NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
416024 |
2dia   |
10335 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2dia
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 2158
_Distance_constraint_stats_list.Viol_count 530
_Distance_constraint_stats_list.Viol_total 81.180
_Distance_constraint_stats_list.Viol_max 0.114
_Distance_constraint_stats_list.Viol_rms 0.0017
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0077
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 8 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 PHE 0.063 0.008 6 0 "[ . 1 . 2]"
1 10 ASP 0.112 0.020 9 0 "[ . 1 . 2]"
1 11 PRO 0.125 0.017 1 0 "[ . 1 . 2]"
1 12 SER 0.015 0.004 9 0 "[ . 1 . 2]"
1 13 LYS 0.059 0.023 9 0 "[ . 1 . 2]"
1 14 VAL 0.029 0.005 15 0 "[ . 1 . 2]"
1 15 VAL 0.018 0.007 14 0 "[ . 1 . 2]"
1 16 ALA 0.011 0.007 14 0 "[ . 1 . 2]"
1 17 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 GLY 0.002 0.002 9 0 "[ . 1 . 2]"
1 19 PRO 0.002 0.002 9 0 "[ . 1 . 2]"
1 20 GLY 0.000 0.000 20 0 "[ . 1 . 2]"
1 21 LEU 0.024 0.009 9 0 "[ . 1 . 2]"
1 22 GLU 0.003 0.002 11 0 "[ . 1 . 2]"
1 23 HIS 0.047 0.013 12 0 "[ . 1 . 2]"
1 24 GLY 0.012 0.005 11 0 "[ . 1 . 2]"
1 25 LYS 0.105 0.024 9 0 "[ . 1 . 2]"
1 26 VAL 0.029 0.005 7 0 "[ . 1 . 2]"
1 27 GLY 0.013 0.007 2 0 "[ . 1 . 2]"
1 28 GLU 0.015 0.005 11 0 "[ . 1 . 2]"
1 29 ALA 0.053 0.038 5 0 "[ . 1 . 2]"
1 30 GLY 0.010 0.003 10 0 "[ . 1 . 2]"
1 31 LEU 0.002 0.002 11 0 "[ . 1 . 2]"
1 32 LEU 0.042 0.005 5 0 "[ . 1 . 2]"
1 33 SER 0.012 0.003 18 0 "[ . 1 . 2]"
1 34 VAL 0.010 0.002 13 0 "[ . 1 . 2]"
1 35 ASP 0.009 0.003 20 0 "[ . 1 . 2]"
1 36 CYS 0.002 0.001 12 0 "[ . 1 . 2]"
1 37 SER 0.077 0.036 14 0 "[ . 1 . 2]"
1 38 GLU 0.019 0.008 14 0 "[ . 1 . 2]"
1 39 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 GLY 0.013 0.008 14 0 "[ . 1 . 2]"
1 41 PRO 0.006 0.002 5 0 "[ . 1 . 2]"
1 42 GLY 0.010 0.003 10 0 "[ . 1 . 2]"
1 43 ALA 0.001 0.001 4 0 "[ . 1 . 2]"
1 44 LEU 0.011 0.005 11 0 "[ . 1 . 2]"
1 45 GLY 0.033 0.007 9 0 "[ . 1 . 2]"
1 46 LEU 0.150 0.028 15 0 "[ . 1 . 2]"
1 47 GLU 0.062 0.021 2 0 "[ . 1 . 2]"
1 48 ALA 0.013 0.011 11 0 "[ . 1 . 2]"
1 49 VAL 0.271 0.047 16 0 "[ . 1 . 2]"
1 50 SER 0.005 0.003 2 0 "[ . 1 . 2]"
1 51 ASP 0.015 0.006 2 0 "[ . 1 . 2]"
1 52 SER 0.005 0.005 4 0 "[ . 1 . 2]"
1 53 GLY 0.007 0.005 4 0 "[ . 1 . 2]"
1 54 THR 0.024 0.013 16 0 "[ . 1 . 2]"
1 55 LYS 0.223 0.077 4 0 "[ . 1 . 2]"
1 56 ALA 0.062 0.021 16 0 "[ . 1 . 2]"
1 57 GLU 0.053 0.019 14 0 "[ . 1 . 2]"
1 58 VAL 0.050 0.019 14 0 "[ . 1 . 2]"
1 59 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 ILE 0.006 0.003 2 0 "[ . 1 . 2]"
1 61 GLN 0.006 0.002 7 0 "[ . 1 . 2]"
1 62 ASN 0.018 0.018 3 0 "[ . 1 . 2]"
1 63 ASN 0.019 0.018 3 0 "[ . 1 . 2]"
1 64 LYS 0.019 0.009 8 0 "[ . 1 . 2]"
1 65 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 THR 0.003 0.003 20 0 "[ . 1 . 2]"
1 68 TYR 0.068 0.048 3 0 "[ . 1 . 2]"
1 69 ALA 0.087 0.048 3 0 "[ . 1 . 2]"
1 70 VAL 0.045 0.012 11 0 "[ . 1 . 2]"
1 71 THR 0.048 0.038 5 0 "[ . 1 . 2]"
1 72 TYR 0.029 0.003 11 0 "[ . 1 . 2]"
1 73 VAL 0.024 0.007 2 0 "[ . 1 . 2]"
1 74 PRO 0.038 0.007 9 0 "[ . 1 . 2]"
1 75 LEU 0.006 0.002 11 0 "[ . 1 . 2]"
1 76 THR 0.005 0.005 2 0 "[ . 1 . 2]"
1 77 ALA 0.017 0.008 11 0 "[ . 1 . 2]"
1 78 GLY 0.004 0.003 11 0 "[ . 1 . 2]"
1 79 MET 0.012 0.004 7 0 "[ . 1 . 2]"
1 80 TYR 0.025 0.011 15 0 "[ . 1 . 2]"
1 81 THR 0.035 0.006 9 0 "[ . 1 . 2]"
1 82 LEU 0.100 0.017 15 0 "[ . 1 . 2]"
1 83 THR 0.013 0.008 9 0 "[ . 1 . 2]"
1 84 MET 0.177 0.028 15 0 "[ . 1 . 2]"
1 85 LYS 0.110 0.011 16 0 "[ . 1 . 2]"
1 86 TYR 0.151 0.015 9 0 "[ . 1 . 2]"
1 87 GLY 0.027 0.009 12 0 "[ . 1 . 2]"
1 88 GLY 0.101 0.018 9 0 "[ . 1 . 2]"
1 89 GLU 0.182 0.019 14 0 "[ . 1 . 2]"
1 90 LEU 0.355 0.018 5 0 "[ . 1 . 2]"
1 91 VAL 0.323 0.017 14 0 "[ . 1 . 2]"
1 92 PRO 0.395 0.050 11 0 "[ . 1 . 2]"
1 93 HIS 0.389 0.050 11 0 "[ . 1 . 2]"
1 94 PHE 0.159 0.013 14 0 "[ . 1 . 2]"
1 95 PRO 0.137 0.011 11 0 "[ . 1 . 2]"
1 96 ALA 0.068 0.017 15 0 "[ . 1 . 2]"
1 97 ARG 0.189 0.055 18 0 "[ . 1 . 2]"
1 98 VAL 0.228 0.055 18 0 "[ . 1 . 2]"
1 99 LYS 0.021 0.006 6 0 "[ . 1 . 2]"
1 100 VAL 0.014 0.006 6 0 "[ . 1 . 2]"
1 101 GLU 0.012 0.003 2 0 "[ . 1 . 2]"
1 102 PRO 0.013 0.008 11 0 "[ . 1 . 2]"
1 103 ALA 0.396 0.045 8 0 "[ . 1 . 2]"
1 104 VAL 0.391 0.045 8 0 "[ . 1 . 2]"
1 105 ASP 0.002 0.002 17 0 "[ . 1 . 2]"
1 106 THR 0.574 0.114 20 0 "[ . 1 . 2]"
1 107 SER 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 PRO HA 1 9 PHE H . . 2.850 2.282 2.176 2.412 . 0 0 "[ . 1 . 2]" 1
2 1 8 PRO HA 1 9 PHE HA . . 5.000 4.334 4.312 4.362 . 0 0 "[ . 1 . 2]" 1
3 1 8 PRO HA 1 9 PHE HB2 . . 5.140 4.890 4.824 4.959 . 0 0 "[ . 1 . 2]" 1
4 1 8 PRO HA 1 9 PHE HB3 . . 4.530 4.428 4.308 4.528 . 0 0 "[ . 1 . 2]" 1
5 1 8 PRO HA 1 41 PRO HD2 . . 5.070 4.227 3.520 4.512 . 0 0 "[ . 1 . 2]" 1
6 1 8 PRO HA 1 41 PRO HD3 . . 5.070 4.807 4.114 5.067 . 0 0 "[ . 1 . 2]" 1
7 1 8 PRO QB 1 9 PHE H . . 3.410 2.832 2.513 3.170 . 0 0 "[ . 1 . 2]" 1
8 1 8 PRO HB2 1 9 PHE H . . 3.890 2.955 2.584 3.360 . 0 0 "[ . 1 . 2]" 1
9 1 8 PRO HB3 1 9 PHE H . . 3.890 3.643 3.438 3.886 . 0 0 "[ . 1 . 2]" 1
10 1 8 PRO QD 1 9 PHE H . . 5.460 4.992 4.944 5.007 . 0 0 "[ . 1 . 2]" 1
11 1 9 PHE H 1 9 PHE HB2 . . 3.220 2.983 2.853 3.138 . 0 0 "[ . 1 . 2]" 1
12 1 9 PHE H 1 9 PHE HB3 . . 3.140 2.208 2.181 2.247 . 0 0 "[ . 1 . 2]" 1
13 1 9 PHE H 1 9 PHE QD . . 4.110 3.882 3.743 4.014 . 0 0 "[ . 1 . 2]" 1
14 1 9 PHE H 1 10 ASP H . . 4.620 4.594 4.539 4.628 0.008 10 0 "[ . 1 . 2]" 1
15 1 9 PHE H 1 40 GLY HA3 . . 4.480 4.007 3.755 4.482 0.002 9 0 "[ . 1 . 2]" 1
16 1 9 PHE H 1 41 PRO HD2 . . 4.780 3.334 2.736 3.591 . 0 0 "[ . 1 . 2]" 1
17 1 9 PHE H 1 41 PRO QD . . 4.130 3.264 2.698 3.493 . 0 0 "[ . 1 . 2]" 1
18 1 9 PHE H 1 41 PRO HD3 . . 4.780 4.656 4.119 4.782 0.002 5 0 "[ . 1 . 2]" 1
19 1 9 PHE H 1 41 PRO QG . . 4.930 4.146 3.245 4.394 . 0 0 "[ . 1 . 2]" 1
20 1 9 PHE HA 1 9 PHE QD . . 3.590 3.133 2.983 3.260 . 0 0 "[ . 1 . 2]" 1
21 1 9 PHE HA 1 10 ASP H . . 3.100 2.212 2.170 2.270 . 0 0 "[ . 1 . 2]" 1
22 1 9 PHE HA 1 40 GLY H . . 4.900 4.155 3.751 4.773 . 0 0 "[ . 1 . 2]" 1
23 1 9 PHE HA 1 40 GLY HA2 . . 4.140 3.863 3.696 4.098 . 0 0 "[ . 1 . 2]" 1
24 1 9 PHE HA 1 40 GLY HA3 . . 3.960 2.146 2.028 2.361 . 0 0 "[ . 1 . 2]" 1
25 1 9 PHE HA 1 41 PRO HD2 . . 4.550 2.609 2.327 2.831 . 0 0 "[ . 1 . 2]" 1
26 1 9 PHE HA 1 41 PRO QD . . 3.960 2.584 2.313 2.796 . 0 0 "[ . 1 . 2]" 1
