 1 46 VAL QG . . 3.090 2.696 2.178 3.096 0.006 17 0 "[ . 1 . 2]" 1
1133 1 46 VAL H 1 46 VAL MG2 . . 4.090 3.438 2.985 4.027 . 0 0 "[ . 1 . 2]" 1
1134 1 46 VAL H 1 47 LEU H . . 4.590 4.227 4.056 4.356 . 0 0 "[ . 1 . 2]" 1
1135 1 46 VAL HA 1 46 VAL MG1 . . 3.210 2.733 2.320 3.199 . 0 0 "[ . 1 . 2]" 1
1136 1 46 VAL HA 1 46 VAL QG . . 2.770 2.198 2.107 2.332 . 0 0 "[ . 1 . 2]" 1
1137 1 46 VAL HA 1 46 VAL MG2 . . 3.210 2.366 2.292 2.433 . 0 0 "[ . 1 . 2]" 1
1138 1 46 VAL HA 1 47 LEU H . . 2.880 2.181 2.145 2.246 . 0 0 "[ . 1 . 2]" 1
1139 1 46 VAL HA 1 47 LEU QB . . 4.780 4.348 4.250 4.433 . 0 0 "[ . 1 . 2]" 1
1140 1 46 VAL HA 1 47 LEU HG . . 5.000 3.855 3.722 4.209 . 0 0 "[ . 1 . 2]" 1
1141 1 46 VAL HB 1 47 LEU H . . 4.350 4.117 3.915 4.260 . 0 0 "[ . 1 . 2]" 1
1142 1 46 VAL QG 1 47 LEU H . . 3.050 2.283 2.025 2.684 . 0 0 "[ . 1 . 2]" 1
1143 1 46 VAL QG 1 48 SER QB . . 4.600 3.692 3.491 4.048 . 0 0 "[ . 1 . 2]" 1
1144 1 46 VAL QG 1 80 MET H . . 5.440 4.724 4.482 4.996 . 0 0 "[ . 1 . 2]" 1
1145 1 46 VAL QG 1 80 MET ME . . 2.560 1.738 1.593 1.862 . 0 0 "[ . 1 . 2]" 1
1146 1 46 VAL QG 1 80 MET HG3 . . 5.280 3.534 3.330 3.757 . 0 0 "[ . 1 . 2]" 1
1147 1 46 VAL MG1 1 47 LEU H . . 4.130 2.942 2.033 4.043 . 0 0 "[ . 1 . 2]" 1
1148 1 46 VAL MG1 1 80 MET ME . . 2.970 2.385 1.740 2.976 0.006 19 0 "[ . 1 . 2]" 1
1149 1 46 VAL MG2 1 47 LEU H . . 4.130 3.270 2.207 4.033 . 0 0 "[ . 1 . 2]" 1
1150 1 46 VAL MG2 1 80 MET ME . . 2.970 1.833 1.698 2.099 . 0 0 "[ . 1 . 2]" 1
1151 1 47 LEU H 1 47 LEU QB . . 3.410 2.475 2.330 2.543 . 0 0 "[ . 1 . 2]" 1
1152 1 47 LEU H 1 47 LEU MD1 . . 4.490 3.850 3.447 4.131 . 0 0 "[ . 1 . 2]" 1
1153 1 47 LEU H 1 47 LEU MD2 . . 4.300 3.875 3.686 3.973 . 0 0 "[ . 1 . 2]" 1
1154 1 47 LEU H 1 47 LEU HG . . 3.790 2.882 2.581 3.188 . 0 0 "[ . 1 . 2]" 1
1155 1 47 LEU H 1 58 VAL MG2 . . 5.500 4.922 4.542 5.296 . 0 0 "[ . 1 . 2]" 1
1156 1 47 LEU HA 1 47 LEU MD1 . . 3.990 3.890 3.834 3.944 . 0 0 "[ . 1 . 2]" 1
1157 1 47 LEU HA 1 47 LEU MD2 . . 2.880 2.150 1.958 2.519 . 0 0 "[ . 1 . 2]" 1
1158 1 47 LEU HA 1 47 LEU HG . . 3.790 3.026 2.931 3.101 . 0 0 "[ . 1 . 2]" 1
1159 1 47 LEU HA 1 48 SER H . . 2.900 2.477 2.306 2.628 . 0 0 "[ . 1 . 2]" 1
1160 1 47 LEU HA 1 48 SER QB . . 4.740 4.059 3.808 4.477 . 0 0 "[ . 1 . 2]" 1
1161 1 47 LEU HA 1 51 SER H . . 5.280 4.738 4.448 4.960 . 0 0 "[ . 1 . 2]" 1
1162 1 47 LEU HA 1 51 SER HB2 . . 4.360 3.656 2.946 4.040 . 0 0 "[ . 1 . 2]" 1
1163 1 47 LEU HA 1 51 SER HB3 . . 4.360 3.633 2.783 4.246 . 0 0 "[ . 1 . 2]" 1
1164 1 47 LEU HA 1 58 VAL MG2 . . 5.110 4.962 4.548 5.114 0.004 3 0 "[ . 1 . 2]" 1
1165 1 47 LEU QB 1 47 LEU MD1 . . 2.920 2.085 2.055 2.099 . 0 0 "[ . 1 . 2]" 1
1166 1 47 LEU QB 1 47 LEU MD2 . . 3.070 2.212 2.037 2.300 . 0 0 "[ . 1 . 2]" 1
1167 1 47 LEU QB 1 48 SER H . . 3.380 2.242 1.956 2.626 . 0 0 "[ . 1 . 2]" 1
1168 1 47 LEU QB 1 48 SER HA . . 4.200 3.879 3.782 3.967 . 0 0 "[ . 1 . 2]" 1
1169 1 47 LEU QB 1 51 SER H . . 5.300 4.540 4.352 4.826 . 0 0 "[ . 1 . 2]" 1
1170 1 47 LEU QB 1 51 SER HB2 . . 4.540 2.914 2.436 3.620 . 0 0 "[ . 1 . 2]" 1
1171 1 47 LEU QB 1 51 SER QB . . 3.930 2.569 2.237 3.050 . 0 0 "[ . 1 . 2]" 1
1172 1 47 LEU QB 1 51 SER HB3 . . 4.540 3.027 2.450 3.793 . 0 0 "[ . 1 . 2]" 1
1173 1 47 LEU QB 1 56 ILE MG . . 4.840 2.801 2.496 3.053 . 0 0 "[ . 1 . 2]" 1
1174 1 47 LEU QB 1 58 VAL MG2 . . 3.300 3.021 2.833 3.199 . 0 0 "[ . 1 . 2]" 1
1175 1 47 LEU QB 1 64 LEU QD . . 4.140 3.381 3.225 3.702 . 0 0 "[ . 1 . 2]" 1
1176 1 47 LEU MD1 1 48 SER H . . 4.510 4.309 4.071 4.505 . 0 0 "[ . 1 . 2]" 1
1177 1 47 LEU MD1 1 51 SER HB2 . . 4.590 3.881 3.508 4.302 . 0 0 "[ . 1 . 2]" 1
1178 1 47 LEU MD1 1 51 SER HB3 . . 4.590 4.013 3.596 4.389 . 0 0 "[ . 1 . 2]" 1
1179 1 47 LEU MD1 1 53 HIS H . . 4.700 4.076 3.715 4.257 . 0 0 "[ . 1 . 2]" 1
1180 1 47 LEU MD1 1 53 HIS HA . . 5.280 4.484 4.165 4.663 . 0 0 "[ . 1 . 2]" 1
1181 1 47 LEU MD1 1 53 HIS HB2 . . 4.220 2.446 2.166 2.605 . 0 0 "[ . 1 . 2]" 1
1182 1 47 LEU MD1 1 53 HIS QB . . 3.660 2.274 1.907 2.439 . 0 0 "[ . 1 . 2]" 1
1183 1 47 LEU MD1 1 53 HIS HB3 . . 4.220 2.717 2.118 2.957 . 0 0 "[ . 1 . 2]" 1
1184 1 47 LEU MD1 1 53 HIS HD2 . . 4.350 2.367 2.060 2.712 . 0 0 "[ . 1 . 2]" 1
1185 1 47 LEU MD1 1 56 ILE MD . . 3.470 1.871 1.763 2.299 . 0 0 "[ . 1 . 2]" 1
1186 1 47 LEU MD1 1 56 ILE MG . . 2.950 1.906 1.714 2.090 . 0 0 "[ . 1 . 2]" 1
1187 1 47 LEU MD1 1 64 LEU QD . . 3.610 3.372 3.169 3.610 . 0 0 "[ . 1 . 2]" 1
1188 1 47 LEU MD2 1 48 SER H . . 3.750 3.163 2.863 3.366 . 0 0 "[ . 1 . 2]" 1
1189 1 47 LEU MD2 1 51 SER H . . 4.820 4.431 4.189 4.556 . 0 0 "[ . 1 . 2]" 1
1190 1 47 LEU MD2 1 51 SER HA . . 4.910 3.960 3.669 4.370 . 0 0 "[ . 1 . 2]" 1
1191 1 47 LEU MD2 1 51 SER HB2 . . 3.570 2.355 1.941 2.869 . 0 0 "[ . 1 . 2]" 1
1192 1 47 LEU MD2 1 51 SER QB . . 3.070 2.036 1.806 2.453 . 0 0 "[ . 1 . 2]" 1
1193 1 47 LEU MD2 1 51 SER HB3 . . 3.570 2.381 1.971 3.057 . 0 0 "[ . 1 . 2]" 1
1194 1 47 LEU MD2 1 53 HIS H . . 4.000 3.612 3.132 3.950 . 0 0 "[ . 1 . 2]" 1
1195 1 47 LEU MD2 1 53 HIS HB2 . . 3.870 2.425 2.045 2.623 . 0 0 "[ . 1 . 2]" 1
1196 1 47 LEU MD2 1 53 HIS QB . . 3.220 2.395 2.025 2.583 . 0 0 "[ . 1 . 2]" 1
1197 1 47 LEU MD2 1 53 HIS HB3 . . 3.870 3.735 3.259 3.876 0.006 5 0 "[ . 1 . 2]" 1
1198 1 47 LEU MD2 1 53 HIS HD2 . . 3.720 2.536 2.075 3.198 . 0 0 "[ . 1 . 2]" 1
1199 1 47 LEU HG 1 48 SER H . . 4.830 4.762 4.652 4.835 0.005 11 0 "[ . 1 . 2]" 1
1200 1 47 LEU HG 1 51 SER HB2 . . 5.490 4.948 4.643 5.246 . 0 0 "[ . 1 . 2]" 1
1201 1 47 LEU HG 1 51 SER QB . . 4.740 4.434 4.172 4.600 . 0 0 "[ . 1 . 2]" 1
1202 1 47 LEU HG 1 51 SER HB3 . . 5.490 5.021 4.721 5.353 . 0 0 "[ . 1 . 2]" 1
1203 1 48 SER H 1 48 SER QB . . 3.690 3.057 2.690 3.335 . 0 0 "[ . 1 . 2]" 1
1204 1 48 SER H 1 51 SER H . . 3.850 2.945 2.685 3.134 . 0 0 "[ . 1 . 2]" 1
1205 1 48 SER H 1 51 SER HB2 . . 4.160 2.796 1.912 3.730 . 0 0 "[ . 1 . 2]" 1
1206 1 48 SER H 1 51 SER QB . . 3.500 2.157 1.872 2.825 . 0 0 "[ . 1 . 2]" 1
1207 1 48 SER H 1 51 SER HB3 . . 4.160 2.821 1.895 4.025 . 0 0 "[ . 1 . 2]" 1
1208 1 48 SER H 1 58 VAL MG2 . . 4.200 3.595 3.286 4.055 . 0 0 "[ . 1 . 2]" 1
1209 1 48 SER HA 1 51 SER H . . 5.500 4.781 4.561 5.133 . 0 0 "[ . 1 . 2]" 1
1210 1 48 SER HA 1 58 VAL HB . . 4.580 4.238 3.472 4.559 . 0 0 "[ . 1 . 2]" 1
1211 1 48 SER HA 1 58 VAL MG1 . . 3.760 3.442 3.031 3.755 . 0 0 "[ . 1 . 2]" 1
1212 1 48 SER HA 1 58 VAL MG2 . . 3.240 2.787 2.316 3.207 . 0 0 "[ . 1 . 2]" 1
1213 1 48 SER QB 1 58 VAL MG2 . . 4.880 4.332 4.087 4.624 . 0 0 "[ . 1 . 2]" 1
1214 1 49 HIS HA 1 58 VAL HB . . 3.490 2.533 2.082 3.122 . 0 0 "[ . 1 . 2]" 1
1215 1 49 HIS QB 1 58 VAL HB . . 4.620 4.133 3.754 4.623 0.003 11 0 "[ . 1 . 2]" 1
1216 1 49 HIS QB 1 58 VAL MG1 . . 4.150 3.376 2.794 4.123 . 0 0 "[ . 1 . 2]" 1
1217 1 49 HIS HE1 1 59 LEU HA . . 4.880 4.532 3.200 4.882 0.002 11 0 "[ . 1 . 2]" 1
1218 1 49 HIS HE1 1 60 ASN HA . . 5.090 2.903 2.068 4.646 . 0 0 "[ . 1 . 2]" 1
1219 1 49 HIS HE1 1 60 ASN HB2 . . 5.270 4.326 3.089 5.271 0.001 5 0 "[ . 1 . 2]" 1
1220 1 49 HIS HE1 1 60 ASN QB . . 4.620 3.611 2.316 4.579 . 0 0 "[ . 1 . 2]" 1
1221 1 49 HIS HE1 1 60 ASN HB3 . . 5.270 4.182 2.335 5.272 0.002 6 0 "[ . 1 . 2]" 1
1222 1 50 ALA MB 1 51 SER H . . 3.650 2.330 1.959 2.528 . 0 0 "[ . 1 . 2]" 1
1223 1 50 ALA MB 1 51 SER HA . . 4.590 3.671 3.578 3.753 . 0 0 "[ . 1 . 2]" 1
1224 1 51 SER H 1 51 SER HB2 . . 3.700 2.985 2.232 3.617 . 0 0 "[ . 1 . 2]" 1
1225 1 51 SER H 1 51 SER QB . . 3.070 2.402 2.172 2.858 . 0 0 "[ . 1 . 2]" 1
1226 1 51 SER H 1 51 SER HB3 . . 3.700 2.915 2.194 3.622 . 0 0 "[ . 1 . 2]" 1
1227 1 51 SER HA 1 52 ARG QB . . 4.440 4.108 3.920 4.438 . 0 0 "[ . 1 . 2]" 1
1228 1 51 SER HA 1 53 HIS H . . 4.610 3.898 3.655 4.293 . 0 0 "[ . 1 . 2]" 1
1229 1 51 SER QB 1 53 HIS H . . 3.840 2.772 2.429 3.537 . 0 0 "[ . 1 . 2]" 1
1230 1 51 SER HB2 1 52 ARG H . . 5.320 3.521 2.483 4.269 . 0 0 "[ . 1 . 2]" 1
1231 1 51 SER HB2 1 53 HIS H . . 4.550 3.301 2.494 4.366 . 0 0 "[ . 1 . 2]" 1
1232 1 51 SER HB3 1 52 ARG H . . 5.320 3.569 2.490 4.266 . 0 0 "[ . 1 . 2]" 1
1233 1 51 SER HB3 1 53 HIS H . . 4.550 3.511 2.456 4.325 . 0 0 "[ . 1 . 2]" 1
1234 1 52 ARG QB 1 52 ARG QD . . 2.990 2.172 1.990 2.568 . 0 0 "[ . 1 . 2]" 1
1235 1 52 ARG HB2 1 53 HIS H . . 4.660 4.361 4.028 4.600 . 0 0 "[ . 1 . 2]" 1
1236 1 52 ARG HB3 1 53 HIS H . . 4.660 4.188 3.682 4.600 . 0 0 "[ . 1 . 2]" 1
1237 1 52 ARG QG 1 53 HIS H . . 5.070 4.187 3.248 4.734 . 0 0 "[ . 1 . 2]" 1
1238 1 53 HIS H 1 53 HIS HB2 . . 3.110 2.220 2.193 2.317 . 0 0 "[ . 1 . 2]" 1
1239 1 53 HIS H 1 53 HIS HB3 . . 3.110 2.933 2.773 3.068 . 0 0 "[ . 1 . 2]" 1
1240 1 53 HIS H 1 53 HIS HD2 . . 4.860 4.657 4.507 4.886 0.026 17 0 "[ . 1 . 2]" 1
1241 1 53 HIS H 1 54 PRO HD2 . . 4.950 4.753 4.690 4.806 . 0 0 "[ . 1 . 2]" 1
1242 1 53 HIS H 1 54 PRO HD3 . . 4.910 4.766 4.661 4.854 . 0 0 "[ . 1 . 2]" 1
1243 1 53 HIS HA 1 53 HIS HD2 . . 4.610 3.735 3.711 3.774 . 0 0 "[ . 1 . 2]" 1
1244 1 53 HIS HA 1 54 PRO HA . . 4.550 4.424 4.408 4.430 . 0 0 "[ . 1 . 2]" 1
1245 1 53 HIS HA 1 54 PRO HD2 . . 2.950 2.100 2.072 2.190 . 0 0 "[ . 1 . 2]" 1
1246 1 53 HIS HA 1 54 PRO HD3 . . 2.830 2.261 2.252 2.267 . 0 0 "[ . 1 . 2]" 1
1247 1 53 HIS HA 1 54 PRO HG2 . . 4.590 4.272 4.250 4.343 . 0 0 "[ . 1 . 2]" 1
1248 1 53 HIS HA 1 54 PRO QG . . 3.990 3.832 3.818 3.879 . 0 0 "[ . 1 . 2]" 1
1249 1 53 HIS HA 1 54 PRO HG3 . . 4.590 4.333 4.324 4.364 . 0 0 "[ . 1 . 2]" 1
1250 1 53 HIS QB 1 54 PRO HD2 . . 4.090 3.498 3.369 3.539 . 0 0 "[ . 1 . 2]" 1
1251 1 53 HIS QB 1 56 ILE H . . 3.920 3.315 3.228 3.852 . 0 0 "[ . 1 . 2]" 1
1252 1 53 HIS HB2 1 54 PRO HD2 . . 4.940 4.011 3.758 4.074 . 0 0 "[ . 1 . 2]" 1
1253 1 53 HIS HB2 1 54 PRO HD3 . . 4.930 4.831 4.652 4.871 . 0 0 "[ . 1 . 2]" 1
1254 1 53 HIS HB2 1 56 ILE HB . . 4.830 3.539 3.396 3.825 . 0 0 "[ . 1 . 2]" 1
1255 1 53 HIS HB3 1 54 PRO HD2 . . 4.940 3.854 3.806 3.887 . 0 0 "[ . 1 . 2]" 1
1256 1 53 HIS HB3 1 54 PRO HD3 . . 4.930 4.803 4.775 4.818 . 0 0 "[ . 1 . 2]" 1
1257 1 53 HIS HB3 1 56 ILE HB . . 4.830 2.650 2.547 2.819 . 0 0 "[ . 1 . 2]" 1
1258 1 53 HIS HD2 1 54 PRO HD2 . . 4.570 4.070 3.616 4.156 . 0 0 "[ . 1 . 2]" 1
1259 1 53 HIS HD2 1 54 PRO HD3 . . 5.400 5.355 5.001 5.418 0.018 7 0 "[ . 1 . 2]" 1
1260 1 53 HIS HD2 1 56 ILE HB . . 5.500 4.106 3.961 4.299 . 0 0 "[ . 1 . 2]" 1
1261 1 53 HIS HD2 1 56 ILE MD . . 4.800 3.477 3.060 3.925 . 0 0 "[ . 1 . 2]" 1
1262 1 53 HIS HE1 1 54 PRO HD2 . . 4.850 3.521 3.385 3.618 . 0 0 "[ . 1 . 2]" 1
1263 1 53 HIS HE1 1 54 PRO QG . . 4.660 3.433 2.899 3.619 . 0 0 "[ . 1 . 2]" 1
1264 1 53 HIS HE1 1 55 ARG H . . 4.270 3.065 2.971 3.213 . 0 0 "[ . 1 . 2]" 1
1265 1 53 HIS HE1 1 55 ARG HB2 . . 3.770 2.006 1.995 2.041 . 0 0 "[ . 1 . 2]" 1
1266 1 53 HIS HE1 1 55 ARG HB3 . . 3.700 3.563 3.382 3.708 0.008 17 0 "[ . 1 . 2]" 1
1267 1 53 HIS HE1 1 55 ARG QD . . 5.040 3.746 2.992 4.538 . 0 0 "[ . 1 . 2]" 1
1268 1 53 HIS HE1 1 55 ARG HG2 . . 4.950 4.723 4.350 4.925 . 0 0 "[ . 1 . 2]" 1
1269 1 53 HIS HE1 1 55 ARG HG3 . . 4.480 3.682 2.879 4.319 . 0 0 "[ . 1 . 2]" 1
1270 1 53 HIS HE1 1 56 ILE H . . 4.300 2.849 2.273 2.938 . 0 0 "[ . 1 . 2]" 1
1271 1 53 HIS HE1 1 56 ILE HB . . 4.910 4.379 3.656 4.609 . 0 0 "[ . 1 . 2]" 1
1272 1 53 HIS HE1 1 56 ILE MD . . 3.870 3.517 3.058 3.868 . 0 0 "[ . 1 . 2]" 1
1273 1 53 HIS HE1 1 56 ILE HG12 . . 5.290 4.901 4.529 5.185 . 0 0 "[ . 1 . 2]" 1
1274 1 53 HIS HE1 1 56 ILE HG13 . . 4.050 3.190 2.793 3.497 . 0 0 "[ . 1 . 2]" 1
1275 1 53 HIS HE1 1 56 ILE MG . . 5.500 5.468 4.962 5.536 0.036 7 0 "[ . 1 . 2]" 1
1276 1 53 HIS HE1 1 70 LEU QD . . 5.440 5.172 4.987 5.441 0.001 17 0 "[ . 1 . 2]" 1
1277 1 54 PRO HA 1 56 ILE H . . 5.500 5.487 5.145 5.535 0.035 7 0 "[ . 1 . 2]" 1
1278 1 54 PRO QB 1 55 ARG HG3 . . 4.600 3.588 2.978 3.866 . 0 0 "[ . 1 . 2]" 1
1279 1 54 PRO HD2 1 55 ARG H . . 4.400 2.860 2.772 3.606 . 0 0 "[ . 1 . 2]" 1
1280 1 54 PRO HD2 1 56 ILE H . . 5.070 4.301 4.161 4.388 . 0 0 "[ . 1 . 2]" 1
1281 1 54 PRO HD3 1 55 ARG H . . 4.910 3.924 3.882 4.293 . 0 0 "[ . 1 . 2]" 1
1282 1 54 PRO QG 1 55 ARG H . . 4.330 1.871 1.811 1.885 . 0 0 "[ . 1 . 2]" 1
1283 1 55 ARG H 1 55 ARG HG2 . . 5.210 3.723 3.063 4.224 . 0 0 "[ . 1 . 2]" 1
1284 1 55 ARG H 1 55 ARG HG3 . . 5.230 2.729 2.053 3.029 . 0 0 "[ . 1 . 2]" 1
1285 1 55 ARG H 1 56 ILE H . . 3.170 2.891 2.802 3.182 0.012 10 0 "[ . 1 . 2]" 1
1286 1 55 ARG H 1 56 ILE HB . . 5.500 5.121 4.950 5.474 . 0 0 "[ . 1 . 2]" 1
1287 1 55 ARG H 1 56 ILE HG13 . . 5.400 4.650 4.415 5.056 . 0 0 "[ . 1 . 2]" 1
1288 1 55 ARG HB2 1 55 ARG HD2 . . 4.200 3.501 3.047 3.835 . 0 0 "[ . 1 . 2]" 1
1289 1 55 ARG HB2 1 55 ARG QD . . 3.680 2.901 2.402 3.283 . 0 0 "[ . 1 . 2]" 1
1290 1 55 ARG HB2 1 55 ARG HD3 . . 4.200 3.262 2.435 3.937 . 0 0 "[ . 1 . 2]" 1
1291 1 55 ARG HB2 1 55 ARG HE . . 5.500 3.201 2.162 4.235 . 0 0 "[ . 1 . 2]" 1
1292 1 55 ARG HB2 1 56 ILE H . . 4.110 2.248 2.047 2.392 . 0 0 "[ . 1 . 2]" 1
1293 1 55 ARG HB2 1 56 ILE MD . . 4.730 4.264 3.844 4.583 . 0 0 "[ . 1 . 2]" 1
1294 1 55 ARG HB2 1 56 ILE HG12 . . 5.170 4.640 4.254 5.022 . 0 0 "[ . 1 . 2]" 1
1295 1 55 ARG HB2 1 56 ILE HG13 . . 4.440 3.091 2.707 3.379 . 0 0 "[ . 1 . 2]" 1
1296 1 55 ARG HB2 1 66 PHE QD . . 5.500 4.816 4.176 5.145 . 0 0 "[ . 1 . 2]" 1
1297 1 55 ARG HB2 1 67 SER H . . 5.500 4.858 4.275 5.390 . 0 0 "[ . 1 . 2]" 1
1298 1 55 ARG HB2 1 68 HIS H . . 5.170 4.883 4.516 5.172 0.002 1 0 "[ . 1 . 2]" 1
1299 1 55 ARG HB3 1 56 ILE H . . 4.620 2.838 2.597 3.139 . 0 0 "[ . 1 . 2]" 1
1300 1 55 ARG HB3 1 56 ILE MD . . 5.170 4.630 4.333 4.844 . 0 0 "[ . 1 . 2]" 1
1301 1 55 ARG HB3 1 56 ILE HG12 . . 5.190 4.284 3.792 4.832 . 0 0 "[ . 1 . 2]" 1
1302 1 55 ARG HB3 1 56 ILE HG13 . . 4.480 3.247 2.930 3.499 . 0 0 "[ . 1 . 2]" 1
1303 1 55 ARG HB3 1 66 PHE QD . . 5.300 3.529 3.054 3.800 . 0 0 "[ . 1 . 2]" 1
1304 1 55 ARG HB3 1 67 SER H . . 4.700 3.621 2.918 4.234 . 0 0 "[ . 1 . 2]" 1
1305 1 55 ARG HB3 1 68 HIS H . . 4.090 3.505 2.866 3.950 . 0 0 "[ . 1 . 2]" 1
1306 1 55 ARG QD 1 55 ARG QH2 . . 3.830 3.649 3.610 3.675 . 0 0 "[ . 1 . 2]" 1
1307 1 55 ARG QD 1 68 HIS H . . 4.200 3.259 2.320 4.186 . 0 0 "[ . 1 . 2]" 1
1308 1 55 ARG QD 1 68 HIS HD2 . . 4.470 3.377 2.968 3.750 . 0 0 "[ . 1 . 2]" 1
1309 1 55 ARG QD 1 68 HIS HE1 . . 4.120 2.744 2.362 3.102 . 0 0 "[ . 1 . 2]" 1
1310 1 55 ARG QD 1 70 LEU H . . 5.340 4.963 4.269 5.276 . 0 0 "[ . 1 . 2]" 1
1311 1 55 ARG QD 1 70 LEU QD . . 3.540 2.655 2.353 3.023 . 0 0 "[ . 1 . 2]" 1
1312 1 55 ARG QD 1 70 LEU HG . . 4.880 3.630 3.174 4.888 0.008 7 0 "[ . 1 . 2]" 1
1313 1 55 ARG HD2 1 68 HIS HE1 . . 4.940 3.462 2.590 4.589 . 0 0 "[ . 1 . 2]" 1
1314 1 55 ARG HD2 1 70 LEU MD1 . . 5.160 3.357 2.510 4.268 . 0 0 "[ . 1 . 2]" 1
1315 1 55 ARG HD2 1 70 LEU MD2 . . 5.160 3.698 2.716 4.634 . 0 0 "[ . 1 . 2]" 1
1316 1 55 ARG HD3 1 68 HIS HE1 . . 4.940 3.052 2.528 3.784 . 0 0 "[ . 1 . 2]" 1
1317 1 55 ARG HD3 1 70 LEU MD1 . . 5.160 3.276 2.631 4.923 . 0 0 "[ . 1 . 2]" 1
1318 1 55 ARG HD3 1 70 LEU MD2 . . 5.160 3.981 2.824 5.096 . 0 0 "[ . 1 . 2]" 1
1319 1 55 ARG HE 1 70 LEU QD . . 4.090 3.105 1.966 3.858 . 0 0 "[ . 1 . 2]" 1
1320 1 55 ARG HG2 1 67 SER H . . 4.490 3.807 3.323 4.261 . 0 0 "[ . 1 . 2]" 1
1321 1 55 ARG HG2 1 68 HIS H . . 3.950 2.602 2.038 3.233 . 0 0 "[ . 1 . 2]" 1
1322 1 55 ARG HG2 1 68 HIS HE1 . . 5.500 2.834 2.319 3.474 . 0 0 "[ . 1 . 2]" 1
1323 1 55 ARG HG3 1 67 SER H . . 5.320 4.986 4.133 5.322 0.002 2 0 "[ . 1 . 2]" 1
1324 1 55 ARG HG3 1 68 HIS H . . 4.660 4.206 3.271 4.664 0.004 11 0 "[ . 1 . 2]" 1
1325 1 55 ARG HG3 1 68 HIS HE1 . . 4.410 2.563 2.008 3.225 . 0 0 "[ . 1 . 2]" 1
1326 1 55 ARG QH1 1 70 LEU QD . . 4.600 3.171 1.904 3.800 . 0 0 "[ . 1 . 2]" 1
1327 1 55 ARG QH2 1 56 ILE MD . . 5.130 3.112 2.163 4.232 . 0 0 "[ . 1 . 2]" 1
1328 1 55 ARG QH2 1 66 PHE QD . . 5.320 3.641 2.002 5.257 . 0 0 "[ . 1 . 2]" 1
1329 1 55 ARG QH2 1 69 VAL HA . . 5.190 4.259 1.888 5.200 0.010 5 0 "[ . 1 . 2]" 1
1330 1 55 ARG QH2 1 70 LEU QD . . 4.600 3.229 2.423 3.928 . 0 0 "[ . 1 . 2]" 1
1331 1 55 ARG QH2 1 70 LEU HG . . 5.320 4.529 3.472 5.325 0.005 7 0 "[ . 1 . 2]" 1
1332 1 56 ILE H 1 56 ILE HB . . 3.540 2.584 2.499 2.689 . 0 0 "[ . 1 . 2]" 1
1333 1 56 ILE H 1 56 ILE MD . . 4.160 3.397 3.082 3.629 . 0 0 "[ . 1 . 2]" 1
1334 1 56 ILE H 1 56 ILE HG12 . . 4.330 3.417 3.079 3.638 . 0 0 "[ . 1 . 2]" 1
1335 1 56 ILE H 1 56 ILE HG13 . . 3.790 2.048 1.898 2.212 . 0 0 "[ . 1 . 2]" 1
1336 1 56 ILE H 1 56 ILE MG . . 4.170 3.770 3.766 3.776 . 0 0 "[ . 1 . 2]" 1
1337 1 56 ILE HA 1 56 ILE MD . . 3.980 3.883 3.824 3.944 . 0 0 "[ . 1 . 2]" 1
1338 1 56 ILE HA 1 56 ILE HG12 . . 3.960 2.678 2.521 2.859 . 0 0 "[ . 1 . 2]" 1
1339 1 56 ILE HA 1 56 ILE HG13 . . 4.150 2.970 2.724 3.212 . 0 0 "[ . 1 . 2]" 1
1340 1 56 ILE HA 1 56 ILE MG . . 3.000 2.283 2.186 2.435 . 0 0 "[ . 1 . 2]" 1
1341 1 56 ILE HA 1 57 SER H . . 2.740 2.195 2.139 2.242 . 0 0 "[ . 1 . 2]" 1
1342 1 56 ILE HA 1 65 ASN H . . 4.880 4.551 4.320 4.764 . 0 0 "[ . 1 . 2]" 1
1343 1 56 ILE HA 1 65 ASN HB3 . . 5.320 5.199 5.007 5.327 0.007 7 0 "[ . 1 . 2]" 1
1344 1 56 ILE HB 1 56 ILE MD . . 3.580 2.382 2.241 2.492 . 0 0 "[ . 1 . 2]" 1
1345 1 56 ILE HB 1 57 SER H . . 4.510 4.386 4.270 4.462 . 0 0 "[ . 1 . 2]" 1
1346 1 56 ILE MD 1 56 ILE MG . . 2.780 2.057 1.903 2.426 . 0 0 "[ . 1 . 2]" 1
1347 1 56 ILE MD 1 57 SER H . . 5.500 5.498 5.301 5.537 0.037 3 0 "[ . 1 . 2]" 1
1348 1 56 ILE MD 1 66 PHE QD . . 4.250 4.176 3.844 4.254 0.004 12 0 "[ . 1 . 2]" 1
1349 1 56 ILE MD 1 66 PHE QE . . 3.420 2.943 2.557 3.309 . 0 0 "[ . 1 . 2]" 1
1350 1 56 ILE MD 1 66 PHE HZ . . 4.840 3.980 3.284 4.405 . 0 0 "[ . 1 . 2]" 1
1351 1 56 ILE HG12 1 56 ILE MG . . 3.050 2.281 2.087 2.351 . 0 0 "[ . 1 . 2]" 1
1352 1 56 ILE HG12 1 57 SER H . . 5.010 4.812 4.554 4.981 . 0 0 "[ . 1 . 2]" 1
1353 1 56 ILE HG12 1 66 PHE QD . . 4.080 3.264 2.999 3.571 . 0 0 "[ . 1 . 2]" 1
1354 1 56 ILE HG12 1 66 PHE QE . . 5.120 2.372 2.044 2.627 . 0 0 "[ . 1 . 2]" 1
1355 1 56 ILE HG13 1 56 ILE MG . . 3.600 3.178 3.129 3.190 . 0 0 "[ . 1 . 2]" 1
1356 1 56 ILE HG13 1 57 SER H . . 5.320 5.038 4.846 5.204 . 0 0 "[ . 1 . 2]" 1
1357 1 56 ILE HG13 1 66 PHE QD . . 4.360 3.755 3.235 4.281 . 0 0 "[ . 1 . 2]" 1
1358 1 56 ILE HG13 1 66 PHE QE . . 5.500 3.625 2.830 4.207 . 0 0 "[ . 1 . 2]" 1
1359 1 56 ILE MG 1 57 SER H . . 3.260 3.127 2.643 3.262 0.002 15 0 "[ . 1 . 2]" 1
1360 1 56 ILE MG 1 57 SER QB . . 5.040 4.744 4.531 4.955 . 0 0 "[ . 1 . 2]" 1
1361 1 56 ILE MG 1 58 VAL MG2 . . 3.880 2.948 2.774 3.164 . 0 0 "[ . 1 . 2]" 1
1362 1 56 ILE MG 1 64 LEU HA . . 4.340 3.920 3.779 4.190 . 0 0 "[ . 1 . 2]" 1
1363 1 56 ILE MG 1 64 LEU HG . . 3.940 2.237 1.990 2.467 . 0 0 "[ . 1 . 2]" 1
1364 1 56 ILE MG 1 65 ASN H . . 4.470 4.341 4.131 4.471 0.001 6 0 "[ . 1 . 2]" 1
1365 1 56 ILE MG 1 66 PHE QD . . 4.430 4.314 4.078 4.433 0.003 4 0 "[ . 1 . 2]" 1
1366 1 56 ILE MG 1 66 PHE QE . . 4.240 3.404 3.079 3.563 . 0 0 "[ . 1 . 2]" 1
1367 1 56 ILE MG 1 66 PHE HZ . . 5.260 3.281 2.744 3.519 . 0 0 "[ . 1 . 2]" 1
1368 1 57 SER H 1 57 SER HB2 . . 3.980 2.661 2.345 3.661 . 0 0 "[ . 1 . 2]" 1
1369 1 57 SER H 1 57 SER QB . . 3.450 2.508 2.316 3.016 . 0 0 "[ . 1 . 2]" 1
1370 1 57 SER H 1 57 SER HB3 . . 3.980 3.416 2.747 3.801 . 0 0 "[ . 1 . 2]" 1
1371 1 57 SER H 1 58 VAL MG2 . . 4.800 4.620 4.325 4.740 . 0 0 "[ . 1 . 2]" 1
1372 1 57 SER H 1 64 LEU HA . . 4.640 4.275 4.003 4.527 . 0 0 "[ . 1 . 2]" 1
1373 1 57 SER H 1 64 LEU QD . . 4.120 3.533 2.835 3.778 . 0 0 "[ . 1 . 2]" 1
1374 1 57 SER H 1 65 ASN H . . 3.530 3.091 2.843 3.277 . 0 0 "[ . 1 . 2]" 1
1375 1 57 SER H 1 65 ASN HB2 . . 5.240 4.864 4.623 5.121 . 0 0 "[ . 1 . 2]" 1
1376 1 57 SER H 1 65 ASN HB3 . . 4.020 3.385 3.132 3.721 . 0 0 "[ . 1 . 2]" 1
1377 1 57 SER HA 1 58 VAL H . . 2.820 2.146 2.138 2.198 . 0 0 "[ . 1 . 2]" 1