27 1 9 PHE HA 1 41 PRO HD3 . . 4.550 4.196 3.987 4.355 . 0 0 "[ . 1 . 2]" 1
28 1 9 PHE HB2 1 10 ASP H . . 4.460 3.785 3.661 3.918 . 0 0 "[ . 1 . 2]" 1
29 1 9 PHE HB2 1 41 PRO HD2 . . 4.690 2.240 1.999 2.751 . 0 0 "[ . 1 . 2]" 1
30 1 9 PHE HB2 1 41 PRO QD . . 3.970 2.227 1.991 2.720 . 0 0 "[ . 1 . 2]" 1
31 1 9 PHE HB2 1 41 PRO HD3 . . 4.690 3.926 3.708 4.289 . 0 0 "[ . 1 . 2]" 1
32 1 9 PHE HB2 1 41 PRO HG2 . . 4.870 2.410 2.153 2.659 . 0 0 "[ . 1 . 2]" 1
33 1 9 PHE HB2 1 41 PRO HG3 . . 4.870 3.812 3.527 4.090 . 0 0 "[ . 1 . 2]" 1
34 1 9 PHE HB3 1 10 ASP H . . 4.740 4.224 4.111 4.331 . 0 0 "[ . 1 . 2]" 1
35 1 9 PHE HB3 1 41 PRO HD2 . . 5.340 3.516 3.342 3.752 . 0 0 "[ . 1 . 2]" 1
36 1 9 PHE HB3 1 41 PRO HD3 . . 5.340 5.151 4.975 5.342 0.002 14 0 "[ . 1 . 2]" 1
37 1 9 PHE HB3 1 41 PRO QG . . 5.050 3.533 3.276 3.707 . 0 0 "[ . 1 . 2]" 1
38 1 9 PHE QD 1 10 ASP H . . 3.890 3.216 2.944 3.455 . 0 0 "[ . 1 . 2]" 1
39 1 9 PHE QD 1 10 ASP HA . . 4.350 3.567 3.292 3.820 . 0 0 "[ . 1 . 2]" 1
40 1 9 PHE QD 1 11 PRO HD2 . . 4.650 4.508 4.357 4.630 . 0 0 "[ . 1 . 2]" 1
41 1 9 PHE QD 1 11 PRO HD3 . . 3.980 3.653 3.497 3.770 . 0 0 "[ . 1 . 2]" 1
42 1 9 PHE QD 1 86 TYR QD . . 4.260 3.404 2.987 3.657 . 0 0 "[ . 1 . 2]" 1
43 1 9 PHE QD 1 86 TYR QE . . 4.030 3.109 2.784 3.449 . 0 0 "[ . 1 . 2]" 1
44 1 9 PHE QD 1 87 GLY HA2 . . 5.450 5.041 4.874 5.360 . 0 0 "[ . 1 . 2]" 1
45 1 9 PHE QD 1 87 GLY HA3 . . 4.400 3.750 3.522 4.029 . 0 0 "[ . 1 . 2]" 1
46 1 9 PHE QE 1 11 PRO HA . . 4.820 4.258 3.987 4.637 . 0 0 "[ . 1 . 2]" 1
47 1 9 PHE QE 1 11 PRO HB3 . . 5.000 3.824 3.521 4.065 . 0 0 "[ . 1 . 2]" 1
48 1 9 PHE QE 1 11 PRO HD2 . . 4.890 3.682 3.481 3.890 . 0 0 "[ . 1 . 2]" 1
49 1 9 PHE QE 1 11 PRO HD3 . . 4.500 2.501 2.354 2.690 . 0 0 "[ . 1 . 2]" 1
50 1 9 PHE QE 1 11 PRO HG2 . . 4.850 4.769 4.526 4.854 0.004 1 0 "[ . 1 . 2]" 1
51 1 9 PHE QE 1 11 PRO HG3 . . 4.430 3.601 3.322 3.746 . 0 0 "[ . 1 . 2]" 1
52 1 9 PHE QE 1 42 GLY QA . . 4.870 3.234 3.010 3.594 . 0 0 "[ . 1 . 2]" 1
53 1 9 PHE QE 1 86 TYR QD . . 3.850 2.042 1.997 2.297 . 0 0 "[ . 1 . 2]" 1
54 1 9 PHE QE 1 86 TYR QE . . 4.270 3.492 3.194 3.690 . 0 0 "[ . 1 . 2]" 1
55 1 9 PHE QE 1 87 GLY HA2 . . 4.430 3.728 3.591 4.002 . 0 0 "[ . 1 . 2]" 1
56 1 9 PHE QE 1 87 GLY HA3 . . 4.050 2.113 1.998 2.524 . 0 0 "[ . 1 . 2]" 1
57 1 9 PHE QE 1 89 GLU H . . 4.300 4.252 4.176 4.302 0.002 11 0 "[ . 1 . 2]" 1
58 1 9 PHE QE 1 89 GLU HB2 . . 4.590 3.495 3.283 3.675 . 0 0 "[ . 1 . 2]" 1
59 1 9 PHE QE 1 89 GLU HB3 . . 4.660 4.247 4.024 4.560 . 0 0 "[ . 1 . 2]" 1
60 1 9 PHE QE 1 89 GLU HG2 . . 4.240 3.869 3.559 4.224 . 0 0 "[ . 1 . 2]" 1
61 1 9 PHE QE 1 89 GLU HG3 . . 3.930 2.533 2.027 2.937 . 0 0 "[ . 1 . 2]" 1
62 1 9 PHE HZ 1 11 PRO HB2 . . 5.040 4.793 4.534 5.020 . 0 0 "[ . 1 . 2]" 1
63 1 9 PHE HZ 1 11 PRO HB3 . . 4.670 3.179 2.994 3.432 . 0 0 "[ . 1 . 2]" 1
64 1 9 PHE HZ 1 11 PRO HG2 . . 4.910 4.790 4.423 4.918 0.008 6 0 "[ . 1 . 2]" 1
65 1 9 PHE HZ 1 11 PRO HG3 . . 4.500 3.256 2.776 3.421 . 0 0 "[ . 1 . 2]" 1
66 1 9 PHE HZ 1 87 GLY HA2 . . 5.050 4.793 4.480 5.053 0.003 9 0 "[ . 1 . 2]" 1
67 1 9 PHE HZ 1 87 GLY HA3 . . 4.330 3.164 2.870 3.459 . 0 0 "[ . 1 . 2]" 1
68 1 9 PHE HZ 1 89 GLU HB2 . . 4.440 2.272 2.061 2.457 . 0 0 "[ . 1 . 2]" 1
69 1 9 PHE HZ 1 89 GLU HB3 . . 4.360 3.767 3.600 3.908 . 0 0 "[ . 1 . 2]" 1
70 1 9 PHE HZ 1 89 GLU HG2 . . 4.230 3.590 2.855 3.849 . 0 0 "[ . 1 . 2]" 1
71 1 9 PHE HZ 1 89 GLU HG3 . . 4.220 2.085 2.002 2.598 . 0 0 "[ . 1 . 2]" 1
72 1 10 ASP H 1 10 ASP HB2 . . 4.140 3.026 2.839 3.296 . 0 0 "[ . 1 . 2]" 1
73 1 10 ASP H 1 10 ASP HB3 . . 4.140 3.678 3.091 3.904 . 0 0 "[ . 1 . 2]" 1
74 1 10 ASP H 1 11 PRO HD2 . . 4.840 4.492 4.396 4.536 . 0 0 "[ . 1 . 2]" 1
75 1 10 ASP H 1 11 PRO HD3 . . 4.630 3.977 3.810 4.056 . 0 0 "[ . 1 . 2]" 1
76 1 10 ASP H 1 39 ALA HA . . 4.030 2.791 2.404 3.267 . 0 0 "[ . 1 . 2]" 1
77 1 10 ASP H 1 39 ALA MB . . 4.220 3.528 3.212 3.820 . 0 0 "[ . 1 . 2]" 1
78 1 10 ASP H 1 40 GLY HA2 . . 5.500 5.240 4.995 5.402 . 0 0 "[ . 1 . 2]" 1
79 1 10 ASP H 1 40 GLY HA3 . . 4.300 3.785 3.465 4.016 . 0 0 "[ . 1 . 2]" 1
80 1 10 ASP H 1 86 TYR QD . . 5.410 4.490 3.892 4.955 . 0 0 "[ . 1 . 2]" 1
81 1 10 ASP H 1 86 TYR QE . . 5.500 4.398 3.762 4.908 . 0 0 "[ . 1 . 2]" 1
82 1 10 ASP HA 1 11 PRO HD2 . . 3.170 1.955 1.917 1.980 . 0 0 "[ . 1 . 2]" 1
83 1 10 ASP HA 1 11 PRO HD3 . . 3.350 2.353 2.320 2.439 . 0 0 "[ . 1 . 2]" 1
84 1 10 ASP HA 1 11 PRO HG2 . . 4.160 4.157 4.124 4.177 0.017 1 0 "[ . 1 . 2]" 1
85 1 10 ASP HA 1 11 PRO HG3 . . 4.460 4.323 4.316 4.353 . 0 0 "[ . 1 . 2]" 1
86 1 10 ASP HA 1 12 SER H . . 4.050 3.635 3.476 3.799 . 0 0 "[ . 1 . 2]" 1
87 1 10 ASP QB 1 11 PRO HD2 . . 4.330 3.481 3.255 3.895 . 0 0 "[ . 1 . 2]" 1
88 1 10 ASP QB 1 13 LYS H . . 4.030 2.736 2.576 3.134 . 0 0 "[ . 1 . 2]" 1
89 1 10 ASP QB 1 13 LYS QD . . 4.260 3.683 3.083 4.099 . 0 0 "[ . 1 . 2]" 1
90 1 10 ASP QB 1 13 LYS HG2 . . 4.100 2.108 1.924 2.373 . 0 0 "[ . 1 . 2]" 1
91 1 10 ASP QB 1 13 LYS HG3 . . 3.970 2.407 2.046 2.833 . 0 0 "[ . 1 . 2]" 1
92 1 10 ASP QB 1 39 ALA HA . . 3.770 2.987 2.461 3.357 . 0 0 "[ . 1 . 2]" 1
93 1 10 ASP HB2 1 11 PRO HD2 . . 5.040 4.451 4.239 4.573 . 0 0 "[ . 1 . 2]" 1
94 1 10 ASP HB2 1 11 PRO HD3 . . 5.250 5.087 4.947 5.148 . 0 0 "[ . 1 . 2]" 1
95 1 10 ASP HB2 1 12 SER H . . 5.040 4.698 4.336 5.034 . 0 0 "[ . 1 . 2]" 1
96 1 10 ASP HB2 1 13 LYS H . . 4.710 4.017 3.661 4.711 0.001 9 0 "[ . 1 . 2]" 1
97 1 10 ASP HB2 1 13 LYS QD . . 4.930 4.354 3.487 4.950 0.020 9 0 "[ . 1 . 2]" 1
98 1 10 ASP HB2 1 13 LYS HG2 . . 4.720 2.973 2.248 3.641 . 0 0 "[ . 1 . 2]" 1
99 1 10 ASP HB2 1 13 LYS HG3 . . 4.560 2.841 2.131 4.115 . 0 0 "[ . 1 . 2]" 1
100 1 10 ASP HB2 1 39 ALA HA . . 4.380 3.422 2.749 4.349 . 0 0 "[ . 1 . 2]" 1
101 1 10 ASP HB3 1 11 PRO HD2 . . 5.040 3.686 3.343 4.476 . 0 0 "[ . 1 . 2]" 1
102 1 10 ASP HB3 1 11 PRO HD3 . . 5.250 4.681 4.483 5.076 . 0 0 "[ . 1 . 2]" 1
103 1 10 ASP HB3 1 12 SER H . . 5.040 3.314 2.885 4.144 . 0 0 "[ . 1 . 2]" 1
104 1 10 ASP HB3 1 13 LYS H . . 4.710 2.788 2.627 3.187 . 0 0 "[ . 1 . 2]" 1
105 1 10 ASP HB3 1 13 LYS QD . . 4.930 4.035 3.320 4.650 . 0 0 "[ . 1 . 2]" 1
106 1 10 ASP HB3 1 13 LYS HG2 . . 4.720 2.183 1.986 2.521 . 0 0 "[ . 1 . 2]" 1
107 1 10 ASP HB3 1 13 LYS HG3 . . 4.560 2.923 2.072 3.481 . 0 0 "[ . 1 . 2]" 1
108 1 10 ASP HB3 1 39 ALA HA . . 4.380 3.695 2.486 4.246 . 0 0 "[ . 1 . 2]" 1
109 1 11 PRO HA 1 13 LYS H . . 4.170 4.033 3.829 4.153 . 0 0 "[ . 1 . 2]" 1
110 1 11 PRO HA 1 14 VAL H . . 4.160 3.526 3.387 3.797 . 0 0 "[ . 1 . 2]" 1
111 1 11 PRO HA 1 14 VAL MG2 . . 3.180 2.303 2.018 2.464 . 0 0 "[ . 1 . 2]" 1
112 1 11 PRO HA 1 39 ALA MB . . 3.820 3.509 3.284 3.758 . 0 0 "[ . 1 . 2]" 1
113 1 11 PRO HA 1 86 TYR HB2 . . 4.430 4.020 3.624 4.265 . 0 0 "[ . 1 . 2]" 1
114 1 11 PRO HA 1 86 TYR HB3 . . 4.620 2.814 2.602 3.029 . 0 0 "[ . 1 . 2]" 1
115 1 11 PRO HA 1 86 TYR QD . . 3.760 3.263 2.975 3.391 . 0 0 "[ . 1 . 2]" 1
116 1 11 PRO HA 1 86 TYR QE . . 4.990 4.868 4.558 4.992 0.002 7 0 "[ . 1 . 2]" 1
117 1 11 PRO HA 1 91 VAL MG1 . . 4.270 3.268 2.926 3.460 . 0 0 "[ . 1 . 2]" 1
118 1 11 PRO HB2 1 12 SER H . . 3.990 3.461 3.284 3.665 . 0 0 "[ . 1 . 2]" 1
119 1 11 PRO HB2 1 86 TYR H . . 4.740 4.348 4.145 4.469 . 0 0 "[ . 1 . 2]" 1
120 1 11 PRO HB2 1 86 TYR HB2 . . 5.310 4.703 4.384 4.996 . 0 0 "[ . 1 . 2]" 1
121 1 11 PRO HB2 1 86 TYR HB3 . . 5.060 3.693 3.439 3.913 . 0 0 "[ . 1 . 2]" 1
122 1 11 PRO HB2 1 91 VAL H . . 5.500 4.746 4.561 4.875 . 0 0 "[ . 1 . 2]" 1
123 1 11 PRO HB2 1 91 VAL HA . . 3.910 2.679 2.439 2.839 . 0 0 "[ . 1 . 2]" 1
124 1 11 PRO HB2 1 92 PRO HD3 . . 4.450 3.650 3.430 3.799 . 0 0 "[ . 1 . 2]" 1
125 1 11 PRO HB3 1 12 SER H . . 4.430 4.214 4.111 4.333 . 0 0 "[ . 1 . 2]" 1
126 1 11 PRO HB3 1 14 VAL MG2 . . 4.320 4.017 3.689 4.236 . 0 0 "[ . 1 . 2]" 1
127 1 11 PRO HB3 1 86 TYR H . . 4.720 3.677 3.475 3.876 . 0 0 "[ . 1 . 2]" 1
128 1 11 PRO HB3 1 86 TYR HB2 . . 4.360 4.060 3.552 4.360 . 0 0 "[ . 1 . 2]" 1
129 1 11 PRO HB3 1 86 TYR HB3 . . 4.360 2.583 2.246 2.794 . 0 0 "[ . 1 . 2]" 1
130 1 11 PRO HB3 1 86 TYR QD . . 4.640 3.734 3.323 3.987 . 0 0 "[ . 1 . 2]" 1
131 1 11 PRO HB3 1 91 VAL HA . . 4.720 4.182 3.954 4.405 . 0 0 "[ . 1 . 2]" 1
132 1 11 PRO HB3 1 91 VAL MG1 . . 4.050 3.473 3.145 3.710 . 0 0 "[ . 1 . 2]" 1
133 1 11 PRO HD2 1 12 SER H . . 3.910 2.670 2.646 2.742 . 0 0 "[ . 1 . 2]" 1
134 1 11 PRO HD2 1 89 GLU HB2 . . 4.870 4.426 4.323 4.579 . 0 0 "[ . 1 . 2]" 1
135 1 11 PRO HD2 1 89 GLU HB3 . . 5.000 4.704 4.526 4.907 . 0 0 "[ . 1 . 2]" 1
136 1 11 PRO HD3 1 12 SER H . . 4.220 3.852 3.835 3.893 . 0 0 "[ . 1 . 2]" 1
137 1 11 PRO HD3 1 89 GLU HB2 . . 4.720 3.268 3.062 3.518 . 0 0 "[ . 1 . 2]" 1
138 1 11 PRO HD3 1 89 GLU HB3 . . 4.630 4.103 3.833 4.464 . 0 0 "[ . 1 . 2]" 1
139 1 11 PRO HD3 1 89 GLU HG2 . . 5.500 5.108 4.706 5.382 . 0 0 "[ . 1 . 2]" 1
140 1 11 PRO HG2 1 12 SER H . . 3.910 2.539 2.308 2.830 . 0 0 "[ . 1 . 2]" 1
141 1 11 PRO HG2 1 12 SER HA . . 4.310 4.203 4.147 4.271 . 0 0 "[ . 1 . 2]" 1
142 1 11 PRO HG2 1 89 GLU HG3 . . 5.350 5.222 4.610 5.352 0.002 6 0 "[ . 1 . 2]" 1
143 1 11 PRO HG2 1 91 VAL HA . . 4.650 4.434 4.045 4.640 . 0 0 "[ . 1 . 2]" 1
144 1 11 PRO HG3 1 12 SER H . . 4.610 4.007 3.835 4.225 . 0 0 "[ . 1 . 2]" 1
145 1 11 PRO HG3 1 89 GLU HB2 . . 3.640 2.032 1.999 2.192 . 0 0 "[ . 1 . 2]" 1
146 1 11 PRO HG3 1 89 GLU HB3 . . 3.510 2.161 2.001 2.398 . 0 0 "[ . 1 . 2]" 1
147 1 11 PRO HG3 1 89 GLU HG2 . . 4.470 4.196 4.101 4.381 . 0 0 "[ . 1 . 2]" 1
148 1 11 PRO HG3 1 89 GLU HG3 . . 4.100 3.492 2.977 3.613 . 0 0 "[ . 1 . 2]" 1
149 1 12 SER H 1 12 SER HB2 . . 3.660 2.392 2.200 2.576 . 0 0 "[ . 1 . 2]" 1
150 1 12 SER H 1 12 SER QB . . 3.140 2.308 2.178 2.522 . 0 0 "[ . 1 . 2]" 1
151 1 12 SER H 1 12 SER HB3 . . 3.660 3.255 2.556 3.600 . 0 0 "[ . 1 . 2]" 1
152 1 12 SER H 1 13 LYS H . . 3.240 2.586 2.477 2.681 . 0 0 "[ . 1 . 2]" 1
153 1 12 SER H 1 13 LYS HB2 . . 4.970 4.869 4.698 4.973 0.003 9 0 "[ . 1 . 2]" 1
154 1 12 SER H 1 13 LYS HG2 . . 5.060 4.067 3.769 4.408 . 0 0 "[ . 1 . 2]" 1
155 1 12 SER H 1 14 VAL H . . 4.440 4.042 3.901 4.132 . 0 0 "[ . 1 . 2]" 1
156 1 12 SER H 1 91 VAL MG1 . . 5.500 4.789 4.610 5.033 . 0 0 "[ . 1 . 2]" 1
157 1 12 SER HA 1 14 VAL H . . 4.850 3.751 3.434 4.017 . 0 0 "[ . 1 . 2]" 1
158 1 12 SER HA 1 91 VAL HA . . 4.200 4.088 3.940 4.204 0.004 9 0 "[ . 1 . 2]" 1
159 1 12 SER HA 1 92 PRO HB2 . . 4.820 4.744 4.400 4.823 0.003 5 0 "[ . 1 . 2]" 1
160 1 12 SER HA 1 92 PRO HB3 . . 4.610 3.642 3.118 3.775 . 0 0 "[ . 1 . 2]" 1
161 1 12 SER HA 1 92 PRO HD2 . . 4.010 3.324 3.176 3.471 . 0 0 "[ . 1 . 2]" 1
162 1 12 SER HA 1 92 PRO HD3 . . 3.640 2.101 1.998 2.206 . 0 0 "[ . 1 . 2]" 1
163 1 12 SER HA 1 92 PRO HG2 . . 3.900 3.849 3.721 3.902 0.002 14 0 "[ . 1 . 2]" 1
164 1 12 SER HA 1 92 PRO QG . . 3.400 2.320 2.125 2.390 . 0 0 "[ . 1 . 2]" 1
165 1 12 SER HA 1 92 PRO HG3 . . 3.900 2.339 2.137 2.413 . 0 0 "[ . 1 . 2]" 1
166 1 12 SER QB 1 13 LYS H . . 3.990 2.819 2.686 3.041 . 0 0 "[ . 1 . 2]" 1
167 1 12 SER HB2 1 13 LYS H . . 4.660 3.261 2.752 4.047 . 0 0 "[ . 1 . 2]" 1
168 1 12 SER HB3 1 13 LYS H . . 4.660 3.446 2.777 3.934 . 0 0 "[ . 1 . 2]" 1
169 1 13 LYS H 1 13 LYS HB2 . . 3.150 2.527 2.368 2.649 . 0 0 "[ . 1 . 2]" 1
170 1 13 LYS H 1 13 LYS HB3 . . 3.820 3.595 3.583 3.635 . 0 0 "[ . 1 . 2]" 1
171 1 13 LYS H 1 13 LYS QD . . 4.010 3.674 2.992 3.981 . 0 0 "[ . 1 . 2]" 1
172 1 13 LYS H 1 13 LYS HG2 . . 3.500 2.165 1.900 2.538 . 0 0 "[ . 1 . 2]" 1
173 1 13 LYS H 1 13 LYS HG3 . . 3.680 3.509 3.297 3.680 . 0 0 "[ . 1 . 2]" 1
174 1 13 LYS H 1 14 VAL H . . 3.020 2.552 2.391 2.622 . 0 0 "[ . 1 . 2]" 1
175 1 13 LYS H 1 14 VAL HB . . 4.940 4.858 4.657 4.942 0.002 11 0 "[ . 1 . 2]" 1
176 1 13 LYS H 1 14 VAL MG2 . . 4.090 3.718 3.491 3.927 . 0 0 "[ . 1 . 2]" 1
177 1 13 LYS H 1 39 ALA HA . . 4.190 3.869 3.608 4.132 . 0 0 "[ . 1 . 2]" 1
178 1 13 LYS H 1 39 ALA MB . . 4.330 4.005 3.658 4.326 . 0 0 "[ . 1 . 2]" 1
179 1 13 LYS H 1 92 PRO HD3 . . 5.500 5.233 4.791 5.348 . 0 0 "[ . 1 . 2]" 1
180 1 13 LYS HA 1 13 LYS QD . . 3.240 2.243 1.984 2.899 . 0 0 "[ . 1 . 2]" 1
181 1 13 LYS HA 1 13 LYS QE . . 4.270 3.271 1.960 4.293 0.023 9 0 "[ . 1 . 2]" 1
182 1 13 LYS HA 1 13 LYS HG2 . . 3.360 2.995 2.773 3.291 . 0 0 "[ . 1 . 2]" 1
183 1 13 LYS HA 1 13 LYS HG3 . . 3.870 3.798 3.740 3.869 . 0 0 "[ . 1 . 2]" 1
184 1 13 LYS HB2 1 13 LYS QD . . 3.490 3.333 3.237 3.497 0.007 18 0 "[ . 1 . 2]" 1
185 1 13 LYS HB2 1 13 LYS QE . . 4.450 4.008 3.406 4.423 . 0 0 "[ . 1 . 2]" 1
186 1 13 LYS HB2 1 14 VAL H . . 4.060 3.146 2.870 3.481 . 0 0 "[ . 1 . 2]" 1
187 1 13 LYS HB2 1 38 GLU HB2 . . 4.770 4.147 3.845 4.360 . 0 0 "[ . 1 . 2]" 1
188 1 13 LYS HB2 1 38 GLU QB . . 3.990 3.843 3.597 3.988 . 0 0 "[ . 1 . 2]" 1
189 1 13 LYS HB2 1 38 GLU HB3 . . 4.770 4.550 4.130 4.728 . 0 0 "[ . 1 . 2]" 1