1378 1 57 SER QB 1 58 VAL H . . 3.750 3.393 2.954 3.765 0.015 3 0 "[ . 1 . 2]" 1
1379 1 57 SER QB 1 59 LEU QD . . 3.480 2.838 2.586 3.291 . 0 0 "[ . 1 . 2]" 1
1380 1 57 SER QB 1 59 LEU HG . . 4.650 4.321 3.957 4.555 . 0 0 "[ . 1 . 2]" 1
1381 1 57 SER QB 1 65 ASN H . . 4.670 3.400 2.975 4.324 . 0 0 "[ . 1 . 2]" 1
1382 1 57 SER QB 1 65 ASN HB2 . . 5.080 3.934 3.422 5.018 . 0 0 "[ . 1 . 2]" 1
1383 1 57 SER QB 1 65 ASN HB3 . . 3.710 2.426 1.990 3.659 . 0 0 "[ . 1 . 2]" 1
1384 1 57 SER HB2 1 58 VAL H . . 4.500 4.256 3.406 4.466 . 0 0 "[ . 1 . 2]" 1
1385 1 57 SER HB2 1 65 ASN HB3 . . 4.440 2.770 1.999 3.973 . 0 0 "[ . 1 . 2]" 1
1386 1 57 SER HB3 1 58 VAL H . . 4.500 3.633 3.047 4.191 . 0 0 "[ . 1 . 2]" 1
1387 1 57 SER HB3 1 65 ASN HB3 . . 4.440 3.377 2.019 4.286 . 0 0 "[ . 1 . 2]" 1
1388 1 58 VAL H 1 58 VAL HB . . 3.220 2.523 2.471 2.565 . 0 0 "[ . 1 . 2]" 1
1389 1 58 VAL H 1 58 VAL MG1 . . 3.980 3.792 3.769 3.819 . 0 0 "[ . 1 . 2]" 1
1390 1 58 VAL H 1 58 VAL MG2 . . 3.290 2.480 2.321 2.663 . 0 0 "[ . 1 . 2]" 1
1391 1 58 VAL H 1 59 LEU QD . . 4.730 4.408 4.067 4.687 . 0 0 "[ . 1 . 2]" 1
1392 1 58 VAL H 1 64 LEU QD . . 4.710 3.726 3.411 4.035 . 0 0 "[ . 1 . 2]" 1
1393 1 58 VAL HA 1 58 VAL MG1 . . 2.990 2.361 2.262 2.474 . 0 0 "[ . 1 . 2]" 1
1394 1 58 VAL HA 1 58 VAL MG2 . . 3.140 2.354 2.274 2.451 . 0 0 "[ . 1 . 2]" 1
1395 1 58 VAL HA 1 59 LEU H . . 3.130 2.219 2.161 2.289 . 0 0 "[ . 1 . 2]" 1
1396 1 58 VAL HA 1 64 LEU HA . . 3.740 2.734 2.481 2.872 . 0 0 "[ . 1 . 2]" 1
1397 1 58 VAL HA 1 64 LEU QD . . 4.070 2.673 2.281 3.020 . 0 0 "[ . 1 . 2]" 1
1398 1 58 VAL HA 1 65 ASN H . . 5.060 3.719 3.543 3.879 . 0 0 "[ . 1 . 2]" 1
1399 1 58 VAL MG1 1 59 LEU H . . 3.530 3.282 3.019 3.535 0.005 7 0 "[ . 1 . 2]" 1
1400 1 58 VAL MG1 1 62 GLY H . . 4.290 4.030 3.640 4.275 . 0 0 "[ . 1 . 2]" 1
1401 1 58 VAL MG1 1 62 GLY QA . . 3.580 2.861 2.335 3.276 . 0 0 "[ . 1 . 2]" 1
1402 1 58 VAL MG1 1 64 LEU HA . . 4.700 4.167 3.986 4.337 . 0 0 "[ . 1 . 2]" 1
1403 1 58 VAL MG1 1 64 LEU QD . . 3.990 3.216 3.064 3.356 . 0 0 "[ . 1 . 2]" 1
1404 1 58 VAL MG1 1 65 ASN H . . 5.500 5.431 5.326 5.506 0.006 3 0 "[ . 1 . 2]" 1
1405 1 58 VAL MG2 1 59 LEU H . . 4.240 4.234 4.178 4.267 0.027 12 0 "[ . 1 . 2]" 1
1406 1 58 VAL MG2 1 64 LEU HA . . 3.870 3.546 3.252 3.722 . 0 0 "[ . 1 . 2]" 1
1407 1 58 VAL MG2 1 64 LEU HB2 . . 4.560 4.209 3.927 4.455 . 0 0 "[ . 1 . 2]" 1
1408 1 58 VAL MG2 1 64 LEU QD . . 2.840 1.909 1.806 2.058 . 0 0 "[ . 1 . 2]" 1
1409 1 59 LEU H 1 59 LEU HB2 . . 3.990 2.556 2.390 2.766 . 0 0 "[ . 1 . 2]" 1
1410 1 59 LEU H 1 59 LEU QB . . 3.450 2.502 2.356 2.676 . 0 0 "[ . 1 . 2]" 1
1411 1 59 LEU H 1 59 LEU HB3 . . 3.990 3.582 3.560 3.603 . 0 0 "[ . 1 . 2]" 1
1412 1 59 LEU H 1 59 LEU MD1 . . 4.020 3.151 1.754 3.929 . 0 0 "[ . 1 . 2]" 1
1413 1 59 LEU H 1 59 LEU QD . . 3.400 2.413 1.751 2.866 . 0 0 "[ . 1 . 2]" 1
1414 1 59 LEU H 1 59 LEU MD2 . . 4.020 3.080 2.420 3.955 . 0 0 "[ . 1 . 2]" 1
1415 1 59 LEU H 1 59 LEU HG . . 3.490 2.539 1.917 3.494 0.004 7 0 "[ . 1 . 2]" 1
1416 1 59 LEU H 1 62 GLY H . . 4.740 4.304 4.038 4.563 . 0 0 "[ . 1 . 2]" 1
1417 1 59 LEU H 1 63 THR H . . 4.380 3.395 2.933 4.276 . 0 0 "[ . 1 . 2]" 1
1418 1 59 LEU H 1 63 THR HB . . 4.470 3.778 3.499 4.111 . 0 0 "[ . 1 . 2]" 1
1419 1 59 LEU H 1 63 THR MG . . 4.740 4.254 3.933 4.430 . 0 0 "[ . 1 . 2]" 1
1420 1 59 LEU H 1 64 LEU HA . . 4.270 3.533 3.236 3.840 . 0 0 "[ . 1 . 2]" 1
1421 1 59 LEU HA 1 59 LEU MD1 . . 3.920 3.537 2.742 3.920 . 0 0 "[ . 1 . 2]" 1
1422 1 59 LEU HA 1 59 LEU QD . . 2.960 2.274 1.904 2.923 . 0 0 "[ . 1 . 2]" 1
1423 1 59 LEU HA 1 59 LEU MD2 . . 3.920 2.551 1.910 3.791 . 0 0 "[ . 1 . 2]" 1
1424 1 59 LEU HA 1 59 LEU HG . . 4.010 3.103 2.409 3.538 . 0 0 "[ . 1 . 2]" 1
1425 1 59 LEU QB 1 59 LEU QD . . 2.590 1.931 1.831 1.975 . 0 0 "[ . 1 . 2]" 1
1426 1 59 LEU QB 1 62 GLY H . . 4.160 2.792 2.536 3.008 . 0 0 "[ . 1 . 2]" 1
1427 1 59 LEU QB 1 63 THR H . . 3.530 2.230 2.022 2.569 . 0 0 "[ . 1 . 2]" 1
1428 1 59 LEU QB 1 63 THR HB . . 3.410 2.304 1.985 2.627 . 0 0 "[ . 1 . 2]" 1
1429 1 59 LEU HB2 1 59 LEU MD1 . . 3.550 2.354 2.131 2.556 . 0 0 "[ . 1 . 2]" 1
1430 1 59 LEU HB2 1 59 LEU MD2 . . 3.550 2.971 2.426 3.191 . 0 0 "[ . 1 . 2]" 1
1431 1 59 LEU HB2 1 61 ASP H . . 4.460 3.852 3.100 4.142 . 0 0 "[ . 1 . 2]" 1
1432 1 59 LEU HB2 1 62 GLY H . . 4.820 2.899 2.572 3.247 . 0 0 "[ . 1 . 2]" 1
1433 1 59 LEU HB2 1 63 THR H . . 4.250 2.247 2.036 2.607 . 0 0 "[ . 1 . 2]" 1
1434 1 59 LEU HB2 1 63 THR HB . . 4.120 2.328 1.998 2.668 . 0 0 "[ . 1 . 2]" 1
1435 1 59 LEU HB3 1 59 LEU MD1 . . 3.550 2.552 2.169 3.194 . 0 0 "[ . 1 . 2]" 1
1436 1 59 LEU HB3 1 59 LEU MD2 . . 3.550 2.383 2.101 2.575 . 0 0 "[ . 1 . 2]" 1
1437 1 59 LEU HB3 1 61 ASP H . . 4.460 3.298 2.734 3.884 . 0 0 "[ . 1 . 2]" 1
1438 1 59 LEU HB3 1 62 GLY H . . 4.820 3.735 3.384 4.126 . 0 0 "[ . 1 . 2]" 1
1439 1 59 LEU HB3 1 63 THR H . . 4.250 3.778 3.357 4.190 . 0 0 "[ . 1 . 2]" 1
1440 1 59 LEU HB3 1 63 THR HB . . 4.120 3.682 3.159 4.028 . 0 0 "[ . 1 . 2]" 1
1441 1 59 LEU QD 1 62 GLY H . . 5.370 4.272 4.102 4.406 . 0 0 "[ . 1 . 2]" 1
1442 1 59 LEU QD 1 63 THR H . . 4.160 3.553 3.125 3.874 . 0 0 "[ . 1 . 2]" 1
1443 1 59 LEU QD 1 63 THR HA . . 5.440 4.403 3.797 4.856 . 0 0 "[ . 1 . 2]" 1
1444 1 59 LEU QD 1 63 THR HB . . 3.130 2.092 1.879 2.403 . 0 0 "[ . 1 . 2]" 1
1445 1 59 LEU QD 1 65 ASN H . . 4.100 3.303 2.330 3.899 . 0 0 "[ . 1 . 2]" 1
1446 1 59 LEU QD 1 65 ASN HB3 . . 3.360 2.897 2.270 3.333 . 0 0 "[ . 1 . 2]" 1
1447 1 59 LEU QD 1 65 ASN HD21 . . 3.610 3.305 2.753 3.581 . 0 0 "[ . 1 . 2]" 1
1448 1 59 LEU QD 1 65 ASN HD22 . . 5.130 4.439 3.963 4.667 . 0 0 "[ . 1 . 2]" 1
1449 1 59 LEU MD1 1 63 THR HB . . 4.410 2.183 1.979 2.686 . 0 0 "[ . 1 . 2]" 1
1450 1 59 LEU MD1 1 64 LEU HA . . 5.500 4.655 3.099 5.498 . 0 0 "[ . 1 . 2]" 1
1451 1 59 LEU MD1 1 65 ASN H . . 4.710 3.874 2.336 4.664 . 0 0 "[ . 1 . 2]" 1
1452 1 59 LEU MD1 1 65 ASN HB2 . . 3.770 2.724 1.950 3.247 . 0 0 "[ . 1 . 2]" 1
1453 1 59 LEU MD1 1 65 ASN HB3 . . 4.430 3.623 2.280 4.335 . 0 0 "[ . 1 . 2]" 1
1454 1 59 LEU MD1 1 65 ASN HD21 . . 4.560 3.518 3.084 3.797 . 0 0 "[ . 1 . 2]" 1
1455 1 59 LEU MD2 1 63 THR HB . . 4.410 3.664 2.041 4.411 0.001 10 0 "[ . 1 . 2]" 1
1456 1 59 LEU MD2 1 64 LEU HA . . 5.500 5.112 4.337 5.496 . 0 0 "[ . 1 . 2]" 1
1457 1 59 LEU MD2 1 65 ASN H . . 4.710 4.133 3.439 4.711 0.001 4 0 "[ . 1 . 2]" 1
1458 1 59 LEU MD2 1 65 ASN HB2 . . 3.770 3.249 2.661 3.606 . 0 0 "[ . 1 . 2]" 1
1459 1 59 LEU MD2 1 65 ASN HB3 . . 4.430 3.530 2.721 4.413 . 0 0 "[ . 1 . 2]" 1
1460 1 59 LEU MD2 1 65 ASN HD21 . . 4.560 4.038 3.097 4.391 . 0 0 "[ . 1 . 2]" 1
1461 1 59 LEU HG 1 63 THR H . . 5.150 4.261 3.639 5.124 . 0 0 "[ . 1 . 2]" 1
1462 1 59 LEU HG 1 63 THR HB . . 4.520 3.269 2.668 4.312 . 0 0 "[ . 1 . 2]" 1
1463 1 59 LEU HG 1 65 ASN H . . 5.260 3.995 3.165 5.205 . 0 0 "[ . 1 . 2]" 1
1464 1 59 LEU HG 1 65 ASN HB2 . . 4.420 3.625 2.755 4.425 0.005 7 0 "[ . 1 . 2]" 1
1465 1 59 LEU HG 1 65 ASN HB3 . . 4.930 4.094 3.591 4.714 . 0 0 "[ . 1 . 2]" 1
1466 1 60 ASN HA 1 62 GLY H . . 4.510 4.142 3.673 4.352 . 0 0 "[ . 1 . 2]" 1
1467 1 60 ASN HB2 1 61 ASP H . . 4.760 2.982 2.161 3.873 . 0 0 "[ . 1 . 2]" 1
1468 1 60 ASN HB3 1 61 ASP H . . 4.760 3.245 2.052 4.110 . 0 0 "[ . 1 . 2]" 1
1469 1 61 ASP H 1 62 GLY H . . 3.520 2.857 2.643 3.035 . 0 0 "[ . 1 . 2]" 1
1470 1 62 GLY H 1 63 THR H . . 3.260 1.987 1.820 2.169 . 0 0 "[ . 1 . 2]" 1
1471 1 62 GLY H 1 63 THR HB . . 5.170 4.093 3.931 4.434 . 0 0 "[ . 1 . 2]" 1
1472 1 63 THR H 1 63 THR HB . . 3.160 2.527 2.351 2.632 . 0 0 "[ . 1 . 2]" 1
1473 1 63 THR H 1 63 THR MG . . 3.970 3.796 3.712 3.846 . 0 0 "[ . 1 . 2]" 1
1474 1 63 THR H 1 64 LEU H . . 4.960 4.525 4.415 4.621 . 0 0 "[ . 1 . 2]" 1
1475 1 63 THR HA 1 63 THR MG . . 3.000 2.381 2.274 2.476 . 0 0 "[ . 1 . 2]" 1
1476 1 63 THR HA 1 64 LEU H . . 2.800 2.231 2.174 2.334 . 0 0 "[ . 1 . 2]" 1
1477 1 63 THR HA 1 64 LEU HB2 . . 4.870 4.177 4.100 4.246 . 0 0 "[ . 1 . 2]" 1
1478 1 63 THR HA 1 64 LEU HB3 . . 5.060 4.921 4.846 4.989 . 0 0 "[ . 1 . 2]" 1
1479 1 63 THR HB 1 64 LEU H . . 4.530 3.992 3.704 4.128 . 0 0 "[ . 1 . 2]" 1
1480 1 63 THR MG 1 64 LEU H . . 3.290 2.088 1.867 2.416 . 0 0 "[ . 1 . 2]" 1
1481 1 63 THR MG 1 64 LEU HA . . 4.810 3.744 3.485 3.937 . 0 0 "[ . 1 . 2]" 1
1482 1 63 THR MG 1 65 ASN H . . 4.420 3.716 3.370 3.971 . 0 0 "[ . 1 . 2]" 1
1483 1 63 THR MG 1 65 ASN HA . . 4.030 3.709 3.578 3.840 . 0 0 "[ . 1 . 2]" 1
1484 1 63 THR MG 1 65 ASN HB2 . . 3.890 3.428 3.123 3.616 . 0 0 "[ . 1 . 2]" 1
1485 1 63 THR MG 1 65 ASN HB3 . . 4.980 4.661 4.378 4.864 . 0 0 "[ . 1 . 2]" 1
1486 1 63 THR MG 1 65 ASN HD21 . . 4.670 4.354 4.116 4.610 . 0 0 "[ . 1 . 2]" 1
1487 1 64 LEU H 1 64 LEU HB2 . . 3.620 2.554 2.433 2.697 . 0 0 "[ . 1 . 2]" 1
1488 1 64 LEU H 1 64 LEU HB3 . . 3.480 2.783 2.720 2.865 . 0 0 "[ . 1 . 2]" 1
1489 1 64 LEU H 1 64 LEU MD1 . . 4.500 3.990 3.859 4.096 . 0 0 "[ . 1 . 2]" 1
1490 1 64 LEU H 1 64 LEU MD2 . . 4.500 4.374 4.293 4.471 . 0 0 "[ . 1 . 2]" 1
1491 1 64 LEU H 1 64 LEU HG . . 5.500 4.625 4.579 4.672 . 0 0 "[ . 1 . 2]" 1
1492 1 64 LEU H 1 65 ASN H . . 4.790 4.203 4.079 4.309 . 0 0 "[ . 1 . 2]" 1
1493 1 64 LEU HA 1 64 LEU MD1 . . 4.050 2.106 1.996 2.234 . 0 0 "[ . 1 . 2]" 1
1494 1 64 LEU HA 1 64 LEU QD . . 3.070 2.096 1.989 2.220 . 0 0 "[ . 1 . 2]" 1
1495 1 64 LEU HA 1 64 LEU MD2 . . 4.050 3.827 3.796 3.855 . 0 0 "[ . 1 . 2]" 1
1496 1 64 LEU HA 1 64 LEU HG . . 4.020 2.859 2.747 2.948 . 0 0 "[ . 1 . 2]" 1
1497 1 64 LEU HA 1 65 ASN H . . 2.820 2.168 2.143 2.194 . 0 0 "[ . 1 . 2]" 1
1498 1 64 LEU HA 1 65 ASN HA . . 4.700 4.418 4.399 4.432 . 0 0 "[ . 1 . 2]" 1
1499 1 64 LEU HA 1 65 ASN HB2 . . 4.940 4.725 4.540 4.855 . 0 0 "[ . 1 . 2]" 1
1500 1 64 LEU HA 1 65 ASN HB3 . . 4.750 4.628 4.522 4.739 . 0 0 "[ . 1 . 2]" 1
1501 1 64 LEU HB2 1 64 LEU MD1 . . 3.650 2.278 2.207 2.351 . 0 0 "[ . 1 . 2]" 1