190 1 13 LYS HB2 1 39 ALA H . . 4.810 3.274 2.825 3.724 . 0 0 "[ . 1 . 2]" 1
191 1 13 LYS HB2 1 39 ALA HA . . 3.610 2.175 1.998 2.458 . 0 0 "[ . 1 . 2]" 1
192 1 13 LYS HB2 1 39 ALA MB . . 3.750 2.660 2.301 3.013 . 0 0 "[ . 1 . 2]" 1
193 1 13 LYS HB3 1 13 LYS QD . . 3.650 2.416 2.133 2.924 . 0 0 "[ . 1 . 2]" 1
194 1 13 LYS HB3 1 13 LYS QE . . 4.930 3.410 1.978 4.088 . 0 0 "[ . 1 . 2]" 1
195 1 13 LYS HB3 1 14 VAL H . . 4.350 4.078 3.889 4.333 . 0 0 "[ . 1 . 2]" 1
196 1 13 LYS HB3 1 14 VAL HA . . 5.160 4.655 4.475 4.880 . 0 0 "[ . 1 . 2]" 1
197 1 13 LYS HB3 1 14 VAL MG2 . . 5.160 4.599 4.436 4.936 . 0 0 "[ . 1 . 2]" 1
198 1 13 LYS HB3 1 38 GLU H . . 4.860 2.757 2.073 3.989 . 0 0 "[ . 1 . 2]" 1
199 1 13 LYS HB3 1 38 GLU HB2 . . 4.350 3.034 2.836 3.256 . 0 0 "[ . 1 . 2]" 1
200 1 13 LYS HB3 1 38 GLU QB . . 3.670 2.948 2.763 3.163 . 0 0 "[ . 1 . 2]" 1
201 1 13 LYS HB3 1 38 GLU HB3 . . 4.350 4.029 3.493 4.290 . 0 0 "[ . 1 . 2]" 1
202 1 13 LYS HB3 1 39 ALA H . . 4.450 3.442 3.006 3.749 . 0 0 "[ . 1 . 2]" 1
203 1 13 LYS HB3 1 39 ALA HA . . 3.980 3.591 3.366 3.874 . 0 0 "[ . 1 . 2]" 1
204 1 13 LYS HB3 1 39 ALA MB . . 4.130 3.645 3.268 3.993 . 0 0 "[ . 1 . 2]" 1
205 1 13 LYS QE 1 13 LYS HG2 . . 3.650 2.529 2.055 3.384 . 0 0 "[ . 1 . 2]" 1
206 1 13 LYS QE 1 13 LYS HG3 . . 3.600 2.746 2.107 3.389 . 0 0 "[ . 1 . 2]" 1
207 1 13 LYS HG2 1 39 ALA HA . . 4.600 3.808 2.937 4.358 . 0 0 "[ . 1 . 2]" 1
208 1 13 LYS HG3 1 39 ALA H . . 4.780 4.275 3.592 4.661 . 0 0 "[ . 1 . 2]" 1
209 1 13 LYS HG3 1 39 ALA HA . . 3.910 3.169 2.459 3.698 . 0 0 "[ . 1 . 2]" 1
210 1 14 VAL H 1 14 VAL HB . . 2.950 2.521 2.461 2.592 . 0 0 "[ . 1 . 2]" 1
211 1 14 VAL H 1 14 VAL MG1 . . 3.930 3.769 3.757 3.792 . 0 0 "[ . 1 . 2]" 1
212 1 14 VAL H 1 14 VAL MG2 . . 3.090 2.156 1.994 2.339 . 0 0 "[ . 1 . 2]" 1
213 1 14 VAL H 1 15 VAL H . . 4.710 4.546 4.459 4.605 . 0 0 "[ . 1 . 2]" 1
214 1 14 VAL H 1 39 ALA HA . . 4.600 4.396 3.980 4.587 . 0 0 "[ . 1 . 2]" 1
215 1 14 VAL H 1 39 ALA MB . . 3.910 3.235 2.753 3.587 . 0 0 "[ . 1 . 2]" 1
216 1 14 VAL H 1 91 VAL MG1 . . 3.800 3.742 3.622 3.805 0.005 7 0 "[ . 1 . 2]" 1
217 1 14 VAL H 1 92 PRO HD2 . . 4.660 4.444 4.165 4.659 . 0 0 "[ . 1 . 2]" 1
218 1 14 VAL H 1 92 PRO HD3 . . 5.120 4.658 4.214 4.979 . 0 0 "[ . 1 . 2]" 1
219 1 14 VAL H 1 92 PRO QG . . 5.060 4.428 4.047 4.737 . 0 0 "[ . 1 . 2]" 1
220 1 14 VAL HA 1 14 VAL MG1 . . 3.280 2.362 2.274 2.450 . 0 0 "[ . 1 . 2]" 1
221 1 14 VAL HA 1 14 VAL MG2 . . 3.380 2.384 2.292 2.468 . 0 0 "[ . 1 . 2]" 1
222 1 14 VAL HA 1 15 VAL H . . 2.810 2.162 2.141 2.204 . 0 0 "[ . 1 . 2]" 1
223 1 14 VAL HA 1 15 VAL HB . . 4.610 4.590 4.543 4.615 0.005 15 0 "[ . 1 . 2]" 1
224 1 14 VAL HA 1 36 CYS HA . . 4.050 3.025 2.619 3.406 . 0 0 "[ . 1 . 2]" 1
225 1 14 VAL HA 1 39 ALA MB . . 4.010 3.174 2.765 3.415 . 0 0 "[ . 1 . 2]" 1
226 1 14 VAL HB 1 39 ALA MB . . 4.330 4.086 3.824 4.267 . 0 0 "[ . 1 . 2]" 1
227 1 14 VAL HB 1 86 TYR HB2 . . 4.500 4.270 4.071 4.504 0.004 14 0 "[ . 1 . 2]" 1
228 1 14 VAL HB 1 91 VAL MG1 . . 3.290 2.039 1.922 2.122 . 0 0 "[ . 1 . 2]" 1
229 1 14 VAL HB 1 92 PRO HD2 . . 4.050 3.409 3.097 3.643 . 0 0 "[ . 1 . 2]" 1
230 1 14 VAL HB 1 92 PRO HD3 . . 5.100 4.401 4.010 4.629 . 0 0 "[ . 1 . 2]" 1
231 1 14 VAL MG1 1 15 VAL H . . 3.420 2.413 2.008 2.703 . 0 0 "[ . 1 . 2]" 1
232 1 14 VAL MG1 1 15 VAL HA . . 4.300 3.696 3.524 3.950 . 0 0 "[ . 1 . 2]" 1
233 1 14 VAL MG1 1 16 ALA H . . 4.620 4.007 3.653 4.296 . 0 0 "[ . 1 . 2]" 1
234 1 14 VAL MG1 1 16 ALA MB . . 3.850 3.251 3.089 3.447 . 0 0 "[ . 1 . 2]" 1
235 1 14 VAL MG1 1 34 VAL HA . . 5.220 3.847 3.684 4.011 . 0 0 "[ . 1 . 2]" 1
236 1 14 VAL MG1 1 34 VAL MG1 . . 2.810 1.839 1.727 2.115 . 0 0 "[ . 1 . 2]" 1
237 1 14 VAL MG1 1 35 ASP H . . 4.780 3.954 3.471 4.273 . 0 0 "[ . 1 . 2]" 1
238 1 14 VAL MG1 1 36 CYS HA . . 4.310 3.889 3.512 4.277 . 0 0 "[ . 1 . 2]" 1
239 1 14 VAL MG1 1 91 VAL HB . . 4.330 3.909 3.646 4.175 . 0 0 "[ . 1 . 2]" 1
240 1 14 VAL MG1 1 91 VAL MG1 . . 3.220 2.189 1.952 2.338 . 0 0 "[ . 1 . 2]" 1
241 1 14 VAL MG2 1 15 VAL H . . 4.270 3.995 3.925 4.109 . 0 0 "[ . 1 . 2]" 1
242 1 14 VAL MG2 1 36 CYS HA . . 3.840 3.572 3.180 3.841 0.001 12 0 "[ . 1 . 2]" 1
243 1 14 VAL MG2 1 36 CYS QB . . 4.470 3.247 2.674 4.320 . 0 0 "[ . 1 . 2]" 1
244 1 14 VAL MG2 1 39 ALA H . . 4.570 4.282 4.094 4.474 . 0 0 "[ . 1 . 2]" 1
245 1 14 VAL MG2 1 39 ALA HA . . 4.730 3.541 3.360 3.804 . 0 0 "[ . 1 . 2]" 1
246 1 14 VAL MG2 1 39 ALA MB . . 2.890 1.842 1.738 1.986 . 0 0 "[ . 1 . 2]" 1
247 1 14 VAL MG2 1 86 TYR HB2 . . 3.900 2.891 2.648 3.084 . 0 0 "[ . 1 . 2]" 1
248 1 14 VAL MG2 1 86 TYR HB3 . . 3.830 2.935 2.662 3.205 . 0 0 "[ . 1 . 2]" 1
249 1 14 VAL MG2 1 86 TYR QD . . 3.790 2.891 2.715 3.070 . 0 0 "[ . 1 . 2]" 1
250 1 14 VAL MG2 1 86 TYR QE . . 4.330 3.378 3.235 3.547 . 0 0 "[ . 1 . 2]" 1
251 1 14 VAL MG2 1 91 VAL HB . . 5.500 5.073 4.854 5.318 . 0 0 "[ . 1 . 2]" 1
252 1 14 VAL MG2 1 91 VAL MG1 . . 3.380 2.808 2.626 3.023 . 0 0 "[ . 1 . 2]" 1
253 1 15 VAL H 1 15 VAL HB . . 3.380 2.614 2.539 2.683 . 0 0 "[ . 1 . 2]" 1
254 1 15 VAL H 1 15 VAL MG1 . . 3.960 3.839 3.807 3.871 . 0 0 "[ . 1 . 2]" 1
255 1 15 VAL H 1 16 ALA H . . 4.430 4.304 4.150 4.437 0.007 14 0 "[ . 1 . 2]" 1
256 1 15 VAL H 1 34 VAL HA . . 4.880 4.411 4.158 4.586 . 0 0 "[ . 1 . 2]" 1
257 1 15 VAL H 1 34 VAL MG1 . . 4.130 3.215 2.874 3.526 . 0 0 "[ . 1 . 2]" 1
258 1 15 VAL H 1 35 ASP H . . 3.900 3.308 2.752 3.705 . 0 0 "[ . 1 . 2]" 1
259 1 15 VAL H 1 35 ASP QB . . 3.970 3.722 3.391 3.961 . 0 0 "[ . 1 . 2]" 1
260 1 15 VAL H 1 36 CYS HA . . 4.330 3.755 3.302 4.322 . 0 0 "[ . 1 . 2]" 1
261 1 15 VAL HA 1 15 VAL MG1 . . 2.910 2.377 2.295 2.467 . 0 0 "[ . 1 . 2]" 1
262 1 15 VAL HA 1 16 ALA H . . 2.650 2.148 2.141 2.172 . 0 0 "[ . 1 . 2]" 1
263 1 15 VAL HA 1 16 ALA HA . . 4.850 4.399 4.395 4.413 . 0 0 "[ . 1 . 2]" 1
264 1 15 VAL HA 1 16 ALA MB . . 4.050 3.945 3.853 4.035 . 0 0 "[ . 1 . 2]" 1
265 1 15 VAL HB 1 16 ALA H . . 4.460 4.257 4.101 4.384 . 0 0 "[ . 1 . 2]" 1
266 1 15 VAL HB 1 35 ASP H . . 4.390 3.175 2.918 3.687 . 0 0 "[ . 1 . 2]" 1
267 1 15 VAL HB 1 35 ASP HB2 . . 3.920 3.422 2.266 3.920 . 0 0 "[ . 1 . 2]" 1
268 1 15 VAL HB 1 35 ASP QB . . 3.240 2.478 2.080 2.931 . 0 0 "[ . 1 . 2]" 1
269 1 15 VAL HB 1 35 ASP HB3 . . 3.920 2.842 2.090 3.918 . 0 0 "[ . 1 . 2]" 1
270 1 15 VAL MG1 1 16 ALA H . . 3.280 2.592 2.215 2.920 . 0 0 "[ . 1 . 2]" 1
271 1 15 VAL MG1 1 16 ALA MB . . 4.210 4.121 3.923 4.211 0.001 10 0 "[ . 1 . 2]" 1
272 1 15 VAL MG1 1 17 SER H . . 4.710 4.343 4.167 4.507 . 0 0 "[ . 1 . 2]" 1
273 1 15 VAL MG1 1 35 ASP H . . 4.500 3.874 3.606 4.344 . 0 0 "[ . 1 . 2]" 1
274 1 16 ALA H 1 16 ALA MB . . 3.110 2.429 2.326 2.586 . 0 0 "[ . 1 . 2]" 1
275 1 16 ALA H 1 17 SER H . . 4.570 4.409 4.334 4.502 . 0 0 "[ . 1 . 2]" 1
276 1 16 ALA H 1 21 LEU MD1 . . 5.360 4.782 4.525 4.952 . 0 0 "[ . 1 . 2]" 1
277 1 16 ALA H 1 34 VAL MG1 . . 5.500 4.701 4.336 5.072 . 0 0 "[ . 1 . 2]" 1
278 1 16 ALA H 1 34 VAL MG2 . . 5.500 4.930 4.571 5.278 . 0 0 "[ . 1 . 2]" 1
279 1 16 ALA HA 1 17 SER H . . 2.710 2.178 2.149 2.237 . 0 0 "[ . 1 . 2]" 1
280 1 16 ALA HA 1 33 SER H . . 4.570 4.436 4.152 4.569 . 0 0 "[ . 1 . 2]" 1
281 1 16 ALA HA 1 34 VAL HA . . 3.790 2.517 2.320 2.666 . 0 0 "[ . 1 . 2]" 1
282 1 16 ALA HA 1 34 VAL MG1 . . 3.980 3.745 3.506 3.945 . 0 0 "[ . 1 . 2]" 1
283 1 16 ALA HA 1 34 VAL MG2 . . 3.500 3.080 2.830 3.320 . 0 0 "[ . 1 . 2]" 1
284 1 16 ALA HA 1 35 ASP H . . 4.020 3.694 3.416 4.023 0.003 9 0 "[ . 1 . 2]" 1
285 1 16 ALA MB 1 17 SER H . . 3.330 3.028 2.765 3.149 . 0 0 "[ . 1 . 2]" 1
286 1 16 ALA MB 1 21 LEU MD1 . . 2.720 2.452 2.281 2.637 . 0 0 "[ . 1 . 2]" 1
287 1 16 ALA MB 1 33 SER H . . 5.120 4.580 4.254 4.799 . 0 0 "[ . 1 . 2]" 1
288 1 16 ALA MB 1 34 VAL H . . 5.500 5.170 4.904 5.444 . 0 0 "[ . 1 . 2]" 1
289 1 16 ALA MB 1 34 VAL HA . . 4.540 3.454 3.158 3.714 . 0 0 "[ . 1 . 2]" 1
290 1 16 ALA MB 1 34 VAL MG2 . . 3.310 2.459 2.185 2.724 . 0 0 "[ . 1 . 2]" 1
291 1 16 ALA MB 1 35 ASP H . . 5.500 4.733 4.454 4.986 . 0 0 "[ . 1 . 2]" 1
292 1 16 ALA MB 1 91 VAL MG1 . . 4.080 3.965 3.728 4.080 . 0 0 "[ . 1 . 2]" 1
293 1 16 ALA MB 1 94 PHE QD . . 4.440 3.734 3.468 3.935 . 0 0 "[ . 1 . 2]" 1
294 1 16 ALA MB 1 94 PHE QE . . 3.140 2.063 1.849 2.211 . 0 0 "[ . 1 . 2]" 1
295 1 16 ALA MB 1 94 PHE HZ . . 3.340 3.034 2.779 3.262 . 0 0 "[ . 1 . 2]" 1
296 1 17 SER H 1 17 SER HB2 . . 4.140 3.296 2.748 4.022 . 0 0 "[ . 1 . 2]" 1
297 1 17 SER H 1 17 SER QB . . 3.550 2.935 2.690 3.249 . 0 0 "[ . 1 . 2]" 1
298 1 17 SER H 1 17 SER HB3 . . 4.140 3.584 2.964 3.959 . 0 0 "[ . 1 . 2]" 1
299 1 17 SER H 1 18 GLY H . . 4.660 4.383 4.364 4.408 . 0 0 "[ . 1 . 2]" 1
300 1 17 SER H 1 18 GLY HA3 . . 5.250 4.687 4.626 4.758 . 0 0 "[ . 1 . 2]" 1
301 1 17 SER H 1 21 LEU MD1 . . 3.520 3.410 3.168 3.511 . 0 0 "[ . 1 . 2]" 1
302 1 17 SER H 1 32 LEU HA . . 4.770 4.394 4.105 4.576 . 0 0 "[ . 1 . 2]" 1
303 1 17 SER H 1 32 LEU HB3 . . 4.930 4.463 4.089 4.749 . 0 0 "[ . 1 . 2]" 1
304 1 17 SER H 1 33 SER H . . 3.370 2.935 2.708 3.074 . 0 0 "[ . 1 . 2]" 1
305 1 17 SER H 1 33 SER HA . . 5.500 4.985 4.718 5.142 . 0 0 "[ . 1 . 2]" 1
306 1 17 SER H 1 33 SER HB2 . . 5.090 4.433 3.619 5.084 . 0 0 "[ . 1 . 2]" 1
307 1 17 SER H 1 33 SER QB . . 4.270 3.876 3.464 4.250 . 0 0 "[ . 1 . 2]" 1
308 1 17 SER H 1 33 SER HB3 . . 5.090 4.544 3.683 5.083 . 0 0 "[ . 1 . 2]" 1
309 1 17 SER H 1 34 VAL HA . . 4.020 3.928 3.745 4.019 . 0 0 "[ . 1 . 2]" 1
310 1 17 SER HA 1 18 GLY H . . 3.070 2.575 2.464 2.636 . 0 0 "[ . 1 . 2]" 1
311 1 17 SER HA 1 18 GLY HA2 . . 4.970 4.755 4.685 4.794 . 0 0 "[ . 1 . 2]" 1
312 1 17 SER HA 1 21 LEU HB3 . . 5.430 4.568 4.313 4.732 . 0 0 "[ . 1 . 2]" 1
313 1 17 SER HA 1 21 LEU MD1 . . 3.710 2.361 2.177 2.657 . 0 0 "[ . 1 . 2]" 1
314 1 17 SER QB 1 18 GLY H . . 2.940 2.216 1.957 2.925 . 0 0 "[ . 1 . 2]" 1
315 1 17 SER HB2 1 18 GLY H . . 3.720 3.011 2.048 3.714 . 0 0 "[ . 1 . 2]" 1
316 1 17 SER HB3 1 18 GLY H . . 3.720 2.762 1.968 3.705 . 0 0 "[ . 1 . 2]" 1
317 1 18 GLY H 1 19 PRO HD3 . . 4.790 4.713 4.649 4.765 . 0 0 "[ . 1 . 2]" 1
318 1 18 GLY H 1 21 LEU HB2 . . 5.040 3.866 3.668 3.968 . 0 0 "[ . 1 . 2]" 1
319 1 18 GLY H 1 21 LEU HB3 . . 5.410 5.193 4.959 5.322 . 0 0 "[ . 1 . 2]" 1
320 1 18 GLY H 1 21 LEU MD1 . . 3.780 3.692 3.485 3.779 . 0 0 "[ . 1 . 2]" 1
321 1 18 GLY HA2 1 19 PRO HA . . 4.800 4.380 4.379 4.382 . 0 0 "[ . 1 . 2]" 1
322 1 18 GLY HA2 1 19 PRO HD2 . . 3.430 2.631 2.580 2.690 . 0 0 "[ . 1 . 2]" 1
323 1 18 GLY HA2 1 19 PRO HD3 . . 3.250 2.417 2.386 2.456 . 0 0 "[ . 1 . 2]" 1
324 1 18 GLY HA2 1 19 PRO HG2 . . 4.750 4.702 4.660 4.752 0.002 9 0 "[ . 1 . 2]" 1
325 1 18 GLY HA2 1 19 PRO HG3 . . 4.750 4.627 4.590 4.672 . 0 0 "[ . 1 . 2]" 1
326 1 18 GLY HA2 1 20 GLY H . . 4.630 4.301 4.118 4.401 . 0 0 "[ . 1 . 2]" 1
327 1 18 GLY HA2 1 32 LEU HA . . 4.510 4.272 4.136 4.476 . 0 0 "[ . 1 . 2]" 1
328 1 18 GLY HA2 1 33 SER H . . 4.680 4.578 4.359 4.667 . 0 0 "[ . 1 . 2]" 1
329 1 18 GLY HA3 1 19 PRO HD2 . . 3.490 2.397 2.343 2.445 . 0 0 "[ . 1 . 2]" 1
330 1 18 GLY HA3 1 19 PRO HD3 . . 3.510 3.286 3.230 3.334 . 0 0 "[ . 1 . 2]" 1
331 1 18 GLY HA3 1 19 PRO HG2 . . 5.150 4.438 4.397 4.476 . 0 0 "[ . 1 . 2]" 1
332 1 18 GLY HA3 1 19 PRO QG . . 4.480 4.151 4.111 4.188 . 0 0 "[ . 1 . 2]" 1
333 1 18 GLY HA3 1 19 PRO HG3 . . 5.150 4.993 4.940 5.040 . 0 0 "[ . 1 . 2]" 1
334 1 18 GLY HA3 1 20 GLY H . . 4.420 3.370 3.179 3.458 . 0 0 "[ . 1 . 2]" 1
335 1 18 GLY HA3 1 31 LEU HB2 . . 5.410 4.339 4.146 4.534 . 0 0 "[ . 1 . 2]" 1
336 1 18 GLY HA3 1 32 LEU H . . 5.500 5.010 4.835 5.221 . 0 0 "[ . 1 . 2]" 1
337 1 18 GLY HA3 1 33 SER H . . 4.640 3.509 3.337 3.635 . 0 0 "[ . 1 . 2]" 1
338 1 19 PRO HA 1 21 LEU H . . 4.190 4.029 3.843 4.154 . 0 0 "[ . 1 . 2]" 1
339 1 19 PRO HA 1 22 GLU H . . 3.960 3.468 3.287 3.645 . 0 0 "[ . 1 . 2]" 1
340 1 19 PRO HA 1 22 GLU QB . . 3.730 2.828 2.708 2.957 . 0 0 "[ . 1 . 2]" 1
341 1 19 PRO HA 1 22 GLU HG2 . . 4.540 4.202 4.016 4.432 . 0 0 "[ . 1 . 2]" 1
342 1 19 PRO HA 1 22 GLU HG3 . . 3.820 2.469 2.266 2.698 . 0 0 "[ . 1 . 2]" 1
343 1 19 PRO HA 1 23 HIS H . . 4.410 4.216 4.037 4.363 . 0 0 "[ . 1 . 2]" 1
344 1 19 PRO HB2 1 20 GLY H . . 4.310 3.381 3.290 3.583 . 0 0 "[ . 1 . 2]" 1
345 1 19 PRO HB2 1 31 LEU H . . 4.580 4.441 4.289 4.564 . 0 0 "[ . 1 . 2]" 1
346 1 19 PRO HB3 1 20 GLY H . . 4.480 4.170 4.117 4.288 . 0 0 "[ . 1 . 2]" 1
347 1 19 PRO HD2 1 20 GLY H . . 3.990 2.655 2.648 2.701 . 0 0 "[ . 1 . 2]" 1
348 1 19 PRO HD2 1 31 LEU H . . 4.980 3.996 3.758 4.191 . 0 0 "[ . 1 . 2]" 1
349 1 19 PRO HD2 1 31 LEU HB2 . . 4.440 2.234 2.021 2.436 . 0 0 "[ . 1 . 2]" 1
350 1 19 PRO HD2 1 31 LEU HB3 . . 4.070 3.226 3.020 3.317 . 0 0 "[ . 1 . 2]" 1
351 1 19 PRO HD2 1 31 LEU MD1 . . 4.070 3.667 3.423 3.860 . 0 0 "[ . 1 . 2]" 1
352 1 19 PRO HD2 1 32 LEU HA . . 4.660 3.925 3.799 4.008 . 0 0 "[ . 1 . 2]" 1
353 1 19 PRO HD3 1 20 GLY H . . 4.420 3.845 3.838 3.873 . 0 0 "[ . 1 . 2]" 1