1502 1 64 LEU HB2 1 64 LEU QD . . 3.060 2.086 2.033 2.160 . 0 0 "[ . 1 . 2]" 1
1503 1 64 LEU HB2 1 64 LEU MD2 . . 3.650 2.426 2.241 2.533 . 0 0 "[ . 1 . 2]" 1
1504 1 64 LEU HB2 1 65 ASN H . . 4.570 4.556 4.494 4.586 0.016 5 0 "[ . 1 . 2]" 1
1505 1 64 LEU HB2 1 66 PHE QE . . 5.500 3.811 3.612 4.028 . 0 0 "[ . 1 . 2]" 1
1506 1 64 LEU HB3 1 64 LEU QD . . 3.110 2.203 2.095 2.347 . 0 0 "[ . 1 . 2]" 1
1507 1 64 LEU HB3 1 65 ASN H . . 4.310 4.229 4.128 4.280 . 0 0 "[ . 1 . 2]" 1
1508 1 64 LEU HB3 1 66 PHE QE . . 5.300 2.216 2.028 2.516 . 0 0 "[ . 1 . 2]" 1
1509 1 64 LEU QD 1 65 ASN H . . 3.480 3.319 3.043 3.474 . 0 0 "[ . 1 . 2]" 1
1510 1 64 LEU QD 1 66 PHE QE . . 3.200 2.380 2.005 2.593 . 0 0 "[ . 1 . 2]" 1
1511 1 64 LEU QD 1 66 PHE HZ . . 3.420 1.899 1.797 2.029 . 0 0 "[ . 1 . 2]" 1
1512 1 64 LEU QD 1 77 TYR QB . . 3.800 3.169 2.952 3.590 . 0 0 "[ . 1 . 2]" 1
1513 1 64 LEU QD 1 77 TYR QD . . 3.510 2.638 2.418 3.046 . 0 0 "[ . 1 . 2]" 1
1514 1 64 LEU QD 1 77 TYR QE . . 3.520 3.321 3.057 3.489 . 0 0 "[ . 1 . 2]" 1
1515 1 64 LEU MD1 1 66 PHE QE . . 4.090 3.899 3.656 4.086 . 0 0 "[ . 1 . 2]" 1
1516 1 64 LEU MD1 1 66 PHE HZ . . 4.670 4.091 3.827 4.374 . 0 0 "[ . 1 . 2]" 1
1517 1 64 LEU MD2 1 66 PHE QE . . 4.090 2.403 2.013 2.630 . 0 0 "[ . 1 . 2]" 1
1518 1 64 LEU MD2 1 66 PHE HZ . . 4.670 1.902 1.799 2.034 . 0 0 "[ . 1 . 2]" 1
1519 1 64 LEU HG 1 65 ASN H . . 4.120 3.674 3.357 3.846 . 0 0 "[ . 1 . 2]" 1
1520 1 64 LEU HG 1 66 PHE QD . . 5.170 3.843 3.597 4.028 . 0 0 "[ . 1 . 2]" 1
1521 1 64 LEU HG 1 66 PHE QE . . 4.420 2.429 2.088 2.825 . 0 0 "[ . 1 . 2]" 1
1522 1 64 LEU HG 1 66 PHE HZ . . 5.370 3.056 2.756 3.316 . 0 0 "[ . 1 . 2]" 1
1523 1 65 ASN H 1 65 ASN HB2 . . 3.520 2.829 2.714 2.910 . 0 0 "[ . 1 . 2]" 1
1524 1 65 ASN H 1 65 ASN HB3 . . 3.240 2.476 2.365 2.606 . 0 0 "[ . 1 . 2]" 1
1525 1 65 ASN HA 1 65 ASN HD21 . . 4.490 3.388 3.064 3.728 . 0 0 "[ . 1 . 2]" 1
1526 1 65 ASN HA 1 66 PHE H . . 2.880 2.274 2.185 2.348 . 0 0 "[ . 1 . 2]" 1
1527 1 65 ASN HA 1 66 PHE HB2 . . 4.740 4.442 4.402 4.501 . 0 0 "[ . 1 . 2]" 1
1528 1 65 ASN HA 1 66 PHE QD . . 4.010 2.775 2.563 3.070 . 0 0 "[ . 1 . 2]" 1
1529 1 65 ASN HB3 1 66 PHE H . . 4.550 3.884 3.738 4.068 . 0 0 "[ . 1 . 2]" 1
1530 1 65 ASN HB3 1 66 PHE HA . . 5.500 4.718 4.559 4.821 . 0 0 "[ . 1 . 2]" 1
1531 1 65 ASN HD22 1 67 SER HA . . 5.300 4.739 4.232 5.157 . 0 0 "[ . 1 . 2]" 1
1532 1 66 PHE H 1 66 PHE HB2 . . 3.510 2.660 2.492 2.769 . 0 0 "[ . 1 . 2]" 1
1533 1 66 PHE H 1 66 PHE HB3 . . 4.160 3.790 3.692 3.853 . 0 0 "[ . 1 . 2]" 1
1534 1 66 PHE H 1 66 PHE QD . . 3.160 2.591 2.449 2.743 . 0 0 "[ . 1 . 2]" 1
1535 1 66 PHE H 1 66 PHE QE . . 4.990 4.846 4.730 4.939 . 0 0 "[ . 1 . 2]" 1
1536 1 66 PHE H 1 69 VAL MG1 . . 4.800 4.601 4.272 4.750 . 0 0 "[ . 1 . 2]" 1
1537 1 66 PHE HA 1 67 SER H . . 2.920 2.186 2.138 2.255 . 0 0 "[ . 1 . 2]" 1
1538 1 66 PHE HA 1 68 HIS H . . 4.120 3.883 3.574 4.105 . 0 0 "[ . 1 . 2]" 1
1539 1 66 PHE HA 1 69 VAL MG1 . . 5.110 4.316 4.099 4.568 . 0 0 "[ . 1 . 2]" 1
1540 1 66 PHE HB2 1 67 SER H . . 4.560 4.458 4.362 4.514 . 0 0 "[ . 1 . 2]" 1
1541 1 66 PHE HB2 1 68 HIS H . . 5.060 4.649 4.294 4.944 . 0 0 "[ . 1 . 2]" 1
1542 1 66 PHE HB2 1 69 VAL HA . . 5.310 4.754 4.559 5.069 . 0 0 "[ . 1 . 2]" 1
1543 1 66 PHE HB2 1 69 VAL MG1 . . 3.380 2.429 2.207 2.591 . 0 0 "[ . 1 . 2]" 1
1544 1 66 PHE HB2 1 69 VAL MG2 . . 4.760 4.521 4.240 4.703 . 0 0 "[ . 1 . 2]" 1
1545 1 66 PHE HB3 1 67 SER H . . 4.160 3.819 3.504 4.027 . 0 0 "[ . 1 . 2]" 1
1546 1 66 PHE HB3 1 68 HIS H . . 3.960 3.466 3.069 3.715 . 0 0 "[ . 1 . 2]" 1
1547 1 66 PHE HB3 1 69 VAL H . . 4.600 3.835 3.643 3.959 . 0 0 "[ . 1 . 2]" 1
1548 1 66 PHE HB3 1 69 VAL HA . . 4.480 3.521 3.326 3.775 . 0 0 "[ . 1 . 2]" 1
1549 1 66 PHE HB3 1 69 VAL MG1 . . 3.510 2.182 1.941 2.551 . 0 0 "[ . 1 . 2]" 1
1550 1 66 PHE HB3 1 69 VAL MG2 . . 4.810 4.533 4.338 4.707 . 0 0 "[ . 1 . 2]" 1
1551 1 66 PHE QD 1 69 VAL HA . . 3.800 3.650 3.382 3.800 0.000 16 0 "[ . 1 . 2]" 1
1552 1 66 PHE QD 1 69 VAL MG1 . . 3.440 2.721 2.267 2.930 . 0 0 "[ . 1 . 2]" 1
1553 1 66 PHE QD 1 69 VAL MG2 . . 5.260 5.136 4.863 5.261 0.001 17 0 "[ . 1 . 2]" 1
1554 1 66 PHE QD 1 70 LEU H . . 5.270 5.178 5.055 5.270 0.000 2 0 "[ . 1 . 2]" 1
1555 1 66 PHE QD 1 94 LEU MD1 . . 4.910 4.622 4.402 4.805 . 0 0 "[ . 1 . 2]" 1
1556 1 66 PHE QD 1 94 LEU MD2 . . 4.730 3.871 3.686 4.004 . 0 0 "[ . 1 . 2]" 1
1557 1 66 PHE QE 1 69 VAL MG1 . . 4.470 4.128 3.878 4.268 . 0 0 "[ . 1 . 2]" 1
1558 1 66 PHE QE 1 73 ASP QB . . 4.470 4.048 3.792 4.470 0.000 7 0 "[ . 1 . 2]" 1
1559 1 66 PHE QE 1 77 TYR HH . . 4.950 3.891 3.564 4.192 . 0 0 "[ . 1 . 2]" 1
1560 1 66 PHE QE 1 94 LEU MD1 . . 4.980 4.786 4.418 4.968 . 0 0 "[ . 1 . 2]" 1
1561 1 66 PHE QE 1 94 LEU MD2 . . 3.850 3.733 3.573 3.852 0.002 15 0 "[ . 1 . 2]" 1
1562 1 66 PHE HZ 1 77 TYR QE . . 4.870 2.726 2.365 3.115 . 0 0 "[ . 1 . 2]" 1
1563 1 66 PHE HZ 1 77 TYR HH . . 5.500 5.139 4.793 5.429 . 0 0 "[ . 1 . 2]" 1
1564 1 66 PHE HZ 1 94 LEU MD2 . . 4.480 4.313 4.142 4.460 . 0 0 "[ . 1 . 2]" 1
1565 1 67 SER H 1 67 SER HB2 . . 3.950 2.443 2.196 3.572 . 0 0 "[ . 1 . 2]" 1
1566 1 67 SER H 1 67 SER QB . . 3.330 2.298 2.151 2.670 . 0 0 "[ . 1 . 2]" 1
1567 1 67 SER H 1 67 SER HB3 . . 3.950 2.996 2.541 3.616 . 0 0 "[ . 1 . 2]" 1
1568 1 67 SER H 1 68 HIS H . . 3.070 2.973 2.799 3.072 0.002 8 0 "[ . 1 . 2]" 1
1569 1 67 SER QB 1 68 HIS H . . 3.630 2.474 2.249 3.244 . 0 0 "[ . 1 . 2]" 1
1570 1 67 SER HB2 1 68 HIS H . . 4.140 3.397 2.324 3.862 . 0 0 "[ . 1 . 2]" 1
1571 1 67 SER HB3 1 68 HIS H . . 4.140 2.769 2.272 4.034 . 0 0 "[ . 1 . 2]" 1
1572 1 68 HIS H 1 68 HIS HB3 . . 3.720 3.385 3.250 3.540 . 0 0 "[ . 1 . 2]" 1
1573 1 68 HIS H 1 69 VAL H . . 3.980 3.797 3.653 3.887 . 0 0 "[ . 1 . 2]" 1
1574 1 68 HIS H 1 69 VAL MG1 . . 4.780 4.247 3.995 4.484 . 0 0 "[ . 1 . 2]" 1
1575 1 68 HIS H 1 69 VAL MG2 . . 5.500 5.333 5.236 5.441 . 0 0 "[ . 1 . 2]" 1
1576 1 68 HIS H 1 70 LEU QD . . 5.440 4.883 4.261 5.202 . 0 0 "[ . 1 . 2]" 1
1577 1 68 HIS HA 1 69 VAL H . . 2.760 2.160 2.151 2.167 . 0 0 "[ . 1 . 2]" 1
1578 1 68 HIS HA 1 69 VAL MG1 . . 4.260 3.924 3.668 4.027 . 0 0 "[ . 1 . 2]" 1
1579 1 68 HIS HA 1 69 VAL MG2 . . 4.070 3.781 3.621 3.935 . 0 0 "[ . 1 . 2]" 1
1580 1 68 HIS HA 1 70 LEU QD . . 5.020 4.765 4.094 5.021 0.001 6 0 "[ . 1 . 2]" 1
1581 1 68 HIS HB2 1 69 VAL H . . 3.980 3.739 3.681 3.768 . 0 0 "[ . 1 . 2]" 1
1582 1 68 HIS HB2 1 70 LEU QD . . 5.340 3.574 3.052 3.895 . 0 0 "[ . 1 . 2]" 1
1583 1 68 HIS HB3 1 69 VAL H . . 4.670 4.451 4.401 4.507 . 0 0 "[ . 1 . 2]" 1
1584 1 68 HIS HD2 1 70 LEU QD . . 3.210 2.005 1.793 2.212 . 0 0 "[ . 1 . 2]" 1
1585 1 68 HIS HD2 1 70 LEU HG . . 4.270 3.602 3.058 4.250 . 0 0 "[ . 1 . 2]" 1
1586 1 68 HIS HE1 1 70 LEU MD1 . . 5.430 5.080 4.213 5.395 . 0 0 "[ . 1 . 2]" 1
1587 1 68 HIS HE1 1 70 LEU QD . . 4.670 4.482 4.052 4.672 0.002 3 0 "[ . 1 . 2]" 1
1588 1 68 HIS HE1 1 70 LEU MD2 . . 5.430 5.026 4.333 5.396 . 0 0 "[ . 1 . 2]" 1
1589 1 69 VAL H 1 69 VAL HB . . 3.850 3.623 3.605 3.653 . 0 0 "[ . 1 . 2]" 1
1590 1 69 VAL H 1 69 VAL MG1 . . 3.240 2.357 2.129 2.464 . 0 0 "[ . 1 . 2]" 1
1591 1 69 VAL H 1 69 VAL MG2 . . 2.980 2.144 1.900 2.246 . 0 0 "[ . 1 . 2]" 1
1592 1 69 VAL H 1 70 LEU H . . 4.890 4.609 4.564 4.633 . 0 0 "[ . 1 . 2]" 1
1593 1 69 VAL H 1 96 VAL MG1 . . 5.010 4.739 4.423 4.945 . 0 0 "[ . 1 . 2]" 1
1594 1 69 VAL HA 1 69 VAL MG1 . . 3.240 2.294 2.210 2.467 . 0 0 "[ . 1 . 2]" 1
1595 1 69 VAL HA 1 69 VAL MG2 . . 3.630 3.191 3.181 3.202 . 0 0 "[ . 1 . 2]" 1
1596 1 69 VAL HA 1 70 LEU H . . 2.960 2.314 2.189 2.532 . 0 0 "[ . 1 . 2]" 1
1597 1 69 VAL HA 1 70 LEU HA . . 4.790 4.435 4.385 4.539 . 0 0 "[ . 1 . 2]" 1
1598 1 69 VAL HA 1 70 LEU HB2 . . 5.330 4.789 4.544 4.904 . 0 0 "[ . 1 . 2]" 1
1599 1 69 VAL HA 1 70 LEU MD1 . . 5.060 4.135 2.592 4.661 . 0 0 "[ . 1 . 2]" 1
1600 1 69 VAL HA 1 70 LEU QD . . 4.140 3.544 2.311 4.062 . 0 0 "[ . 1 . 2]" 1
1601 1 69 VAL HA 1 70 LEU MD2 . . 5.060 4.007 2.351 5.070 0.010 7 0 "[ . 1 . 2]" 1
1602 1 69 VAL HA 1 70 LEU HG . . 5.500 3.606 2.949 5.316 . 0 0 "[ . 1 . 2]" 1
1603 1 69 VAL HA 1 73 ASP QB . . 4.340 3.439 3.198 3.901 . 0 0 "[ . 1 . 2]" 1
1604 1 69 VAL HA 1 96 VAL MG1 . . 4.900 4.385 3.966 4.612 . 0 0 "[ . 1 . 2]" 1
1605 1 69 VAL HB 1 70 LEU H . . 3.540 2.636 2.107 3.032 . 0 0 "[ . 1 . 2]" 1
1606 1 69 VAL HB 1 70 LEU HA . . 5.500 4.468 4.253 4.708 . 0 0 "[ . 1 . 2]" 1
1607 1 69 VAL HB 1 73 ASP HB2 . . 4.910 3.095 2.856 3.388 . 0 0 "[ . 1 . 2]" 1
1608 1 69 VAL HB 1 73 ASP QB . . 4.140 2.964 2.703 3.204 . 0 0 "[ . 1 . 2]" 1
1609 1 69 VAL HB 1 73 ASP HB3 . . 4.910 3.806 3.338 3.953 . 0 0 "[ . 1 . 2]" 1
1610 1 69 VAL HB 1 94 LEU MD2 . . 4.300 2.748 2.510 3.057 . 0 0 "[ . 1 . 2]" 1
1611 1 69 VAL HB 1 96 VAL MG2 . . 3.380 2.219 1.934 2.443 . 0 0 "[ . 1 . 2]" 1
1612 1 69 VAL MG1 1 70 LEU H . . 3.950 3.730 3.514 3.948 . 0 0 "[ . 1 . 2]" 1
1613 1 69 VAL MG1 1 73 ASP HB2 . . 4.880 4.020 3.742 4.576 . 0 0 "[ . 1 . 2]" 1
1614 1 69 VAL MG1 1 73 ASP QB . . 4.060 3.517 3.249 4.033 . 0 0 "[ . 1 . 2]" 1
1615 1 69 VAL MG1 1 73 ASP HB3 . . 4.880 3.888 3.566 4.480 . 0 0 "[ . 1 . 2]" 1
1616 1 69 VAL MG1 1 94 LEU MD2 . . 3.330 2.185 1.937 2.725 . 0 0 "[ . 1 . 2]" 1
1617 1 69 VAL MG2 1 70 LEU H . . 3.970 3.625 3.125 3.864 . 0 0 "[ . 1 . 2]" 1
1618 1 69 VAL MG2 1 70 LEU HA . . 4.840 3.856 3.431 4.049 . 0 0 "[ . 1 . 2]" 1
1619 1 69 VAL MG2 1 73 ASP HB2 . . 5.320 4.470 4.196 4.670 . 0 0 "[ . 1 . 2]" 1
1620 1 69 VAL MG2 1 73 ASP HB3 . . 5.320 5.216 4.826 5.322 0.002 12 0 "[ . 1 . 2]" 1
1621 1 69 VAL MG2 1 94 LEU MD2 . . 3.740 3.534 3.269 3.743 0.003 9 0 "[ . 1 . 2]" 1
1622 1 69 VAL MG2 1 96 VAL HA . . 4.800 3.460 3.161 3.678 . 0 0 "[ . 1 . 2]" 1
1623 1 69 VAL MG2 1 96 VAL MG2 . . 3.100 2.159 1.844 2.518 . 0 0 "[ . 1 . 2]" 1
1624 1 69 VAL MG2 1 97 SER H . . 5.050 4.584 4.420 4.699 . 0 0 "[ . 1 . 2]" 1
1625 1 70 LEU H 1 70 LEU HB2 . . 3.470 2.851 2.529 3.091 . 0 0 "[ . 1 . 2]" 1