354 1 19 PRO HD3 1 31 LEU H . . 5.500 5.333 5.087 5.498 . 0 0 "[ . 1 . 2]" 1
355 1 19 PRO HD3 1 31 LEU HB2 . . 5.020 3.387 3.184 3.560 . 0 0 "[ . 1 . 2]" 1
356 1 19 PRO HD3 1 31 LEU HB3 . . 4.670 4.366 4.143 4.466 . 0 0 "[ . 1 . 2]" 1
357 1 19 PRO HD3 1 31 LEU MD1 . . 4.290 3.871 3.610 4.061 . 0 0 "[ . 1 . 2]" 1
358 1 19 PRO HD3 1 32 LEU HA . . 5.490 5.415 5.286 5.486 . 0 0 "[ . 1 . 2]" 1
359 1 19 PRO QG 1 20 GLY H . . 3.510 2.407 2.295 2.669 . 0 0 "[ . 1 . 2]" 1
360 1 19 PRO QG 1 31 LEU H . . 3.800 2.659 2.436 2.790 . 0 0 "[ . 1 . 2]" 1
361 1 19 PRO QG 1 31 LEU HB2 . . 3.750 2.000 1.948 2.123 . 0 0 "[ . 1 . 2]" 1
362 1 19 PRO QG 1 31 LEU HB3 . . 3.640 3.520 3.471 3.630 . 0 0 "[ . 1 . 2]" 1
363 1 19 PRO QG 1 31 LEU HG . . 4.050 3.301 3.059 3.455 . 0 0 "[ . 1 . 2]" 1
364 1 19 PRO HG2 1 20 GLY H . . 4.130 2.429 2.313 2.703 . 0 0 "[ . 1 . 2]" 1
365 1 19 PRO HG2 1 31 LEU H . . 4.470 2.690 2.461 2.828 . 0 0 "[ . 1 . 2]" 1
366 1 19 PRO HG2 1 31 LEU HB2 . . 4.400 2.066 2.000 2.214 . 0 0 "[ . 1 . 2]" 1
367 1 19 PRO HG2 1 31 LEU HB3 . . 4.290 3.815 3.748 3.956 . 0 0 "[ . 1 . 2]" 1
368 1 19 PRO HG2 1 31 LEU MD1 . . 4.490 3.131 2.821 3.408 . 0 0 "[ . 1 . 2]" 1
369 1 19 PRO HG2 1 31 LEU HG . . 4.740 3.487 3.217 3.669 . 0 0 "[ . 1 . 2]" 1
370 1 19 PRO HG3 1 20 GLY H . . 4.130 3.926 3.840 4.130 0.000 20 0 "[ . 1 . 2]" 1
371 1 19 PRO HG3 1 31 LEU H . . 4.470 4.154 3.878 4.286 . 0 0 "[ . 1 . 2]" 1
372 1 19 PRO HG3 1 31 LEU HB2 . . 4.400 2.676 2.567 2.778 . 0 0 "[ . 1 . 2]" 1
373 1 19 PRO HG3 1 31 LEU HB3 . . 4.290 4.133 4.051 4.226 . 0 0 "[ . 1 . 2]" 1
374 1 19 PRO HG3 1 31 LEU MD1 . . 4.490 2.609 2.224 2.890 . 0 0 "[ . 1 . 2]" 1
375 1 19 PRO HG3 1 31 LEU HG . . 4.740 4.083 3.830 4.265 . 0 0 "[ . 1 . 2]" 1
376 1 20 GLY H 1 21 LEU H . . 3.510 2.693 2.551 2.780 . 0 0 "[ . 1 . 2]" 1
377 1 20 GLY H 1 22 GLU H . . 4.600 3.996 3.920 4.095 . 0 0 "[ . 1 . 2]" 1
378 1 20 GLY H 1 30 GLY HA2 . . 4.580 3.855 3.667 4.045 . 0 0 "[ . 1 . 2]" 1
379 1 20 GLY H 1 30 GLY HA3 . . 5.300 4.458 4.258 4.715 . 0 0 "[ . 1 . 2]" 1
380 1 20 GLY H 1 31 LEU H . . 3.820 3.377 3.243 3.582 . 0 0 "[ . 1 . 2]" 1
381 1 20 GLY H 1 31 LEU HB2 . . 4.380 3.500 3.366 3.603 . 0 0 "[ . 1 . 2]" 1
382 1 20 GLY H 1 31 LEU HB3 . . 4.920 4.865 4.794 4.917 . 0 0 "[ . 1 . 2]" 1
383 1 20 GLY H 1 32 LEU HA . . 4.570 4.342 4.180 4.549 . 0 0 "[ . 1 . 2]" 1
384 1 20 GLY H 1 32 LEU MD2 . . 3.970 2.620 2.427 2.846 . 0 0 "[ . 1 . 2]" 1
385 1 20 GLY H 1 32 LEU HG . . 4.550 4.365 4.243 4.508 . 0 0 "[ . 1 . 2]" 1
386 1 20 GLY H 1 72 TYR QE . . 5.050 4.728 4.505 4.909 . 0 0 "[ . 1 . 2]" 1
387 1 20 GLY HA2 1 22 GLU H . . 4.000 3.676 3.559 3.821 . 0 0 "[ . 1 . 2]" 1
388 1 20 GLY HA2 1 30 GLY HA2 . . 4.380 2.795 2.652 2.939 . 0 0 "[ . 1 . 2]" 1
389 1 20 GLY HA2 1 30 GLY HA3 . . 4.340 3.133 2.942 3.435 . 0 0 "[ . 1 . 2]" 1
390 1 20 GLY HA2 1 31 LEU H . . 4.400 4.014 3.883 4.145 . 0 0 "[ . 1 . 2]" 1
391 1 20 GLY HA2 1 32 LEU MD2 . . 4.150 3.596 3.472 3.749 . 0 0 "[ . 1 . 2]" 1
392 1 20 GLY HA2 1 32 LEU HG . . 5.240 5.065 4.888 5.238 . 0 0 "[ . 1 . 2]" 1
393 1 20 GLY HA2 1 72 TYR QE . . 4.000 3.041 2.833 3.443 . 0 0 "[ . 1 . 2]" 1
394 1 20 GLY HA2 1 72 TYR HH . . 4.160 3.223 2.844 3.427 . 0 0 "[ . 1 . 2]" 1
395 1 20 GLY HA3 1 22 GLU H . . 4.540 4.260 4.170 4.385 . 0 0 "[ . 1 . 2]" 1
396 1 20 GLY HA3 1 30 GLY HA2 . . 4.020 2.898 2.732 3.044 . 0 0 "[ . 1 . 2]" 1
397 1 20 GLY HA3 1 30 GLY HA3 . . 4.400 2.653 2.457 2.963 . 0 0 "[ . 1 . 2]" 1
398 1 20 GLY HA3 1 31 LEU H . . 4.070 3.634 3.506 3.739 . 0 0 "[ . 1 . 2]" 1
399 1 20 GLY HA3 1 32 LEU MD1 . . 4.080 3.829 3.703 4.001 . 0 0 "[ . 1 . 2]" 1
400 1 20 GLY HA3 1 32 LEU MD2 . . 3.880 2.129 1.982 2.355 . 0 0 "[ . 1 . 2]" 1
401 1 20 GLY HA3 1 32 LEU HG . . 4.590 3.349 3.179 3.530 . 0 0 "[ . 1 . 2]" 1
402 1 20 GLY HA3 1 72 TYR QE . . 3.850 2.479 2.254 2.662 . 0 0 "[ . 1 . 2]" 1
403 1 20 GLY HA3 1 72 TYR HH . . 4.090 3.864 3.450 4.082 . 0 0 "[ . 1 . 2]" 1
404 1 21 LEU H 1 21 LEU HB2 . . 3.120 2.186 2.167 2.211 . 0 0 "[ . 1 . 2]" 1
405 1 21 LEU H 1 21 LEU HB3 . . 3.620 3.486 3.473 3.504 . 0 0 "[ . 1 . 2]" 1
406 1 21 LEU H 1 21 LEU MD1 . . 3.930 3.503 3.373 3.622 . 0 0 "[ . 1 . 2]" 1
407 1 21 LEU H 1 21 LEU MD2 . . 4.310 4.242 4.183 4.295 . 0 0 "[ . 1 . 2]" 1
408 1 21 LEU H 1 21 LEU HG . . 3.360 3.218 3.071 3.314 . 0 0 "[ . 1 . 2]" 1
409 1 21 LEU H 1 22 GLU QB . . 4.730 4.555 4.427 4.646 . 0 0 "[ . 1 . 2]" 1
410 1 21 LEU H 1 22 GLU HG2 . . 4.730 4.581 4.474 4.707 . 0 0 "[ . 1 . 2]" 1
411 1 21 LEU H 1 22 GLU HG3 . . 4.520 3.732 3.610 3.910 . 0 0 "[ . 1 . 2]" 1
412 1 21 LEU H 1 23 HIS H . . 4.330 4.140 4.062 4.265 . 0 0 "[ . 1 . 2]" 1
413 1 21 LEU H 1 32 LEU MD1 . . 4.690 4.535 4.337 4.693 0.003 15 0 "[ . 1 . 2]" 1
414 1 21 LEU H 1 32 LEU MD2 . . 3.410 2.458 2.353 2.578 . 0 0 "[ . 1 . 2]" 1
415 1 21 LEU H 1 32 LEU HG . . 5.110 4.906 4.750 5.062 . 0 0 "[ . 1 . 2]" 1
416 1 21 LEU HA 1 21 LEU MD1 . . 4.020 3.794 3.780 3.817 . 0 0 "[ . 1 . 2]" 1
417 1 21 LEU HA 1 21 LEU MD2 . . 2.820 2.445 2.319 2.620 . 0 0 "[ . 1 . 2]" 1
418 1 21 LEU HA 1 21 LEU HG . . 3.550 2.506 2.472 2.574 . 0 0 "[ . 1 . 2]" 1
419 1 21 LEU HA 1 23 HIS H . . 4.650 4.499 4.384 4.617 . 0 0 "[ . 1 . 2]" 1
420 1 21 LEU HA 1 32 LEU MD2 . . 3.560 3.402 3.252 3.543 . 0 0 "[ . 1 . 2]" 1
421 1 21 LEU HA 1 82 LEU MD1 . . 3.600 2.469 2.269 2.635 . 0 0 "[ . 1 . 2]" 1
422 1 21 LEU HA 1 82 LEU MD2 . . 4.370 4.326 4.186 4.379 0.009 9 0 "[ . 1 . 2]" 1
423 1 21 LEU HA 1 82 LEU HG . . 5.270 5.042 4.766 5.266 . 0 0 "[ . 1 . 2]" 1
424 1 21 LEU HA 1 98 VAL MG2 . . 3.050 2.213 1.946 2.444 . 0 0 "[ . 1 . 2]" 1
425 1 21 LEU HB2 1 21 LEU MD1 . . 2.990 2.094 1.987 2.199 . 0 0 "[ . 1 . 2]" 1
426 1 21 LEU HB2 1 21 LEU MD2 . . 3.540 3.136 3.116 3.155 . 0 0 "[ . 1 . 2]" 1
427 1 21 LEU HB2 1 22 GLU H . . 3.870 3.564 3.407 3.702 . 0 0 "[ . 1 . 2]" 1
428 1 21 LEU HB2 1 22 GLU HA . . 5.050 4.980 4.897 5.049 . 0 0 "[ . 1 . 2]" 1
429 1 21 LEU HB2 1 22 GLU HG2 . . 4.460 4.097 4.041 4.186 . 0 0 "[ . 1 . 2]" 1
430 1 21 LEU HB2 1 22 GLU HG3 . . 4.520 3.938 3.834 4.005 . 0 0 "[ . 1 . 2]" 1
431 1 21 LEU HB3 1 21 LEU MD1 . . 3.010 2.613 2.558 2.688 . 0 0 "[ . 1 . 2]" 1
432 1 21 LEU HB3 1 21 LEU MD2 . . 3.090 2.163 2.018 2.251 . 0 0 "[ . 1 . 2]" 1
433 1 21 LEU HB3 1 22 GLU H . . 4.090 3.987 3.880 4.078 . 0 0 "[ . 1 . 2]" 1
434 1 21 LEU HB3 1 22 GLU HA . . 4.590 4.381 4.318 4.438 . 0 0 "[ . 1 . 2]" 1