1626 1 70 LEU H 1 70 LEU HB3 . . 3.950 3.829 3.706 3.949 . 0 0 "[ . 1 . 2]" 1
1627 1 70 LEU H 1 70 LEU MD1 . . 4.220 3.542 2.144 3.955 . 0 0 "[ . 1 . 2]" 1
1628 1 70 LEU H 1 70 LEU QD . . 3.700 3.075 1.791 3.559 . 0 0 "[ . 1 . 2]" 1
1629 1 70 LEU H 1 70 LEU MD2 . . 4.220 3.564 1.803 4.048 . 0 0 "[ . 1 . 2]" 1
1630 1 70 LEU H 1 70 LEU HG . . 3.940 2.924 2.465 3.970 0.030 3 0 "[ . 1 . 2]" 1
1631 1 70 LEU H 1 73 ASP H . . 4.550 3.322 3.157 3.823 . 0 0 "[ . 1 . 2]" 1
1632 1 70 LEU H 1 73 ASP HB2 . . 4.440 2.117 1.898 2.582 . 0 0 "[ . 1 . 2]" 1
1633 1 70 LEU H 1 73 ASP QB . . 3.770 2.097 1.887 2.532 . 0 0 "[ . 1 . 2]" 1
1634 1 70 LEU H 1 73 ASP HB3 . . 4.440 3.452 3.277 3.691 . 0 0 "[ . 1 . 2]" 1
1635 1 70 LEU H 1 96 VAL MG1 . . 4.590 3.365 3.095 3.780 . 0 0 "[ . 1 . 2]" 1
1636 1 70 LEU H 1 96 VAL MG2 . . 4.450 3.260 2.796 3.685 . 0 0 "[ . 1 . 2]" 1
1637 1 70 LEU HA 1 70 LEU MD1 . . 4.110 3.664 2.114 4.039 . 0 0 "[ . 1 . 2]" 1
1638 1 70 LEU HA 1 70 LEU QD . . 2.760 2.524 2.093 2.756 . 0 0 "[ . 1 . 2]" 1
1639 1 70 LEU HA 1 70 LEU MD2 . . 4.110 2.795 2.443 3.846 . 0 0 "[ . 1 . 2]" 1
1640 1 70 LEU HA 1 70 LEU HG . . 4.040 3.210 2.631 3.866 . 0 0 "[ . 1 . 2]" 1
1641 1 70 LEU HA 1 71 LEU H . . 2.990 2.391 2.315 2.495 . 0 0 "[ . 1 . 2]" 1
1642 1 70 LEU HA 1 71 LEU HA . . 4.680 4.298 4.294 4.303 . 0 0 "[ . 1 . 2]" 1
1643 1 70 LEU HA 1 71 LEU HB2 . . 5.230 4.866 4.695 5.123 . 0 0 "[ . 1 . 2]" 1
1644 1 70 LEU HA 1 71 LEU MD1 . . 5.500 5.303 5.113 5.489 . 0 0 "[ . 1 . 2]" 1
1645 1 70 LEU HA 1 71 LEU QD . . 4.570 4.290 3.942 4.469 . 0 0 "[ . 1 . 2]" 1
1646 1 70 LEU HA 1 71 LEU MD2 . . 5.500 4.546 4.041 4.835 . 0 0 "[ . 1 . 2]" 1
1647 1 70 LEU HA 1 71 LEU HG . . 5.500 4.041 3.800 4.264 . 0 0 "[ . 1 . 2]" 1
1648 1 70 LEU HA 1 96 VAL HB . . 5.140 4.920 4.556 5.083 . 0 0 "[ . 1 . 2]" 1
1649 1 70 LEU HA 1 96 VAL MG1 . . 4.160 2.772 2.392 3.001 . 0 0 "[ . 1 . 2]" 1
1650 1 70 LEU HB2 1 70 LEU QD . . 2.850 2.050 1.969 2.140 . 0 0 "[ . 1 . 2]" 1
1651 1 70 LEU HB2 1 71 LEU H . . 3.770 3.379 3.117 3.600 . 0 0 "[ . 1 . 2]" 1
1652 1 70 LEU HB2 1 72 SER H . . 4.090 2.641 2.321 3.717 . 0 0 "[ . 1 . 2]" 1
1653 1 70 LEU HB2 1 73 ASP H . . 4.200 2.772 2.475 3.083 . 0 0 "[ . 1 . 2]" 1
1654 1 70 LEU HB2 1 96 VAL MG1 . . 4.930 4.521 4.145 4.740 . 0 0 "[ . 1 . 2]" 1
1655 1 70 LEU HB2 1 96 VAL MG2 . . 5.500 4.970 4.752 5.163 . 0 0 "[ . 1 . 2]" 1
1656 1 70 LEU HB3 1 70 LEU MD1 . . 3.240 2.594 2.365 3.193 . 0 0 "[ . 1 . 2]" 1
1657 1 70 LEU HB3 1 70 LEU MD2 . . 3.240 2.251 2.024 3.174 . 0 0 "[ . 1 . 2]" 1
1658 1 70 LEU HB3 1 71 LEU H . . 3.170 2.547 2.232 2.762 . 0 0 "[ . 1 . 2]" 1
1659 1 70 LEU HB3 1 72 SER H . . 4.340 3.033 2.844 3.195 . 0 0 "[ . 1 . 2]" 1
1660 1 70 LEU HB3 1 73 ASP H . . 4.580 4.119 3.691 4.507 . 0 0 "[ . 1 . 2]" 1
1661 1 70 LEU HB3 1 96 VAL MG1 . . 5.030 4.417 4.059 4.662 . 0 0 "[ . 1 . 2]" 1
1662 1 70 LEU QD 1 71 LEU H . . 3.870 3.672 3.454 3.856 . 0 0 "[ . 1 . 2]" 1
1663 1 70 LEU QD 1 72 SER H . . 5.320 3.823 3.613 4.165 . 0 0 "[ . 1 . 2]" 1
1664 1 70 LEU HG 1 71 LEU H . . 5.050 4.858 4.031 5.017 . 0 0 "[ . 1 . 2]" 1
1665 1 70 LEU HG 1 96 VAL MG1 . . 5.500 5.056 4.778 5.509 0.009 3 0 "[ . 1 . 2]" 1
1666 1 71 LEU H 1 71 LEU HB2 . . 3.050 2.482 2.349 2.633 . 0 0 "[ . 1 . 2]" 1
1667 1 71 LEU H 1 71 LEU HB3 . . 3.620 3.581 3.563 3.593 . 0 0 "[ . 1 . 2]" 1
1668 1 71 LEU H 1 71 LEU MD1 . . 3.860 3.580 3.401 3.780 . 0 0 "[ . 1 . 2]" 1
1669 1 71 LEU H 1 71 LEU MD2 . . 3.860 3.347 2.865 3.663 . 0 0 "[ . 1 . 2]" 1
1670 1 71 LEU H 1 71 LEU HG . . 3.430 2.260 1.985 2.513 . 0 0 "[ . 1 . 2]" 1
1671 1 71 LEU H 1 72 SER H . . 4.020 2.699 2.612 2.871 . 0 0 "[ . 1 . 2]" 1
1672 1 71 LEU H 1 96 VAL HB . . 4.920 4.413 4.164 4.561 . 0 0 "[ . 1 . 2]" 1
1673 1 71 LEU H 1 96 VAL MG1 . . 3.970 2.914 2.613 3.099 . 0 0 "[ . 1 . 2]" 1
1674 1 71 LEU HA 1 71 LEU MD1 . . 3.910 3.870 3.767 3.933 0.023 12 0 "[ . 1 . 2]" 1
1675 1 71 LEU HA 1 71 LEU QD . . 2.740 2.111 1.962 2.377 . 0 0 "[ . 1 . 2]" 1
1676 1 71 LEU HA 1 71 LEU MD2 . . 3.910 2.121 1.968 2.397 . 0 0 "[ . 1 . 2]" 1
1677 1 71 LEU HA 1 71 LEU HG . . 3.970 3.066 2.912 3.282 . 0 0 "[ . 1 . 2]" 1
1678 1 71 LEU HA 1 73 ASP H . . 4.290 3.986 3.644 4.250 . 0 0 "[ . 1 . 2]" 1
1679 1 71 LEU HA 1 74 THR H . . 4.240 3.707 3.575 3.839 . 0 0 "[ . 1 . 2]" 1
1680 1 71 LEU HA 1 74 THR HG1 . . 4.010 2.536 2.266 2.783 . 0 0 "[ . 1 . 2]" 1
1681 1 71 LEU HA 1 96 VAL H . . 4.730 4.538 4.131 4.721 . 0 0 "[ . 1 . 2]" 1
1682 1 71 LEU HA 1 96 VAL HA . . 5.150 4.946 4.596 5.150 0.000 20 0 "[ . 1 . 2]" 1
1683 1 71 LEU HA 1 96 VAL HB . . 2.940 2.232 1.997 2.433 . 0 0 "[ . 1 . 2]" 1
1684 1 71 LEU HA 1 96 VAL MG1 . . 2.970 2.363 2.098 2.653 . 0 0 "[ . 1 . 2]" 1
1685 1 71 LEU HA 1 96 VAL MG2 . . 3.790 3.585 3.452 3.750 . 0 0 "[ . 1 . 2]" 1
1686 1 71 LEU HB2 1 71 LEU QD . . 3.090 2.220 2.081 2.385 . 0 0 "[ . 1 . 2]" 1
1687 1 71 LEU HB2 1 72 SER H . . 4.350 2.969 2.397 3.297 . 0 0 "[ . 1 . 2]" 1
1688 1 71 LEU HB2 1 72 SER HA . . 4.630 4.425 4.176 4.619 . 0 0 "[ . 1 . 2]" 1
1689 1 71 LEU HB2 1 96 VAL MG1 . . 4.620 4.345 4.075 4.544 . 0 0 "[ . 1 . 2]" 1
1690 1 71 LEU HB3 1 71 LEU MD1 . . 3.450 2.411 2.247 2.562 . 0 0 "[ . 1 . 2]" 1
1691 1 71 LEU HB3 1 71 LEU MD2 . . 3.450 2.297 2.133 2.475 . 0 0 "[ . 1 . 2]" 1
1692 1 71 LEU HB3 1 72 SER H . . 4.120 3.883 3.293 4.078 . 0 0 "[ . 1 . 2]" 1
1693 1 71 LEU HB3 1 72 SER HA . . 4.960 4.484 4.180 4.651 . 0 0 "[ . 1 . 2]" 1
1694 1 71 LEU HB3 1 96 VAL MG1 . . 4.570 4.290 4.022 4.570 . 6 0 "[ . 1 . 2]" 1
1695 1 71 LEU QD 1 72 SER H . . 5.440 4.213 3.910 4.327 . 0 0 "[ . 1 . 2]" 1
1696 1 71 LEU QD 1 72 SER HA . . 5.440 5.145 4.977 5.215 . 0 0 "[ . 1 . 2]" 1
1697 1 71 LEU QD 1 73 ASP H . . 5.440 5.195 4.949 5.430 . 0 0 "[ . 1 . 2]" 1
1698 1 71 LEU QD 1 74 THR HG1 . . 4.220 3.352 3.111 3.706 . 0 0 "[ . 1 . 2]" 1
1699 1 71 LEU QD 1 96 VAL H . . 4.960 4.254 4.038 4.419 . 0 0 "[ . 1 . 2]" 1
1700 1 71 LEU QD 1 96 VAL HA . . 4.680 4.149 3.894 4.345 . 0 0 "[ . 1 . 2]" 1
1701 1 71 LEU QD 1 96 VAL HB . . 3.380 2.955 2.698 3.384 0.004 5 0 "[ . 1 . 2]" 1
1702 1 71 LEU QD 1 97 SER H . . 4.450 3.734 3.379 4.078 . 0 0 "[ . 1 . 2]" 1
1703 1 71 LEU QD 1 98 SER H . . 3.870 2.222 1.854 2.832 . 0 0 "[ . 1 . 2]" 1
1704 1 71 LEU QD 1 98 SER HA . . 3.210 2.754 2.452 3.016 . 0 0 "[ . 1 . 2]" 1
1705 1 71 LEU QD 1 98 SER QB . . 3.070 2.020 1.758 3.058 . 0 0 "[ . 1 . 2]" 1
1706 1 71 LEU MD1 1 74 THR HG1 . . 5.500 5.435 5.298 5.500 0.000 15 0 "[ . 1 . 2]" 1
1707 1 71 LEU MD1 1 98 SER H . . 4.560 3.470 2.979 4.241 . 0 0 "[ . 1 . 2]" 1
1708 1 71 LEU MD1 1 98 SER HA . . 3.890 3.399 2.765 3.725 . 0 0 "[ . 1 . 2]" 1
1709 1 71 LEU MD1 1 98 SER QB . . 3.550 2.121 1.838 3.347 . 0 0 "[ . 1 . 2]" 1
1710 1 71 LEU MD2 1 74 THR HG1 . . 5.500 3.385 3.130 3.768 . 0 0 "[ . 1 . 2]" 1
1711 1 71 LEU MD2 1 98 SER H . . 4.560 2.253 1.863 2.876 . 0 0 "[ . 1 . 2]" 1
1712 1 71 LEU MD2 1 98 SER HA . . 3.890 2.943 2.510 3.302 . 0 0 "[ . 1 . 2]" 1
1713 1 71 LEU MD2 1 98 SER QB . . 3.550 2.625 2.023 3.538 . 0 0 "[ . 1 . 2]" 1
1714 1 71 LEU HG 1 96 VAL MG1 . . 4.490 3.151 2.723 3.656 . 0 0 "[ . 1 . 2]" 1
1715 1 72 SER H 1 72 SER QB . . 3.640 2.353 2.167 2.710 . 0 0 "[ . 1 . 2]" 1
1716 1 72 SER H 1 73 ASP H . . 3.860 2.403 2.255 2.759 . 0 0 "[ . 1 . 2]" 1
1717 1 72 SER HA 1 74 THR H . . 3.760 3.708 3.601 3.767 0.007 7 0 "[ . 1 . 2]" 1
1718 1 72 SER QB 1 73 ASP H . . 4.410 3.065 2.693 3.582 . 0 0 "[ . 1 . 2]" 1
1719 1 72 SER HB2 1 73 ASP H . . 5.120 3.346 2.828 4.028 . 0 0 "[ . 1 . 2]" 1
1720 1 72 SER HB3 1 73 ASP H . . 5.120 3.803 2.758 4.277 . 0 0 "[ . 1 . 2]" 1
1721 1 73 ASP H 1 73 ASP HB2 . . 3.700 2.354 2.246 2.518 . 0 0 "[ . 1 . 2]" 1
1722 1 73 ASP H 1 73 ASP QB . . 3.160 2.323 2.222 2.471 . 0 0 "[ . 1 . 2]" 1
1723 1 73 ASP H 1 73 ASP HB3 . . 3.700 3.573 3.524 3.618 . 0 0 "[ . 1 . 2]" 1
1724 1 73 ASP H 1 74 THR H . . 3.020 2.472 2.216 2.695 . 0 0 "[ . 1 . 2]" 1
1725 1 73 ASP H 1 74 THR HB . . 5.050 4.822 4.594 4.992 . 0 0 "[ . 1 . 2]" 1
1726 1 73 ASP H 1 94 LEU MD2 . . 5.500 5.035 4.773 5.263 . 0 0 "[ . 1 . 2]" 1
1727 1 73 ASP H 1 96 VAL MG2 . . 4.100 3.723 3.437 3.964 . 0 0 "[ . 1 . 2]" 1
1728 1 73 ASP HA 1 94 LEU MD2 . . 4.620 4.498 4.149 4.625 0.005 7 0 "[ . 1 . 2]" 1
1729 1 73 ASP QB 1 74 THR H . . 3.710 3.078 2.897 3.248 . 0 0 "[ . 1 . 2]" 1
1730 1 73 ASP QB 1 77 TYR HH . . 3.450 2.406 2.186 2.632 . 0 0 "[ . 1 . 2]" 1
1731 1 73 ASP QB 1 94 LEU MD2 . . 3.160 2.638 2.401 2.763 . 0 0 "[ . 1 . 2]" 1
1732 1 73 ASP QB 1 96 VAL MG1 . . 4.780 3.802 3.490 4.048 . 0 0 "[ . 1 . 2]" 1
1733 1 73 ASP QB 1 96 VAL MG2 . . 3.210 2.572 2.219 2.834 . 0 0 "[ . 1 . 2]" 1
1734 1 73 ASP HB2 1 74 THR H . . 4.230 3.214 2.982 3.461 . 0 0 "[ . 1 . 2]" 1
1735 1 73 ASP HB2 1 77 TYR HH . . 4.250 4.011 3.789 4.240 . 0 0 "[ . 1 . 2]" 1
1736 1 73 ASP HB2 1 94 LEU MD2 . . 3.640 3.340 3.040 3.606 . 0 0 "[ . 1 . 2]" 1
1737 1 73 ASP HB2 1 96 VAL MG2 . . 3.720 2.646 2.246 2.956 . 0 0 "[ . 1 . 2]" 1
1738 1 73 ASP HB3 1 74 THR H . . 4.230 3.952 3.812 4.121 . 0 0 "[ . 1 . 2]" 1
1739 1 73 ASP HB3 1 77 TYR HH . . 4.250 2.426 2.198 2.658 . 0 0 "[ . 1 . 2]" 1
1740 1 73 ASP HB3 1 94 LEU MD2 . . 3.640 2.770 2.514 2.910 . 0 0 "[ . 1 . 2]" 1
1741 1 73 ASP HB3 1 96 VAL MG2 . . 3.720 3.546 3.194 3.720 0.000 16 0 "[ . 1 . 2]" 1
1742 1 74 THR H 1 74 THR HB . . 2.810 2.559 2.522 2.623 . 0 0 "[ . 1 . 2]" 1
1743 1 74 THR H 1 74 THR HG1 . . 3.060 2.761 2.705 2.831 . 0 0 "[ . 1 . 2]" 1
1744 1 74 THR H 1 74 THR MG . . 3.780 3.766 3.764 3.776 . 0 0 "[ . 1 . 2]" 1
1745 1 74 THR H 1 75 GLY H . . 4.590 4.549 4.495 4.577 . 0 0 "[ . 1 . 2]" 1
1746 1 74 THR H 1 96 VAL H . . 5.220 4.900 4.509 5.071 . 0 0 "[ . 1 . 2]" 1
1747 1 74 THR H 1 96 VAL HB . . 4.010 3.585 3.279 3.814 . 0 0 "[ . 1 . 2]" 1
1748 1 74 THR H 1 96 VAL MG2 . . 3.650 3.074 2.821 3.410 . 0 0 "[ . 1 . 2]" 1
1749 1 74 THR HA 1 74 THR HG1 . . 3.970 3.481 3.441 3.510 . 0 0 "[ . 1 . 2]" 1