435 1 21 LEU HB3 1 22 GLU HG2 . . 4.180 4.025 3.880 4.162 . 0 0 "[ . 1 . 2]" 1
436 1 21 LEU HB3 1 22 GLU HG3 . . 4.850 4.567 4.441 4.739 . 0 0 "[ . 1 . 2]" 1
437 1 21 LEU MD1 1 94 PHE QE . . 4.080 3.222 3.051 3.596 . 0 0 "[ . 1 . 2]" 1
438 1 21 LEU MD1 1 94 PHE HZ . . 3.780 2.690 2.347 3.066 . 0 0 "[ . 1 . 2]" 1
439 1 21 LEU MD2 1 82 LEU HB3 . . 4.000 3.789 3.436 4.003 0.003 2 0 "[ . 1 . 2]" 1
440 1 21 LEU MD2 1 82 LEU HG . . 4.550 4.180 3.948 4.446 . 0 0 "[ . 1 . 2]" 1
441 1 21 LEU MD2 1 94 PHE QD . . 4.660 3.812 3.636 4.050 . 0 0 "[ . 1 . 2]" 1
442 1 21 LEU MD2 1 94 PHE QE . . 3.440 2.845 2.591 3.158 . 0 0 "[ . 1 . 2]" 1
443 1 21 LEU MD2 1 94 PHE HZ . . 3.420 2.876 2.381 3.167 . 0 0 "[ . 1 . 2]" 1
444 1 21 LEU MD2 1 96 ALA MB . . 3.170 2.100 1.797 2.318 . 0 0 "[ . 1 . 2]" 1
445 1 21 LEU HG 1 22 GLU H . . 5.060 4.981 4.944 5.008 . 0 0 "[ . 1 . 2]" 1
446 1 21 LEU HG 1 32 LEU MD2 . . 3.120 2.036 1.963 2.228 . 0 0 "[ . 1 . 2]" 1
447 1 22 GLU H 1 22 GLU QB . . 3.190 2.593 2.540 2.650 . 0 0 "[ . 1 . 2]" 1
448 1 22 GLU H 1 22 GLU HG2 . . 3.920 3.289 3.165 3.405 . 0 0 "[ . 1 . 2]" 1
449 1 22 GLU H 1 22 GLU HG3 . . 3.680 2.702 2.561 2.931 . 0 0 "[ . 1 . 2]" 1
450 1 22 GLU H 1 23 HIS H . . 2.730 2.055 1.958 2.168 . 0 0 "[ . 1 . 2]" 1
451 1 22 GLU H 1 98 VAL MG1 . . 4.620 3.505 3.294 3.734 . 0 0 "[ . 1 . 2]" 1
452 1 22 GLU H 1 98 VAL MG2 . . 4.130 3.763 3.510 3.969 . 0 0 "[ . 1 . 2]" 1
453 1 22 GLU HA 1 22 GLU HG2 . . 3.380 2.520 2.448 2.570 . 0 0 "[ . 1 . 2]" 1
454 1 22 GLU HA 1 22 GLU HG3 . . 3.630 3.486 3.462 3.512 . 0 0 "[ . 1 . 2]" 1
455 1 22 GLU HA 1 23 HIS HD2 . . 5.130 4.640 3.979 4.947 . 0 0 "[ . 1 . 2]" 1
456 1 22 GLU HA 1 98 VAL MG2 . . 4.440 3.615 3.312 3.832 . 0 0 "[ . 1 . 2]" 1
457 1 22 GLU QB 1 22 GLU HG3 . . 2.700 2.226 2.206 2.248 . 0 0 "[ . 1 . 2]" 1
458 1 22 GLU QB 1 23 HIS H . . 3.220 2.697 2.620 2.787 . 0 0 "[ . 1 . 2]" 1
459 1 22 GLU QB 1 23 HIS HB2 . . 5.070 4.857 3.916 4.926 . 0 0 "[ . 1 . 2]" 1
460 1 22 GLU QB 1 23 HIS QB . . 4.200 3.574 3.446 3.763 . 0 0 "[ . 1 . 2]" 1
461 1 22 GLU QB 1 23 HIS HB3 . . 5.070 3.722 3.523 4.869 . 0 0 "[ . 1 . 2]" 1
462 1 22 GLU QB 1 23 HIS HD2 . . 3.450 2.285 1.936 2.765 . 0 0 "[ . 1 . 2]" 1
463 1 22 GLU HG2 1 23 HIS H . . 4.720 4.706 4.675 4.722 0.002 11 0 "[ . 1 . 2]" 1
464 1 22 GLU HG3 1 23 HIS H . . 4.280 4.145 4.045 4.261 . 0 0 "[ . 1 . 2]" 1
465 1 23 HIS H 1 23 HIS HB2 . . 4.060 3.996 3.135 4.073 0.013 12 0 "[ . 1 . 2]" 1
466 1 23 HIS H 1 23 HIS QB . . 3.480 3.278 3.032 3.387 . 0 0 "[ . 1 . 2]" 1
467 1 23 HIS H 1 23 HIS HB3 . . 4.060 3.515 3.381 4.026 . 0 0 "[ . 1 . 2]" 1
468 1 23 HIS H 1 23 HIS HD2 . . 4.620 3.170 2.106 4.168 . 0 0 "[ . 1 . 2]" 1
469 1 23 HIS H 1 98 VAL HB . . 5.500 5.429 5.264 5.501 0.001 11 0 "[ . 1 . 2]" 1
470 1 23 HIS H 1 98 VAL MG1 . . 3.930 2.718 2.585 2.842 . 0 0 "[ . 1 . 2]" 1
471 1 23 HIS H 1 98 VAL MG2 . . 4.190 3.984 3.683 4.173 . 0 0 "[ . 1 . 2]" 1
472 1 23 HIS HA 1 24 GLY H . . 3.060 2.432 2.373 2.504 . 0 0 "[ . 1 . 2]" 1
473 1 23 HIS HA 1 98 VAL HA . . 5.250 4.335 4.027 4.465 . 0 0 "[ . 1 . 2]" 1
474 1 23 HIS HA 1 98 VAL MG1 . . 3.710 1.878 1.839 1.962 . 0 0 "[ . 1 . 2]" 1
475 1 23 HIS HA 1 98 VAL MG2 . . 4.210 4.086 3.881 4.202 . 0 0 "[ . 1 . 2]" 1
476 1 23 HIS HA 1 99 LYS H . . 4.770 3.858 3.328 4.345 . 0 0 "[ . 1 . 2]" 1
477 1 23 HIS QB 1 24 GLY H . . 3.250 2.394 2.291 2.486 . 0 0 "[ . 1 . 2]" 1
478 1 23 HIS QB 1 98 VAL MG1 . . 4.700 3.350 3.281 3.497 . 0 0 "[ . 1 . 2]" 1
479 1 23 HIS HB2 1 24 GLY H . . 3.870 2.466 2.313 3.207 . 0 0 "[ . 1 . 2]" 1
480 1 23 HIS HB3 1 24 GLY H . . 3.870 3.715 2.346 3.874 0.004 15 0 "[ . 1 . 2]" 1
481 1 24 GLY H 1 25 LYS H . . 4.430 4.416 4.395 4.431 0.001 9 0 "[ . 1 . 2]" 1
482 1 24 GLY H 1 98 VAL HB . . 5.430 5.384 5.253 5.435 0.005 11 0 "[ . 1 . 2]" 1
483 1 24 GLY H 1 98 VAL MG1 . . 3.740 3.009 2.843 3.182 . 0 0 "[ . 1 . 2]" 1
484 1 24 GLY H 1 100 VAL HA . . 3.430 2.480 2.377 2.625 . 0 0 "[ . 1 . 2]" 1
485 1 24 GLY H 1 100 VAL HB . . 5.370 5.195 5.076 5.367 . 0 0 "[ . 1 . 2]" 1
486 1 24 GLY H 1 100 VAL MG1 . . 4.170 3.840 3.604 4.091 . 0 0 "[ . 1 . 2]" 1
487 1 24 GLY H 1 100 VAL MG2 . . 4.070 2.977 2.767 3.154 . 0 0 "[ . 1 . 2]" 1
488 1 24 GLY H 1 101 GLU H . . 3.930 3.636 3.444 3.826 . 0 0 "[ . 1 . 2]" 1
489 1 24 GLY QA 1 25 LYS H . . 2.760 2.265 2.230 2.281 . 0 0 "[ . 1 . 2]" 1
490 1 24 GLY QA 1 25 LYS HB2 . . 5.030 3.868 3.829 3.932 . 0 0 "[ . 1 . 2]" 1
491 1 24 GLY QA 1 25 LYS HB3 . . 5.090 4.551 4.429 4.596 . 0 0 "[ . 1 . 2]" 1
492 1 24 GLY QA 1 98 VAL MG1 . . 4.620 3.382 3.074 3.663 . 0 0 "[ . 1 . 2]" 1
493 1 24 GLY QA 1 100 VAL HA . . 4.250 3.385 3.247 3.498 . 0 0 "[ . 1 . 2]" 1
494 1 24 GLY QA 1 100 VAL MG1 . . 3.990 2.977 2.587 3.352 . 0 0 "[ . 1 . 2]" 1
495 1 24 GLY QA 1 100 VAL MG2 . . 3.510 2.119 1.902 2.367 . 0 0 "[ . 1 . 2]" 1
496 1 24 GLY QA 1 101 GLU H . . 5.040 4.346 4.204 4.458 . 0 0 "[ . 1 . 2]" 1
497 1 24 GLY HA2 1 25 LYS H . . 3.160 2.442 2.337 2.519 . 0 0 "[ . 1 . 2]" 1
498 1 24 GLY HA2 1 100 VAL HA . . 4.920 4.481 4.311 4.583 . 0 0 "[ . 1 . 2]" 1
499 1 24 GLY HA2 1 100 VAL MG1 . . 4.630 4.023 3.649 4.430 . 0 0 "[ . 1 . 2]" 1
500 1 24 GLY HA2 1 100 VAL MG2 . . 4.210 3.645 3.356 3.836 . 0 0 "[ . 1 . 2]" 1
501 1 24 GLY HA3 1 25 LYS H . . 3.160 2.690 2.605 2.815 . 0 0 "[ . 1 . 2]" 1
502 1 24 GLY HA3 1 100 VAL HA . . 4.920 3.504 3.348 3.639 . 0 0 "[ . 1 . 2]" 1
503 1 24 GLY HA3 1 100 VAL MG1 . . 4.630 3.068 2.646 3.470 . 0 0 "[ . 1 . 2]" 1
504 1 24 GLY HA3 1 100 VAL MG2 . . 4.210 2.133 1.912 2.391 . 0 0 "[ . 1 . 2]" 1
505 1 25 LYS H 1 25 LYS HB2 . . 3.670 3.010 2.936 3.124 . 0 0 "[ . 1 . 2]" 1
506 1 25 LYS H 1 25 LYS HB3 . . 3.630 3.013 2.935 3.074 . 0 0 "[ . 1 . 2]" 1
507 1 25 LYS H 1 25 LYS HG2 . . 4.680 4.670 4.588 4.704 0.024 9 0 "[ . 1 . 2]" 1
508 1 25 LYS H 1 25 LYS HG3 . . 4.820 4.734 4.672 4.835 0.015 18 0 "[ . 1 . 2]" 1
509 1 25 LYS H 1 26 VAL H . . 4.520 4.316 4.250 4.376 . 0 0 "[ . 1 . 2]" 1
510 1 25 LYS H 1 28 GLU H . . 4.610 3.996 3.895 4.171 . 0 0 "[ . 1 . 2]" 1
511 1 25 LYS H 1 28 GLU HB2 . . 4.070 2.583 2.363 2.705 . 0 0 "[ . 1 . 2]" 1
512 1 25 LYS H 1 28 GLU HB3 . . 4.750 3.611 3.374 3.842 . 0 0 "[ . 1 . 2]" 1
513 1 25 LYS H 1 28 GLU HG3 . . 4.720 4.154 3.863 4.322 . 0 0 "[ . 1 . 2]" 1
514 1 25 LYS H 1 74 PRO HD2 . . 4.920 4.137 3.999 4.300 . 0 0 "[ . 1 . 2]" 1
515 1 25 LYS H 1 74 PRO HG2 . . 4.970 3.579 3.423 3.893 . 0 0 "[ . 1 . 2]" 1