1750 1 74 THR HA 1 74 THR MG . . 2.940 2.453 2.436 2.468 . 0 0 "[ . 1 . 2]" 1
1751 1 74 THR HA 1 75 GLY H . . 2.690 2.157 2.147 2.170 . 0 0 "[ . 1 . 2]" 1
1752 1 74 THR HA 1 75 GLY HA2 . . 4.540 4.427 4.401 4.449 . 0 0 "[ . 1 . 2]" 1
1753 1 74 THR HA 1 77 TYR QE . . 4.480 4.024 3.880 4.208 . 0 0 "[ . 1 . 2]" 1
1754 1 74 THR HA 1 93 TYR QE . . 5.240 4.929 4.624 5.233 . 0 0 "[ . 1 . 2]" 1
1755 1 74 THR HA 1 94 LEU H . . 4.970 4.472 4.287 4.642 . 0 0 "[ . 1 . 2]" 1
1756 1 74 THR HA 1 94 LEU HB3 . . 4.260 3.600 3.401 3.967 . 0 0 "[ . 1 . 2]" 1
1757 1 74 THR HA 1 94 LEU MD2 . . 4.230 3.194 2.930 3.363 . 0 0 "[ . 1 . 2]" 1
1758 1 74 THR HA 1 94 LEU HG . . 4.100 3.590 3.292 3.726 . 0 0 "[ . 1 . 2]" 1
1759 1 74 THR HA 1 95 ASN HA . . 4.000 3.833 3.515 4.001 0.001 10 0 "[ . 1 . 2]" 1
1760 1 74 THR HA 1 96 VAL H . . 3.950 3.839 3.562 3.951 0.001 19 0 "[ . 1 . 2]" 1
1761 1 74 THR HA 1 96 VAL MG2 . . 3.610 2.758 2.504 2.992 . 0 0 "[ . 1 . 2]" 1
1762 1 74 THR HB 1 75 GLY H . . 4.500 4.211 4.145 4.291 . 0 0 "[ . 1 . 2]" 1
1763 1 74 THR HB 1 96 VAL H . . 4.370 4.251 3.871 4.366 . 0 0 "[ . 1 . 2]" 1
1764 1 74 THR HB 1 96 VAL HB . . 4.550 4.140 3.999 4.290 . 0 0 "[ . 1 . 2]" 1
1765 1 74 THR HB 1 96 VAL MG2 . . 4.510 4.197 3.931 4.462 . 0 0 "[ . 1 . 2]" 1
1766 1 74 THR HG1 1 74 THR MG . . 3.190 2.790 2.754 2.821 . 0 0 "[ . 1 . 2]" 1
1767 1 74 THR HG1 1 96 VAL H . . 3.380 2.953 2.547 3.137 . 0 0 "[ . 1 . 2]" 1
1768 1 74 THR HG1 1 96 VAL HB . . 3.860 2.203 2.063 2.440 . 0 0 "[ . 1 . 2]" 1
1769 1 74 THR HG1 1 96 VAL MG1 . . 4.780 3.760 3.653 3.946 . 0 0 "[ . 1 . 2]" 1
1770 1 74 THR HG1 1 96 VAL MG2 . . 4.070 3.205 2.961 3.445 . 0 0 "[ . 1 . 2]" 1
1771 1 74 THR MG 1 75 GLY H . . 3.070 2.437 2.298 2.600 . 0 0 "[ . 1 . 2]" 1
1772 1 74 THR MG 1 75 GLY HA2 . . 3.660 3.073 3.038 3.116 . 0 0 "[ . 1 . 2]" 1
1773 1 74 THR MG 1 75 GLY HA3 . . 4.220 3.959 3.911 4.027 . 0 0 "[ . 1 . 2]" 1
1774 1 74 THR MG 1 76 VAL H . . 5.500 5.493 5.459 5.522 0.022 7 0 "[ . 1 . 2]" 1
1775 1 74 THR MG 1 93 TYR QD . . 4.440 4.282 4.020 4.410 . 0 0 "[ . 1 . 2]" 1
1776 1 74 THR MG 1 93 TYR QE . . 3.310 2.857 2.488 3.078 . 0 0 "[ . 1 . 2]" 1
1777 1 74 THR MG 1 95 ASN HA . . 2.830 2.216 1.976 2.385 . 0 0 "[ . 1 . 2]" 1
1778 1 74 THR MG 1 95 ASN HB2 . . 4.200 3.998 3.744 4.135 . 0 0 "[ . 1 . 2]" 1
1779 1 74 THR MG 1 95 ASN HB3 . . 4.970 4.864 4.601 4.970 . 0 0 "[ . 1 . 2]" 1
1780 1 74 THR MG 1 96 VAL H . . 3.300 2.490 2.378 2.656 . 0 0 "[ . 1 . 2]" 1
1781 1 74 THR MG 1 96 VAL HB . . 4.090 3.996 3.927 4.091 0.001 3 0 "[ . 1 . 2]" 1
1782 1 74 THR MG 1 96 VAL MG2 . . 3.900 3.560 3.285 3.761 . 0 0 "[ . 1 . 2]" 1
1783 1 75 GLY H 1 76 VAL H . . 4.460 4.242 4.146 4.334 . 0 0 "[ . 1 . 2]" 1
1784 1 75 GLY H 1 77 TYR QE . . 3.990 3.381 3.047 3.645 . 0 0 "[ . 1 . 2]" 1
1785 1 75 GLY H 1 93 TYR HA . . 4.960 4.648 4.474 4.792 . 0 0 "[ . 1 . 2]" 1
1786 1 75 GLY H 1 93 TYR QD . . 4.880 4.530 4.310 4.679 . 0 0 "[ . 1 . 2]" 1
1787 1 75 GLY H 1 93 TYR QE . . 4.470 4.080 3.836 4.306 . 0 0 "[ . 1 . 2]" 1
1788 1 75 GLY H 1 94 LEU H . . 3.590 2.950 2.833 3.093 . 0 0 "[ . 1 . 2]" 1
1789 1 75 GLY H 1 94 LEU HB2 . . 4.980 4.764 4.563 4.898 . 0 0 "[ . 1 . 2]" 1
1790 1 75 GLY H 1 94 LEU HB3 . . 3.860 3.102 2.891 3.252 . 0 0 "[ . 1 . 2]" 1
1791 1 75 GLY H 1 94 LEU MD2 . . 4.430 3.821 3.576 4.101 . 0 0 "[ . 1 . 2]" 1
1792 1 75 GLY H 1 94 LEU HG . . 4.490 4.402 4.095 4.490 . 0 0 "[ . 1 . 2]" 1
1793 1 75 GLY H 1 95 ASN HA . . 5.230 4.416 4.134 4.590 . 0 0 "[ . 1 . 2]" 1
1794 1 75 GLY H 1 96 VAL MG2 . . 4.700 4.416 4.209 4.633 . 0 0 "[ . 1 . 2]" 1
1795 1 75 GLY HA2 1 76 VAL H . . 3.160 3.007 2.856 3.134 . 0 0 "[ . 1 . 2]" 1
1796 1 75 GLY HA2 1 76 VAL HB . . 5.020 4.865 4.740 5.001 . 0 0 "[ . 1 . 2]" 1
1797 1 75 GLY HA2 1 76 VAL QG . . 3.990 3.397 3.185 3.701 . 0 0 "[ . 1 . 2]" 1
1798 1 75 GLY HA2 1 93 TYR QD . . 4.660 4.179 3.844 4.373 . 0 0 "[ . 1 . 2]" 1
1799 1 75 GLY HA2 1 93 TYR QE . . 3.890 3.071 2.539 3.350 . 0 0 "[ . 1 . 2]" 1
1800 1 75 GLY HA3 1 76 VAL H . . 3.060 2.217 2.157 2.308 . 0 0 "[ . 1 . 2]" 1
1801 1 75 GLY HA3 1 76 VAL MG1 . . 5.500 5.529 5.506 5.565 0.065 17 0 "[ . 1 . 2]" 1
1802 1 75 GLY HA3 1 76 VAL QG . . 4.340 3.961 3.716 4.250 . 0 0 "[ . 1 . 2]" 1
1803 1 75 GLY HA3 1 76 VAL MG2 . . 5.500 4.062 3.778 4.418 . 0 0 "[ . 1 . 2]" 1
1804 1 75 GLY HA3 1 93 TYR QD . . 5.500 5.261 4.904 5.491 . 0 0 "[ . 1 . 2]" 1
1805 1 75 GLY HA3 1 93 TYR QE . . 4.920 4.652 4.182 4.895 . 0 0 "[ . 1 . 2]" 1
1806 1 75 GLY HA3 1 94 LEU H . . 5.480 4.895 4.642 5.139 . 0 0 "[ . 1 . 2]" 1
1807 1 76 VAL H 1 76 VAL HB . . 3.120 2.635 2.443 2.800 . 0 0 "[ . 1 . 2]" 1
1808 1 76 VAL H 1 76 VAL MG1 . . 3.960 3.811 3.694 3.904 . 0 0 "[ . 1 . 2]" 1
1809 1 76 VAL H 1 76 VAL QG . . 2.920 2.867 2.719 2.934 0.014 7 0 "[ . 1 . 2]" 1
1810 1 76 VAL H 1 76 VAL MG2 . . 3.960 2.966 2.776 3.067 . 0 0 "[ . 1 . 2]" 1
1811 1 76 VAL H 1 77 TYR H . . 4.680 4.340 4.269 4.451 . 0 0 "[ . 1 . 2]" 1
1812 1 76 VAL H 1 93 TYR QD . . 4.890 4.738 4.204 4.898 0.008 5 0 "[ . 1 . 2]" 1
1813 1 76 VAL H 1 93 TYR QE . . 5.230 4.945 4.349 5.154 . 0 0 "[ . 1 . 2]" 1
1814 1 76 VAL HA 1 76 VAL MG1 . . 3.190 2.447 2.348 2.555 . 0 0 "[ . 1 . 2]" 1
1815 1 76 VAL HA 1 76 VAL MG2 . . 3.190 2.342 2.157 2.453 . 0 0 "[ . 1 . 2]" 1
1816 1 76 VAL HA 1 77 TYR H . . 2.870 2.163 2.144 2.177 . 0 0 "[ . 1 . 2]" 1
1817 1 76 VAL HA 1 92 ALA H . . 4.580 4.226 3.985 4.507 . 0 0 "[ . 1 . 2]" 1
1818 1 76 VAL HA 1 93 TYR HA . . 3.140 2.228 2.023 2.394 . 0 0 "[ . 1 . 2]" 1
1819 1 76 VAL HA 1 93 TYR QD . . 3.980 3.581 2.939 3.984 0.004 11 0 "[ . 1 . 2]" 1
1820 1 76 VAL HA 1 94 LEU H . . 3.950 3.421 3.036 3.840 . 0 0 "[ . 1 . 2]" 1
1821 1 76 VAL HB 1 77 TYR H . . 4.680 4.205 4.095 4.311 . 0 0 "[ . 1 . 2]" 1
1822 1 76 VAL HB 1 93 TYR HA . . 5.260 4.917 4.576 5.172 . 0 0 "[ . 1 . 2]" 1
1823 1 76 VAL HB 1 93 TYR QD . . 4.710 4.428 4.340 4.505 . 0 0 "[ . 1 . 2]" 1
1824 1 76 VAL HB 1 93 TYR QE . . 5.500 5.404 5.235 5.501 0.001 11 0 "[ . 1 . 2]" 1
1825 1 76 VAL QG 1 77 TYR H . . 3.210 2.380 2.218 2.652 . 0 0 "[ . 1 . 2]" 1
1826 1 76 VAL QG 1 78 THR H . . 4.600 4.137 3.742 4.531 . 0 0 "[ . 1 . 2]" 1
1827 1 76 VAL QG 1 78 THR HA . . 4.610 4.169 3.928 4.409 . 0 0 "[ . 1 . 2]" 1
1828 1 76 VAL QG 1 91 SER HA . . 4.290 3.739 3.495 4.057 . 0 0 "[ . 1 . 2]" 1
1829 1 76 VAL QG 1 91 SER QB . . 3.000 2.669 2.218 2.981 . 0 0 "[ . 1 . 2]" 1
1830 1 76 VAL QG 1 92 ALA H . . 3.680 2.525 2.246 2.887 . 0 0 "[ . 1 . 2]" 1
1831 1 76 VAL QG 1 93 TYR H . . 5.440 3.924 3.519 4.174 . 0 0 "[ . 1 . 2]" 1
1832 1 76 VAL QG 1 93 TYR HA . . 3.480 2.704 2.292 3.030 . 0 0 "[ . 1 . 2]" 1
1833 1 76 VAL QG 1 93 TYR QB . . 3.660 2.638 2.216 2.893 . 0 0 "[ . 1 . 2]" 1
1834 1 76 VAL QG 1 93 TYR QD . . 2.820 1.834 1.786 1.912 . 0 0 "[ . 1 . 2]" 1
1835 1 76 VAL QG 1 93 TYR QE . . 3.400 2.944 2.726 3.094 . 0 0 "[ . 1 . 2]" 1
1836 1 76 VAL QG 1 94 LEU H . . 4.520 3.946 3.720 4.259 . 0 0 "[ . 1 . 2]" 1
1837 1 76 VAL MG1 1 77 TYR H . . 4.050 2.404 2.236 2.699 . 0 0 "[ . 1 . 2]" 1
1838 1 76 VAL MG1 1 92 ALA H . . 5.080 2.541 2.254 2.912 . 0 0 "[ . 1 . 2]" 1
1839 1 76 VAL MG1 1 93 TYR HA . . 4.160 3.559 3.254 3.830 . 0 0 "[ . 1 . 2]" 1
1840 1 76 VAL MG1 1 93 TYR QD . . 4.300 3.999 3.675 4.296 . 0 0 "[ . 1 . 2]" 1
1841 1 76 VAL MG2 1 77 TYR H . . 4.050 3.876 3.694 4.020 . 0 0 "[ . 1 . 2]" 1
1842 1 76 VAL MG2 1 92 ALA H . . 5.080 4.426 4.119 4.813 . 0 0 "[ . 1 . 2]" 1
1843 1 76 VAL MG2 1 93 TYR HA . . 4.160 2.815 2.334 3.232 . 0 0 "[ . 1 . 2]" 1
1844 1 76 VAL MG2 1 93 TYR QD . . 4.300 1.837 1.789 1.914 . 0 0 "[ . 1 . 2]" 1
1845 1 77 TYR H 1 77 TYR HB2 . . 3.950 2.519 2.474 2.567 . 0 0 "[ . 1 . 2]" 1
1846 1 77 TYR H 1 77 TYR QB . . 3.360 2.480 2.437 2.525 . 0 0 "[ . 1 . 2]" 1
1847 1 77 TYR H 1 77 TYR HB3 . . 3.950 3.703 3.669 3.731 . 0 0 "[ . 1 . 2]" 1
1848 1 77 TYR H 1 77 TYR QD . . 4.130 2.370 2.202 2.684 . 0 0 "[ . 1 . 2]" 1
1849 1 77 TYR H 1 78 THR H . . 5.150 4.429 4.262 4.537 . 0 0 "[ . 1 . 2]" 1
1850 1 77 TYR H 1 91 SER QB . . 4.870 4.746 4.456 4.868 . 0 0 "[ . 1 . 2]" 1
1851 1 77 TYR H 1 92 ALA H . . 3.710 3.006 2.898 3.091 . 0 0 "[ . 1 . 2]" 1
1852 1 77 TYR H 1 92 ALA MB . . 4.770 3.759 3.518 4.060 . 0 0 "[ . 1 . 2]" 1
1853 1 77 TYR H 1 93 TYR HA . . 4.050 3.348 3.023 3.518 . 0 0 "[ . 1 . 2]" 1
1854 1 77 TYR H 1 94 LEU H . . 5.040 4.536 4.063 4.924 . 0 0 "[ . 1 . 2]" 1
1855 1 77 TYR QB 1 78 THR H . . 3.810 3.060 2.543 3.437 . 0 0 "[ . 1 . 2]" 1
1856 1 77 TYR QB 1 92 ALA H . . 4.480 3.964 3.639 4.200 . 0 0 "[ . 1 . 2]" 1
1857 1 77 TYR QB 1 92 ALA MB . . 4.130 3.321 3.050 3.557 . 0 0 "[ . 1 . 2]" 1
1858 1 77 TYR HB2 1 78 THR H . . 4.620 4.147 3.765 4.379 . 0 0 "[ . 1 . 2]" 1
1859 1 77 TYR HB3 1 78 THR H . . 4.620 3.154 2.586 3.593 . 0 0 "[ . 1 . 2]" 1
1860 1 77 TYR QD 1 94 LEU HB2 . . 4.650 3.507 3.160 3.808 . 0 0 "[ . 1 . 2]" 1
1861 1 77 TYR QD 1 94 LEU HB3 . . 4.840 3.207 2.960 3.510 . 0 0 "[ . 1 . 2]" 1
1862 1 77 TYR QE 1 94 LEU H . . 4.450 3.847 3.518 4.249 . 0 0 "[ . 1 . 2]" 1
1863 1 77 TYR QE 1 94 LEU HB2 . . 4.100 3.357 3.131 3.706 . 0 0 "[ . 1 . 2]" 1
1864 1 77 TYR QE 1 94 LEU HB3 . . 3.770 2.164 2.007 2.465 . 0 0 "[ . 1 . 2]" 1
1865 1 77 TYR QE 1 94 LEU MD1 . . 4.710 4.348 4.154 4.624 . 0 0 "[ . 1 . 2]" 1
1866 1 77 TYR QE 1 94 LEU MD2 . . 3.610 2.315 2.098 2.607 . 0 0 "[ . 1 . 2]" 1
1867 1 77 TYR HH 1 94 LEU HB2 . . 5.500 5.362 5.088 5.507 0.007 9 0 "[ . 1 . 2]" 1
1868 1 77 TYR HH 1 94 LEU HB3 . . 5.230 4.164 3.931 4.360 . 0 0 "[ . 1 . 2]" 1
1869 1 77 TYR HH 1 94 LEU MD2 . . 3.570 2.792 2.521 3.199 . 0 0 "[ . 1 . 2]" 1
1870 1 78 THR H 1 78 THR HB . . 3.360 2.691 2.572 2.809 . 0 0 "[ . 1 . 2]" 1
1871 1 78 THR H 1 78 THR MG . . 4.130 3.870 3.820 3.918 . 0 0 "[ . 1 . 2]" 1
1872 1 78 THR H 1 91 SER HA . . 5.050 4.707 4.542 4.860 . 0 0 "[ . 1 . 2]" 1
1873 1 78 THR HA 1 78 THR MG . . 3.160 2.365 2.180 2.455 . 0 0 "[ . 1 . 2]" 1
1874 1 78 THR HA 1 79 CYS H . . 2.960 2.154 2.141 2.207 . 0 0 "[ . 1 . 2]" 1
1875 1 78 THR HA 1 91 SER HA . . 3.070 2.207 2.013 2.385 . 0 0 "[ . 1 . 2]" 1
1876 1 78 THR HA 1 91 SER QB . . 4.180 3.814 3.434 4.163 . 0 0 "[ . 1 . 2]" 1
1877 1 78 THR HB 1 80 MET HG2 . . 4.970 4.610 4.198 4.882 . 0 0 "[ . 1 . 2]" 1
1878 1 78 THR HB 1 80 MET HG3 . . 4.860 4.688 4.071 4.857 . 0 0 "[ . 1 . 2]" 1
1879 1 78 THR MG 1 79 CYS H . . 3.400 2.627 2.119 3.023 . 0 0 "[ . 1 . 2]" 1
1880 1 78 THR MG 1 79 CYS HA . . 4.820 3.957 3.708 4.310 . 0 0 "[ . 1 . 2]" 1
1881 1 78 THR MG 1 80 MET H . . 4.660 4.451 4.039 4.657 . 0 0 "[ . 1 . 2]" 1
1882 1 78 THR MG 1 80 MET ME . . 4.980 4.199 3.681 4.679 . 0 0 "[ . 1 . 2]" 1
1883 1 78 THR MG 1 80 MET HG2 . . 3.540 3.278 3.007 3.522 . 0 0 "[ . 1 . 2]" 1
1884 1 78 THR MG 1 80 MET HG3 . . 4.110 3.955 3.808 4.111 0.001 3 0 "[ . 1 . 2]" 1
1885 1 78 THR MG 1 89 ASN HA . . 4.560 4.308 4.037 4.557 . 0 0 "[ . 1 . 2]" 1
1886 1 78 THR MG 1 89 ASN QB . . 2.990 2.645 2.267 2.964 . 0 0 "[ . 1 . 2]" 1
1887 1 78 THR MG 1 89 ASN QD . . 4.260 3.332 2.546 4.024 . 0 0 "[ . 1 . 2]" 1
1888 1 78 THR MG 1 90 ALA H . . 3.500 3.177 2.807 3.429 . 0 0 "[ . 1 . 2]" 1
1889 1 78 THR MG 1 90 ALA MB . . 4.640 4.350 4.158 4.514 . 0 0 "[ . 1 . 2]" 1
1890 1 78 THR MG 1 91 SER H . . 4.860 4.573 4.345 4.762 . 0 0 "[ . 1 . 2]" 1
1891 1 78 THR MG 1 91 SER HA . . 4.020 3.358 3.131 3.503 . 0 0 "[ . 1 . 2]" 1
1892 1 78 THR MG 1 91 SER HB2 . . 4.740 4.565 4.286 4.705 . 0 0 "[ . 1 . 2]" 1
1893 1 78 THR MG 1 91 SER QB . . 4.100 3.750 2.978 4.070 . 0 0 "[ . 1 . 2]" 1
1894 1 78 THR MG 1 91 SER HB3 . . 4.740 4.043 3.024 4.545 . 0 0 "[ . 1 . 2]" 1
1895 1 78 THR MG 1 91 SER HG . . 4.480 2.900 2.170 4.392 . 0 0 "[ . 1 . 2]" 1
1896 1 79 CYS H 1 79 CYS HB2 . . 3.740 2.864 2.679 3.637 . 0 0 "[ . 1 . 2]" 1
1897 1 79 CYS H 1 79 CYS QB . . 3.230 2.358 2.275 2.929 . 0 0 "[ . 1 . 2]" 1
1898 1 79 CYS H 1 79 CYS HB3 . . 3.740 2.517 2.391 3.089 . 0 0 "[ . 1 . 2]" 1
1899 1 79 CYS H 1 80 MET H . . 4.570 4.472 4.261 4.574 0.004 2 0 "[ . 1 . 2]" 1
1900 1 79 CYS H 1 90 ALA H . . 3.610 2.896 2.478 3.169 . 0 0 "[ . 1 . 2]" 1
1901 1 79 CYS H 1 90 ALA MB . . 4.590 3.429 3.144 3.828 . 0 0 "[ . 1 . 2]" 1
1902 1 79 CYS H 1 91 SER HA . . 3.890 3.333 3.025 3.705 . 0 0 "[ . 1 . 2]" 1
1903 1 79 CYS HA 1 80 MET H . . 2.950 2.168 2.140 2.232 . 0 0 "[ . 1 . 2]" 1
1904 1 79 CYS HA 1 80 MET HB2 . . 5.150 4.728 4.586 4.861 . 0 0 "[ . 1 . 2]" 1
1905 1 79 CYS HA 1 80 MET ME . . 5.500 4.849 4.518 5.098 . 0 0 "[ . 1 . 2]" 1
1906 1 79 CYS HA 1 80 MET HG2 . . 4.990 4.549 4.301 4.814 . 0 0 "[ . 1 . 2]" 1
1907 1 79 CYS HA 1 80 MET HG3 . . 5.170 3.717 3.533 3.863 . 0 0 "[ . 1 . 2]" 1
1908 1 79 CYS QB 1 80 MET H . . 4.290 3.697 3.141 3.908 . 0 0 "[ . 1 . 2]" 1
1909 1 79 CYS QB 1 89 ASN HA . . 4.480 4.226 3.742 4.480 0.000 15 0 "[ . 1 . 2]" 1
1910 1 79 CYS QB 1 90 ALA H . . 3.810 2.977 2.486 3.781 . 0 0 "[ . 1 . 2]" 1
1911 1 79 CYS QB 1 90 ALA MB . . 4.150 2.713 2.344 4.101 . 0 0 "[ . 1 . 2]" 1
1912 1 79 CYS QB 1 91 SER HA . . 5.340 4.783 4.514 5.256 . 0 0 "[ . 1 . 2]" 1
1913 1 79 CYS HB2 1 80 MET H . . 5.020 4.149 3.268 4.315 . 0 0 "[ . 1 . 2]" 1
1914 1 79 CYS HB3 1 80 MET H . . 5.020 4.168 3.979 4.468 . 0 0 "[ . 1 . 2]" 1
1915 1 80 MET H 1 80 MET HB2 . . 3.460 2.651 2.556 2.722 . 0 0 "[ . 1 . 2]" 1
1916 1 80 MET H 1 80 MET HB3 . . 3.850 3.707 3.640 3.788 . 0 0 "[ . 1 . 2]" 1
1917 1 80 MET H 1 80 MET HG2 . . 3.970 3.380 2.987 3.689 . 0 0 "[ . 1 . 2]" 1
1918 1 80 MET H 1 80 MET HG3 . . 3.780 2.492 2.170 2.903 . 0 0 "[ . 1 . 2]" 1
1919 1 80 MET HA 1 80 MET HG2 . . 3.760 2.587 2.474 2.719 . 0 0 "[ . 1 . 2]" 1
1920 1 80 MET HA 1 80 MET HG3 . . 3.860 3.364 3.273 3.491 . 0 0 "[ . 1 . 2]" 1
1921 1 80 MET HA 1 81 VAL H . . 2.850 2.221 2.169 2.274 . 0 0 "[ . 1 . 2]" 1
1922 1 80 MET HA 1 89 ASN HA . . 3.420 2.849 2.575 3.092 . 0 0 "[ . 1 . 2]" 1
1923 1 80 MET HA 1 89 ASN HB2 . . 4.250 3.394 2.761 4.194 . 0 0 "[ . 1 . 2]" 1
1924 1 80 MET HA 1 89 ASN QB . . 3.740 2.558 1.994 3.214 . 0 0 "[ . 1 . 2]" 1
1925 1 80 MET HA 1 89 ASN HB3 . . 4.250 2.685 2.023 3.520 . 0 0 "[ . 1 . 2]" 1
1926 1 80 MET HA 1 90 ALA H . . 4.590 4.043 3.798 4.424 . 0 0 "[ . 1 . 2]" 1
1927 1 80 MET HB2 1 81 VAL H . . 4.620 3.874 3.707 4.027 . 0 0 "[ . 1 . 2]" 1
1928 1 80 MET HB3 1 81 VAL H . . 4.550 2.976 2.810 3.195 . 0 0 "[ . 1 . 2]" 1
1929 1 80 MET ME 1 80 MET HG2 . . 3.840 2.971 2.700 3.270 . 0 0 "[ . 1 . 2]" 1
1930 1 80 MET ME 1 80 MET HG3 . . 3.920 2.111 1.992 2.344 . 0 0 "[ . 1 . 2]" 1
1931 1 80 MET HG2 1 81 VAL H . . 4.610 4.474 4.329 4.605 . 0 0 "[ . 1 . 2]" 1
1932 1 80 MET HG3 1 81 VAL H . . 5.270 5.199 5.123 5.271 0.001 9 0 "[ . 1 . 2]" 1
1933 1 81 VAL H 1 81 VAL HB . . 3.250 2.814 2.728 2.891 . 0 0 "[ . 1 . 2]" 1
1934 1 81 VAL H 1 81 VAL MG1 . . 4.000 3.916 3.871 3.954 . 0 0 "[ . 1 . 2]" 1
1935 1 81 VAL H 1 81 VAL MG2 . . 3.430 2.900 2.667 3.077 . 0 0 "[ . 1 . 2]" 1
1936 1 81 VAL H 1 88 SER H . . 3.760 3.353 3.057 3.568 . 0 0 "[ . 1 . 2]" 1
1937 1 81 VAL H 1 89 ASN HA . . 3.810 3.329 2.963 3.657 . 0 0 "[ . 1 . 2]" 1
1938 1 81 VAL H 1 89 ASN HB2 . . 5.110 4.721 4.199 5.109 . 0 0 "[ . 1 . 2]" 1
1939 1 81 VAL H 1 89 ASN QB . . 4.400 3.433 2.869 4.333 . 0 0 "[ . 1 . 2]" 1
1940 1 81 VAL H 1 89 ASN HB3 . . 5.110 3.541 2.906 4.747 . 0 0 "[ . 1 . 2]" 1
1941 1 81 VAL HA 1 81 VAL MG1 . . 3.290 2.374 2.195 2.446 . 0 0 "[ . 1 . 2]" 1
1942 1 81 VAL HA 1 81 VAL MG2 . . 3.350 2.384 2.246 2.532 . 0 0 "[ . 1 . 2]" 1
1943 1 81 VAL HA 1 82 THR H . . 2.860 2.145 2.139 2.151 . 0 0 "[ . 1 . 2]" 1
1944 1 81 VAL HB 1 82 THR H . . 4.390 4.297 4.137 4.366 . 0 0 "[ . 1 . 2]" 1
1945 1 81 VAL HB 1 88 SER H . . 3.730 2.703 2.162 3.126 . 0 0 "[ . 1 . 2]" 1
1946 1 81 VAL HB 1 88 SER HB2 . . 4.280 3.583 2.649 4.247 . 0 0 "[ . 1 . 2]" 1
1947 1 81 VAL HB 1 88 SER HB3 . . 4.280 3.867 2.598 4.279 . 0 0 "[ . 1 . 2]" 1
1948 1 81 VAL HB 1 89 ASN HA . . 4.810 3.995 3.542 4.336 . 0 0 "[ . 1 . 2]" 1
1949 1 81 VAL MG1 1 82 THR H . . 3.430 2.815 2.584 3.009 . 0 0 "[ . 1 . 2]" 1
1950 1 81 VAL MG1 1 88 SER H . . 4.500 3.556 3.056 3.929 . 0 0 "[ . 1 . 2]" 1
1951 1 81 VAL MG1 1 88 SER HB2 . . 4.970 4.146 3.171 4.970 . 0 0 "[ . 1 . 2]" 1
1952 1 81 VAL MG1 1 88 SER QB . . 4.370 3.680 3.080 4.264 . 0 0 "[ . 1 . 2]" 1
1953 1 81 VAL MG1 1 88 SER HB3 . . 4.970 4.422 3.229 4.919 . 0 0 "[ . 1 . 2]" 1
1954 1 81 VAL MG2 1 82 THR H . . 4.260 4.158 4.036 4.239 . 0 0 "[ . 1 . 2]" 1
1955 1 81 VAL MG2 1 88 SER H . . 4.620 4.221 3.800 4.572 . 0 0 "[ . 1 . 2]" 1
1956 1 81 VAL MG2 1 88 SER QB . . 4.380 3.718 3.112 4.211 . 0 0 "[ . 1 . 2]" 1
1957 1 81 VAL MG2 1 89 ASN HA . . 4.570 3.079 2.732 3.471 . 0 0 "[ . 1 . 2]" 1
1958 1 81 VAL MG2 1 90 ALA H . . 5.420 4.280 3.909 4.744 . 0 0 "[ . 1 . 2]" 1
1959 1 82 THR H 1 82 THR HB . . 3.520 2.783 2.582 3.545 0.025 2 0 "[ . 1 . 2]" 1
1960 1 82 THR H 1 82 THR MG . . 4.000 3.860 3.267 3.942 . 0 0 "[ . 1 . 2]" 1
1961 1 82 THR HA 1 82 THR MG . . 3.250 2.272 2.028 2.521 . 0 0 "[ . 1 . 2]" 1
1962 1 82 THR HA 1 83 ASN H . . 2.960 2.150 2.142 2.180 . 0 0 "[ . 1 . 2]" 1
1963 1 82 THR HA 1 87 ASN HA . . 3.430 2.719 2.342 3.079 . 0 0 "[ . 1 . 2]" 1
1964 1 82 THR HA 1 87 ASN HB2 . . 4.950 3.805 2.373 4.807 . 0 0 "[ . 1 . 2]" 1
1965 1 82 THR HA 1 87 ASN QB . . 4.320 2.993 2.074 3.533 . 0 0 "[ . 1 . 2]" 1
1966 1 82 THR HA 1 87 ASN HB3 . . 4.950 3.351 2.288 4.907 . 0 0 "[ . 1 . 2]" 1
1967 1 82 THR HA 1 88 SER H . . 4.410 3.788 3.504 4.219 . 0 0 "[ . 1 . 2]" 1
1968 1 82 THR HB 1 83 ASN H . . 4.230 4.119 3.585 4.228 . 0 0 "[ . 1 . 2]" 1
1969 1 82 THR MG 1 83 ASN H . . 3.610 2.738 2.253 3.611 0.001 2 0 "[ . 1 . 2]" 1
1970 1 82 THR MG 1 87 ASN HA . . 4.470 4.055 3.776 4.445 . 0 0 "[ . 1 . 2]" 1
1971 1 82 THR MG 1 87 ASN HB2 . . 4.620 4.045 3.042 4.618 . 0 0 "[ . 1 . 2]" 1
1972 1 82 THR MG 1 87 ASN QB . . 4.010 3.174 2.328 3.755 . 0 0 "[ . 1 . 2]" 1
1973 1 82 THR MG 1 87 ASN HB3 . . 4.620 3.511 2.380 4.601 . 0 0 "[ . 1 . 2]" 1
1974 1 82 THR MG 1 87 ASN QD . . 4.700 3.613 1.970 4.667 . 0 0 "[ . 1 . 2]" 1
1975 1 83 ASN H 1 86 GLY H . . 3.920 3.705 3.283 3.921 0.001 2 0 "[ . 1 . 2]" 1
1976 1 83 ASN H 1 87 ASN HA . . 4.190 3.002 2.704 3.226 . 0 0 "[ . 1 . 2]" 1
1977 1 83 ASN H 1 87 ASN QB . . 4.710 3.727 2.778 4.547 . 0 0 "[ . 1 . 2]" 1
1978 1 83 ASN HA 1 86 GLY H . . 5.060 4.669 4.386 4.973 . 0 0 "[ . 1 . 2]" 1
1979 1 83 ASN QB 1 85 ALA H . . 4.120 2.844 2.340 3.639 . 0 0 "[ . 1 . 2]" 1
1980 1 83 ASN QB 1 86 GLY H . . 3.990 2.377 2.086 3.577 . 0 0 "[ . 1 . 2]" 1
1981 1 83 ASN HB2 1 85 ALA H . . 4.980 3.892 2.601 4.654 . 0 0 "[ . 1 . 2]" 1
1982 1 83 ASN HB2 1 86 GLY H . . 4.590 3.672 2.201 4.344 . 0 0 "[ . 1 . 2]" 1
1983 1 83 ASN HB3 1 85 ALA H . . 4.980 3.064 2.355 4.235 . 0 0 "[ . 1 . 2]" 1
1984 1 83 ASN HB3 1 86 GLY H . . 4.590 2.736 2.095 4.591 0.001 16 0 "[ . 1 . 2]" 1
1985 1 84 VAL H 1 84 VAL HB . . 3.800 2.579 2.394 2.921 . 0 0 "[ . 1 . 2]" 1
1986 1 84 VAL H 1 84 VAL MG1 . . 3.360 2.115 1.843 2.424 . 0 0 "[ . 1 . 2]" 1
1987 1 84 VAL H 1 85 ALA H . . 4.260 2.695 2.342 3.052 . 0 0 "[ . 1 . 2]" 1
1988 1 84 VAL HA 1 84 VAL HB . . 2.970 2.439 2.350 2.545 . 0 0 "[ . 1 . 2]" 1
1989 1 84 VAL HA 1 84 VAL MG2 . . 2.810 2.339 2.212 2.469 . 0 0 "[ . 1 . 2]" 1
1990 1 84 VAL HA 1 86 GLY H . . 4.990 4.774 4.211 4.980 . 0 0 "[ . 1 . 2]" 1
1991 1 84 VAL HB 1 85 ALA H . . 4.330 4.076 3.867 4.327 . 0 0 "[ . 1 . 2]" 1
1992 1 84 VAL MG1 1 85 ALA H . . 3.350 2.219 1.861 2.607 . 0 0 "[ . 1 . 2]" 1
1993 1 84 VAL MG1 1 85 ALA HA . . 4.550 3.437 3.222 3.933 . 0 0 "[ . 1 . 2]" 1
1994 1 84 VAL MG1 1 85 ALA MB . . 3.420 2.921 2.739 3.145 . 0 0 "[ . 1 . 2]" 1
1995 1 84 VAL MG1 1 86 GLY H . . 4.580 4.384 4.164 4.566 . 0 0 "[ . 1 . 2]" 1
1996 1 84 VAL MG2 1 85 ALA HA . . 4.420 3.707 3.471 4.125 . 0 0 "[ . 1 . 2]" 1
1997 1 85 ALA H 1 85 ALA MB . . 3.060 2.219 2.062 2.330 . 0 0 "[ . 1 . 2]" 1
1998 1 85 ALA H 1 86 GLY H . . 3.230 2.508 2.104 2.832 . 0 0 "[ . 1 . 2]" 1
1999 1 85 ALA MB 1 86 GLY H . . 3.670 2.452 2.238 2.937 . 0 0 "[ . 1 . 2]" 1
2000 1 86 GLY QA 1 87 ASN H . . 3.010 2.268 2.212 2.284 . 0 0 "[ . 1 . 2]" 1
2001 1 86 GLY HA2 1 87 ASN H . . 3.440 2.612 2.366 2.866 . 0 0 "[ . 1 . 2]" 1
2002 1 86 GLY HA3 1 87 ASN H . . 3.440 2.523 2.302 2.781 . 0 0 "[ . 1 . 2]" 1
2003 1 87 ASN H 1 87 ASN HB2 . . 4.190 3.337 2.677 3.901 . 0 0 "[ . 1 . 2]" 1
2004 1 87 ASN H 1 87 ASN QB . . 3.520 2.864 2.529 3.196 . 0 0 "[ . 1 . 2]" 1
2005 1 87 ASN H 1 87 ASN HB3 . . 4.190 3.391 2.683 3.912 . 0 0 "[ . 1 . 2]" 1
2006 1 87 ASN HA 1 88 SER H . . 2.990 2.279 2.141 2.397 . 0 0 "[ . 1 . 2]" 1
2007 1 87 ASN QB 1 88 SER H . . 3.530 2.863 2.412 3.529 . 0 0 "[ . 1 . 2]" 1
2008 1 87 ASN HB2 1 88 SER H . . 4.140 3.356 2.445 4.140 . 0 0 "[ . 1 . 2]" 1
2009 1 87 ASN HB3 1 88 SER H . . 4.140 3.510 2.491 4.066 . 0 0 "[ . 1 . 2]" 1
2010 1 88 SER H 1 88 SER HB2 . . 4.160 3.425 2.769 4.023 . 0 0 "[ . 1 . 2]" 1
2011 1 88 SER H 1 88 SER HB3 . . 4.160 3.552 2.976 3.979 . 0 0 "[ . 1 . 2]" 1
2012 1 88 SER HA 1 89 ASN H . . 3.320 2.415 2.267 2.566 . 0 0 "[ . 1 . 2]" 1
2013 1 88 SER HB2 1 89 ASN H . . 4.280 3.168 2.259 4.073 . 0 0 "[ . 1 . 2]" 1
2014 1 88 SER HB3 1 89 ASN H . . 4.280 3.179 2.094 3.958 . 0 0 "[ . 1 . 2]" 1
2015 1 89 ASN HA 1 90 ALA H . . 2.950 2.336 2.196 2.435 . 0 0 "[ . 1 . 2]" 1
2016 1 89 ASN HA 1 90 ALA MB . . 4.350 3.823 3.728 3.920 . 0 0 "[ . 1 . 2]" 1
2017 1 89 ASN QB 1 90 ALA H . . 3.330 2.579 2.339 2.998 . 0 0 "[ . 1 . 2]" 1
2018 1 89 ASN HB2 1 90 ALA H . . 3.990 2.758 2.365 3.780 . 0 0 "[ . 1 . 2]" 1
2019 1 89 ASN HB3 1 90 ALA H . . 3.990 3.647 2.535 3.929 . 0 0 "[ . 1 . 2]" 1
2020 1 90 ALA H 1 90 ALA MB . . 3.320 2.572 2.367 2.709 . 0 0 "[ . 1 . 2]" 1
2021 1 90 ALA H 1 91 SER HA . . 5.490 4.810 4.686 4.928 . 0 0 "[ . 1 . 2]" 1
2022 1 90 ALA HA 1 91 SER H . . 2.700 2.460 2.341 2.542 . 0 0 "[ . 1 . 2]" 1
2023 1 90 ALA MB 1 91 SER H . . 3.220 2.363 2.118 2.616 . 0 0 "[ . 1 . 2]" 1
2024 1 90 ALA MB 1 91 SER HA . . 4.850 3.912 3.825 4.036 . 0 0 "[ . 1 . 2]" 1
2025 1 90 ALA MB 1 91 SER HG . . 5.500 4.561 4.198 4.990 . 0 0 "[ . 1 . 2]" 1
2026 1 91 SER H 1 91 SER HB2 . . 4.020 2.952 2.570 3.769 . 0 0 "[ . 1 . 2]" 1
2027 1 91 SER H 1 91 SER QB . . 3.170 2.794 2.526 3.175 0.005 17 0 "[ . 1 . 2]" 1
2028 1 91 SER H 1 91 SER HB3 . . 4.020 3.762 3.415 3.914 . 0 0 "[ . 1 . 2]" 1
2029 1 91 SER H 1 91 SER HG . . 4.120 3.165 2.543 3.879 . 0 0 "[ . 1 . 2]" 1
2030 1 91 SER H 1 92 ALA H . . 4.500 4.435 4.404 4.472 . 0 0 "[ . 1 . 2]" 1
2031 1 91 SER HA 1 92 ALA H . . 2.930 2.389 2.301 2.518 . 0 0 "[ . 1 . 2]" 1
2032 1 91 SER HA 1 92 ALA MB . . 4.410 3.778 3.685 3.828 . 0 0 "[ . 1 . 2]" 1
2033 1 91 SER QB 1 92 ALA H . . 3.230 2.442 2.163 2.659 . 0 0 "[ . 1 . 2]" 1
2034 1 91 SER QB 1 92 ALA MB . . 5.340 4.235 4.139 4.366 . 0 0 "[ . 1 . 2]" 1
2035 1 91 SER HB2 1 92 ALA H . . 3.780 3.419 2.469 3.773 . 0 0 "[ . 1 . 2]" 1
2036 1 91 SER HB3 1 92 ALA H . . 3.780 2.695 2.185 3.706 . 0 0 "[ . 1 . 2]" 1
2037 1 92 ALA H 1 92 ALA MB . . 3.340 2.847 2.788 2.892 . 0 0 "[ . 1 . 2]" 1
2038 1 92 ALA HA 1 93 TYR H . . 2.820 2.227 2.150 2.401 . 0 0 "[ . 1 . 2]" 1
2039 1 92 ALA HA 1 93 TYR QB . . 5.040 4.028 3.953 4.068 . 0 0 "[ . 1 . 2]" 1
2040 1 92 ALA MB 1 93 TYR H . . 3.300 2.885 2.447 3.131 . 0 0 "[ . 1 . 2]" 1
2041 1 92 ALA MB 1 93 TYR HA . . 4.560 4.204 4.034 4.315 . 0 0 "[ . 1 . 2]" 1
2042 1 93 TYR H 1 93 TYR HB2 . . 3.400 2.751 2.623 2.967 . 0 0 "[ . 1 . 2]" 1
2043 1 93 TYR H 1 93 TYR QB . . 2.970 2.374 2.328 2.522 . 0 0 "[ . 1 . 2]" 1
2044 1 93 TYR H 1 93 TYR HB3 . . 3.400 2.597 2.520 2.729 . 0 0 "[ . 1 . 2]" 1
2045 1 93 TYR H 1 93 TYR QD . . 4.450 4.262 4.213 4.333 . 0 0 "[ . 1 . 2]" 1
2046 1 93 TYR H 1 94 LEU H . . 4.590 4.529 4.417 4.585 . 0 0 "[ . 1 . 2]" 1
2047 1 93 TYR HA 1 93 TYR QD . . 3.720 2.990 2.685 3.172 . 0 0 "[ . 1 . 2]" 1
2048 1 93 TYR HA 1 94 LEU H . . 2.890 2.234 2.150 2.393 . 0 0 "[ . 1 . 2]" 1
2049 1 93 TYR HA 1 94 LEU HB3 . . 4.480 4.363 4.251 4.470 . 0 0 "[ . 1 . 2]" 1
2050 1 93 TYR HB2 1 94 LEU H . . 4.590 4.101 3.840 4.283 . 0 0 "[ . 1 . 2]" 1
2051 1 93 TYR HB3 1 94 LEU H . . 4.590 3.884 3.562 4.139 . 0 0 "[ . 1 . 2]" 1
2052 1 93 TYR QD 1 94 LEU H . . 4.170 3.125 2.867 3.306 . 0 0 "[ . 1 . 2]" 1
2053 1 93 TYR QD 1 94 LEU HB2 . . 5.500 5.293 5.034 5.469 . 0 0 "[ . 1 . 2]" 1
2054 1 93 TYR QD 1 95 ASN H . . 4.590 3.464 3.159 3.740 . 0 0 "[ . 1 . 2]" 1
2055 1 93 TYR QD 1 95 ASN HB2 . . 3.690 3.226 3.048 3.552 . 0 0 "[ . 1 . 2]" 1
2056 1 93 TYR QD 1 95 ASN HB3 . . 4.540 4.343 4.120 4.540 . 0 0 "[ . 1 . 2]" 1
2057 1 93 TYR QE 1 95 ASN HA . . 3.980 2.689 2.452 3.074 . 0 0 "[ . 1 . 2]" 1
2058 1 93 TYR QE 1 95 ASN HB2 . . 3.640 2.457 2.106 2.739 . 0 0 "[ . 1 . 2]" 1
2059 1 93 TYR QE 1 95 ASN HB3 . . 4.410 4.075 3.721 4.276 . 0 0 "[ . 1 . 2]" 1
2060 1 93 TYR QE 1 95 ASN HD21 . . 5.130 4.764 4.178 5.133 0.003 11 0 "[ . 1 . 2]" 1
2061 1 93 TYR QE 1 96 VAL H . . 5.290 4.594 4.374 4.952 . 0 0 "[ . 1 . 2]" 1
2062 1 94 LEU H 1 94 LEU HB2 . . 3.680 3.212 2.964 3.429 . 0 0 "[ . 1 . 2]" 1
2063 1 94 LEU H 1 94 LEU HB3 . . 3.540 2.545 2.397 2.718 . 0 0 "[ . 1 . 2]" 1
2064 1 94 LEU H 1 94 LEU MD1 . . 4.610 4.492 4.371 4.596 . 0 0 "[ . 1 . 2]" 1
2065 1 94 LEU H 1 94 LEU MD2 . . 4.550 4.283 4.105 4.440 . 0 0 "[ . 1 . 2]" 1
2066 1 94 LEU HA 1 94 LEU MD1 . . 2.990 2.424 2.258 2.564 . 0 0 "[ . 1 . 2]" 1
2067 1 94 LEU HA 1 94 LEU MD2 . . 4.490 3.985 3.967 4.006 . 0 0 "[ . 1 . 2]" 1
2068 1 94 LEU HA 1 94 LEU HG . . 4.100 3.055 3.003 3.095 . 0 0 "[ . 1 . 2]" 1
2069 1 94 LEU HA 1 95 ASN H . . 2.850 2.150 2.139 2.179 . 0 0 "[ . 1 . 2]" 1
2070 1 94 LEU HA 1 95 ASN HB2 . . 4.960 4.668 4.492 4.894 . 0 0 "[ . 1 . 2]" 1
2071 1 94 LEU HA 1 95 ASN HB3 . . 4.770 4.546 4.246 4.769 . 0 0 "[ . 1 . 2]" 1
2072 1 94 LEU HB2 1 94 LEU MD1 . . 2.800 2.196 2.085 2.290 . 0 0 "[ . 1 . 2]" 1
2073 1 94 LEU HB2 1 94 LEU MD2 . . 3.130 2.608 2.508 2.678 . 0 0 "[ . 1 . 2]" 1
2074 1 94 LEU HB2 1 95 ASN H . . 4.490 4.233 4.036 4.367 . 0 0 "[ . 1 . 2]" 1
2075 1 94 LEU HB3 1 94 LEU MD1 . . 3.590 3.149 3.125 3.170 . 0 0 "[ . 1 . 2]" 1
2076 1 94 LEU HB3 1 94 LEU MD2 . . 3.340 2.134 2.019 2.223 . 0 0 "[ . 1 . 2]" 1
2077 1 94 LEU HB3 1 95 ASN H . . 4.690 4.370 4.183 4.476 . 0 0 "[ . 1 . 2]" 1
2078 1 94 LEU HB3 1 96 VAL MG2 . . 4.610 4.126 4.006 4.297 . 0 0 "[ . 1 . 2]" 1
2079 1 94 LEU MD1 1 95 ASN H . . 3.360 3.108 2.679 3.364 0.004 9 0 "[ . 1 . 2]" 1
2080 1 94 LEU MD1 1 96 VAL MG2 . . 3.350 3.145 2.918 3.297 . 0 0 "[ . 1 . 2]" 1
2081 1 94 LEU MD2 1 95 ASN H . . 5.110 4.680 4.280 4.883 . 0 0 "[ . 1 . 2]" 1
2082 1 94 LEU MD2 1 96 VAL MG1 . . 4.470 4.284 4.095 4.451 . 0 0 "[ . 1 . 2]" 1
2083 1 94 LEU MD2 1 96 VAL MG2 . . 3.110 2.464 2.189 2.635 . 0 0 "[ . 1 . 2]" 1
2084 1 94 LEU HG 1 95 ASN H . . 4.080 3.219 2.682 3.492 . 0 0 "[ . 1 . 2]" 1
2085 1 94 LEU HG 1 96 VAL H . . 4.730 4.390 4.098 4.593 . 0 0 "[ . 1 . 2]" 1
2086 1 94 LEU HG 1 96 VAL MG2 . . 3.120 2.384 2.249 2.652 . 0 0 "[ . 1 . 2]" 1
2087 1 95 ASN H 1 95 ASN HB2 . . 3.620 2.908 2.653 3.317 . 0 0 "[ . 1 . 2]" 1
2088 1 95 ASN H 1 95 ASN HB3 . . 3.440 2.466 2.346 2.636 . 0 0 "[ . 1 . 2]" 1
2089 1 95 ASN H 1 96 VAL H . . 4.550 4.460 4.377 4.514 . 0 0 "[ . 1 . 2]" 1
2090 1 95 ASN H 1 96 VAL MG2 . . 4.570 4.192 4.012 4.308 . 0 0 "[ . 1 . 2]" 1
2091 1 95 ASN HA 1 96 VAL H . . 2.760 2.156 2.142 2.211 . 0 0 "[ . 1 . 2]" 1
2092 1 95 ASN HA 1 96 VAL HB . . 5.450 4.666 4.582 4.751 . 0 0 "[ . 1 . 2]" 1
2093 1 95 ASN HA 1 96 VAL MG2 . . 3.960 3.489 3.354 3.617 . 0 0 "[ . 1 . 2]" 1
2094 1 95 ASN HB2 1 96 VAL H . . 4.410 4.175 3.982 4.347 . 0 0 "[ . 1 . 2]" 1
2095 1 95 ASN HB3 1 96 VAL H . . 4.680 4.229 4.067 4.420 . 0 0 "[ . 1 . 2]" 1
2096 1 95 ASN HD21 1 96 VAL H . . 5.500 4.863 1.834 5.402 . 0 0 "[ . 1 . 2]" 1
2097 1 96 VAL H 1 96 VAL HB . . 3.220 2.711 2.629 2.819 . 0 0 "[ . 1 . 2]" 1
2098 1 96 VAL H 1 96 VAL MG1 . . 4.230 3.883 3.844 3.925 . 0 0 "[ . 1 . 2]" 1
2099 1 96 VAL H 1 96 VAL MG2 . . 3.100 2.640 2.530 2.891 . 0 0 "[ . 1 . 2]" 1
2100 1 96 VAL H 1 97 SER H . . 4.520 4.220 4.047 4.385 . 0 0 "[ . 1 . 2]" 1
2101 1 96 VAL HA 1 96 VAL MG1 . . 3.060 2.301 2.205 2.455 . 0 0 "[ . 1 . 2]" 1
2102 1 96 VAL HA 1 96 VAL MG2 . . 3.230 2.451 2.347 2.521 . 0 0 "[ . 1 . 2]" 1
2103 1 96 VAL HA 1 97 SER H . . 2.690 2.146 2.140 2.160 . 0 0 "[ . 1 . 2]" 1
2104 1 96 VAL HB 1 97 SER H . . 4.330 4.258 4.089 4.332 0.002 13 0 "[ . 1 . 2]" 1
2105 1 96 VAL MG1 1 97 SER H . . 3.140 2.716 2.306 3.025 . 0 0 "[ . 1 . 2]" 1
2106 1 96 VAL MG1 1 98 SER HA . . 4.610 4.252 3.985 4.511 . 0 0 "[ . 1 . 2]" 1
2107 1 96 VAL MG2 1 97 SER H . . 4.840 4.167 4.001 4.240 . 0 0 "[ . 1 . 2]" 1
2108 1 97 SER H 1 97 SER HB2 . . 3.770 2.738 2.331 3.102 . 0 0 "[ . 1 . 2]" 1
2109 1 97 SER H 1 97 SER QB . . 3.260 2.439 2.303 2.589 . 0 0 "[ . 1 . 2]" 1
2110 1 97 SER H 1 97 SER HB3 . . 3.770 2.978 2.471 3.748 . 0 0 "[ . 1 . 2]" 1
2111 1 97 SER QB 1 98 SER H . . 3.860 3.410 2.778 3.740 . 0 0 "[ . 1 . 2]" 1
2112 1 97 SER HB2 1 98 SER H . . 4.510 4.163 3.955 4.398 . 0 0 "[ . 1 . 2]" 1
2113 1 97 SER HB3 1 98 SER H . . 4.510 3.674 2.832 4.230 . 0 0 "[ . 1 . 2]" 1
2114 1 98 SER H 1 98 SER QB . . 3.380 2.360 2.189 2.673 . 0 0 "[ . 1 . 2]" 1
2115 1 98 SER HA 1 99 GLY H . . 3.080 2.304 2.142 2.946 . 0 0 "[ . 1 . 2]" 1
2116 1 98 SER QB 1 99 GLY H . . 3.820 3.181 2.093 3.779 . 0 0 "[ . 1 . 2]" 1
2117 1 99 GLY H 1 100 PRO QD . . 4.530 4.307 4.059 4.378 . 0 0 "[ . 1 . 2]" 1
2118 1 99 GLY HA2 1 100 PRO QD . . 2.790 2.176 2.081 2.367 . 0 0 "[ . 1 . 2]" 1
2119 1 99 GLY HA2 1 100 PRO QG . . 4.340 4.092 3.991 4.287 . 0 0 "[ . 1 . 2]" 1
2120 1 99 GLY HA3 1 100 PRO QD . . 2.790 2.431 2.188 2.573 . 0 0 "[ . 1 . 2]" 1
2121 1 99 GLY HA3 1 100 PRO QG . . 4.340 4.223 4.031 4.339 . 0 0 "[ . 1 . 2]" 1
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