516 1 25 LYS H 1 74 PRO HG3 . . 5.120 3.175 3.005 3.499 . 0 0 "[ . 1 . 2]" 1
517 1 25 LYS H 1 100 VAL HA . . 4.850 4.758 4.522 4.850 0.000 11 0 "[ . 1 . 2]" 1
518 1 25 LYS H 1 100 VAL MG1 . . 3.870 2.985 2.630 3.292 . 0 0 "[ . 1 . 2]" 1
519 1 25 LYS H 1 100 VAL MG2 . . 4.360 3.702 3.268 4.022 . 0 0 "[ . 1 . 2]" 1
520 1 25 LYS H 1 101 GLU H . . 4.910 4.808 4.668 4.913 0.003 2 0 "[ . 1 . 2]" 1
521 1 25 LYS HA 1 25 LYS QE . . 5.160 4.540 4.262 4.767 . 0 0 "[ . 1 . 2]" 1
522 1 25 LYS HA 1 26 VAL H . . 3.180 2.195 2.165 2.230 . 0 0 "[ . 1 . 2]" 1
523 1 25 LYS HA 1 100 VAL HA . . 4.810 3.923 3.745 4.141 . 0 0 "[ . 1 . 2]" 1
524 1 25 LYS HA 1 100 VAL MG1 . . 3.950 2.078 1.942 2.291 . 0 0 "[ . 1 . 2]" 1
525 1 25 LYS HA 1 101 GLU H . . 3.780 2.807 2.626 2.983 . 0 0 "[ . 1 . 2]" 1
526 1 25 LYS HA 1 101 GLU HB2 . . 4.870 3.748 3.552 3.967 . 0 0 "[ . 1 . 2]" 1
527 1 25 LYS HA 1 101 GLU HB3 . . 5.160 4.663 4.483 4.816 . 0 0 "[ . 1 . 2]" 1
528 1 25 LYS HB2 1 25 LYS QE . . 4.340 3.893 2.518 4.224 . 0 0 "[ . 1 . 2]" 1
529 1 25 LYS HB2 1 26 VAL H . . 4.410 4.277 4.153 4.357 . 0 0 "[ . 1 . 2]" 1
530 1 25 LYS HB2 1 28 GLU H . . 5.100 4.782 4.660 4.940 . 0 0 "[ . 1 . 2]" 1
531 1 25 LYS HB2 1 28 GLU HB2 . . 3.860 3.307 3.153 3.458 . 0 0 "[ . 1 . 2]" 1
532 1 25 LYS HB2 1 28 GLU HB3 . . 4.470 4.298 4.119 4.466 . 0 0 "[ . 1 . 2]" 1
533 1 25 LYS HB2 1 28 GLU HG2 . . 4.420 3.969 3.746 4.303 . 0 0 "[ . 1 . 2]" 1
534 1 25 LYS HB2 1 28 GLU HG3 . . 4.530 2.922 2.752 3.210 . 0 0 "[ . 1 . 2]" 1
535 1 25 LYS HB3 1 25 LYS HD2 . . 4.080 2.936 2.165 3.621 . 0 0 "[ . 1 . 2]" 1
536 1 25 LYS HB3 1 25 LYS HD3 . . 4.080 2.563 2.205 3.448 . 0 0 "[ . 1 . 2]" 1
537 1 25 LYS HB3 1 25 LYS QE . . 4.590 3.779 2.377 4.111 . 0 0 "[ . 1 . 2]" 1
538 1 25 LYS HB3 1 25 LYS HG2 . . 2.880 2.504 2.445 2.571 . 0 0 "[ . 1 . 2]" 1
539 1 25 LYS HB3 1 26 VAL H . . 4.260 3.813 3.725 3.893 . 0 0 "[ . 1 . 2]" 1
540 1 25 LYS HB3 1 28 GLU H . . 4.490 3.146 3.012 3.292 . 0 0 "[ . 1 . 2]" 1
541 1 25 LYS HB3 1 28 GLU HA . . 5.290 4.444 4.318 4.550 . 0 0 "[ . 1 . 2]" 1
542 1 25 LYS HB3 1 28 GLU HB2 . . 3.860 2.073 1.999 2.222 . 0 0 "[ . 1 . 2]" 1
543 1 25 LYS HB3 1 28 GLU HB3 . . 4.290 3.417 3.321 3.551 . 0 0 "[ . 1 . 2]" 1
544 1 25 LYS HB3 1 28 GLU HG2 . . 4.280 2.462 2.275 2.826 . 0 0 "[ . 1 . 2]" 1
545 1 25 LYS HB3 1 28 GLU HG3 . . 4.290 2.115 2.000 2.328 . 0 0 "[ . 1 . 2]" 1
546 1 25 LYS QD 1 28 GLU HG2 . . 3.990 2.722 2.357 3.136 . 0 0 "[ . 1 . 2]" 1
547 1 25 LYS QD 1 103 ALA HA . . 4.120 3.469 1.993 4.120 0.000 11 0 "[ . 1 . 2]" 1
548 1 25 LYS HD2 1 28 GLU HG2 . . 4.540 3.864 2.379 4.533 . 0 0 "[ . 1 . 2]" 1
549 1 25 LYS HD2 1 28 GLU HG3 . . 4.420 3.300 2.414 4.288 . 0 0 "[ . 1 . 2]" 1
550 1 25 LYS HD2 1 103 ALA HA . . 4.690 4.409 3.184 4.692 0.002 15 0 "[ . 1 . 2]" 1
551 1 25 LYS HD3 1 28 GLU HG2 . . 4.540 2.944 2.410 4.058 . 0 0 "[ . 1 . 2]" 1
552 1 25 LYS HD3 1 28 GLU HG3 . . 4.420 2.987 2.214 4.241 . 0 0 "[ . 1 . 2]" 1
553 1 25 LYS HD3 1 103 ALA HA . . 4.690 3.769 2.001 4.624 . 0 0 "[ . 1 . 2]" 1
554 1 25 LYS QE 1 25 LYS HG2 . . 3.630 2.512 2.147 3.512 . 0 0 "[ . 1 . 2]" 1
555 1 25 LYS QE 1 25 LYS HG3 . . 3.830 2.567 2.097 3.224 . 0 0 "[ . 1 . 2]" 1
556 1 25 LYS QE 1 103 ALA HA . . 3.830 2.226 1.880 3.831 0.001 18 0 "[ . 1 . 2]" 1
557 1 25 LYS QE 1 104 VAL H . . 5.050 4.108 3.236 5.039 . 0 0 "[ . 1 . 2]" 1
558 1 25 LYS HG2 1 26 VAL H . . 3.570 2.563 2.268 2.746 . 0 0 "[ . 1 . 2]" 1
559 1 25 LYS HG2 1 26 VAL HB . . 4.450 3.762 3.553 3.929 . 0 0 "[ . 1 . 2]" 1
560 1 25 LYS HG2 1 28 GLU H . . 4.450 4.340 4.173 4.432 . 0 0 "[ . 1 . 2]" 1
561 1 25 LYS HG2 1 101 GLU H . . 5.380 4.953 4.762 5.184 . 0 0 "[ . 1 . 2]" 1
562 1 25 LYS HG2 1 101 GLU HB2 . . 4.840 4.702 4.470 4.841 0.001 5 0 "[ . 1 . 2]" 1
563 1 25 LYS HG2 1 101 GLU HB3 . . 5.270 4.891 4.628 5.066 . 0 0 "[ . 1 . 2]" 1
564 1 25 LYS HG2 1 103 ALA H . . 5.500 4.266 3.959 4.540 . 0 0 "[ . 1 . 2]" 1
565 1 25 LYS HG2 1 103 ALA HA . . 4.280 3.053 2.689 3.443 . 0 0 "[ . 1 . 2]" 1
566 1 25 LYS HG3 1 26 VAL H . . 3.880 3.458 3.242 3.666 . 0 0 "[ . 1 . 2]" 1
567 1 25 LYS HG3 1 26 VAL HB . . 5.500 5.147 4.878 5.367 . 0 0 "[ . 1 . 2]" 1
568 1 25 LYS HG3 1 101 GLU H . . 4.930 3.902 3.712 4.112 . 0 0 "[ . 1 . 2]" 1
569 1 25 LYS HG3 1 101 GLU HB2 . . 4.410 3.169 2.975 3.387 . 0 0 "[ . 1 . 2]" 1
570 1 25 LYS HG3 1 101 GLU HB3 . . 5.060 3.621 3.410 3.868 . 0 0 "[ . 1 . 2]" 1
571 1 25 LYS HG3 1 103 ALA HA . . 4.370 3.926 3.531 4.291 . 0 0 "[ . 1 . 2]" 1
572 1 26 VAL H 1 26 VAL HB . . 3.140 2.521 2.417 2.627 . 0 0 "[ . 1 . 2]" 1
573 1 26 VAL H 1 26 VAL MG1 . . 4.040 3.760 3.742 3.766 . 0 0 "[ . 1 . 2]" 1
574 1 26 VAL H 1 26 VAL MG2 . . 2.950 2.166 1.985 2.414 . 0 0 "[ . 1 . 2]" 1
575 1 26 VAL H 1 27 GLY H . . 4.620 4.424 4.366 4.485 . 0 0 "[ . 1 . 2]" 1
576 1 26 VAL H 1 74 PRO HG2 . . 4.910 3.920 3.788 4.072 . 0 0 "[ . 1 . 2]" 1
577 1 26 VAL H 1 74 PRO HG3 . . 5.390 4.837 4.719 4.973 . 0 0 "[ . 1 . 2]" 1
578 1 26 VAL H 1 100 VAL MG1 . . 3.390 2.608 2.395 2.797 . 0 0 "[ . 1 . 2]" 1
579 1 26 VAL H 1 101 GLU H . . 4.550 4.316 4.187 4.552 0.002 19 0 "[ . 1 . 2]" 1
580 1 26 VAL H 1 102 PRO HA . . 4.080 3.481 3.277 3.692 . 0 0 "[ . 1 . 2]" 1
581 1 26 VAL H 1 103 ALA H . . 4.270 4.022 3.708 4.259 . 0 0 "[ . 1 . 2]" 1
582 1 26 VAL H 1 103 ALA HA . . 4.760 4.599 4.348 4.763 0.003 11 0 "[ . 1 . 2]" 1
583 1 26 VAL HA 1 26 VAL MG1 . . 3.220 2.414 2.318 2.514 . 0 0 "[ . 1 . 2]" 1
584 1 26 VAL HA 1 26 VAL MG2 . . 3.260 2.322 2.191 2.433 . 0 0 "[ . 1 . 2]" 1
585 1 26 VAL HA 1 27 GLY H . . 2.870 2.152 2.145 2.165 . 0 0 "[ . 1 . 2]" 1
586 1 26 VAL HA 1 27 GLY HA2 . . 4.520 4.369 4.355 4.384 . 0 0 "[ . 1 . 2]" 1
587 1 26 VAL HA 1 27 GLY HA3 . . 4.820 4.387 4.383 4.393 . 0 0 "[ . 1 . 2]" 1
588 1 26 VAL HA 1 28 GLU H . . 3.860 3.750 3.616 3.847 . 0 0 "[ . 1 . 2]" 1
589 1 26 VAL HA 1 74 PRO HB2 . . 4.270 2.935 2.812 3.019 . 0 0 "[ . 1 . 2]" 1
590 1 26 VAL HA 1 74 PRO HB3 . . 4.490 4.472 4.336 4.495 0.005 7 0 "[ . 1 . 2]" 1
591 1 26 VAL HA 1 74 PRO HD2 . . 4.800 4.219 3.924 4.382 . 0 0 "[ . 1 . 2]" 1
592 1 26 VAL HA 1 74 PRO HD3 . . 5.390 5.186 4.914 5.306 . 0 0 "[ . 1 . 2]" 1
593 1 26 VAL HA 1 74 PRO HG2 . . 3.780 2.283 1.999 2.416 . 0 0 "[ . 1 . 2]" 1
594 1 26 VAL HA 1 74 PRO HG3 . . 4.190 3.859 3.611 3.969 . 0 0 "[ . 1 . 2]" 1
595 1 26 VAL HA 1 75 LEU HA . . 4.720 4.343 4.181 4.596 . 0 0 "[ . 1 . 2]" 1
596 1 26 VAL HA 1 77 ALA HA . . 5.240 4.522 4.338 4.674 . 0 0 "[ . 1 . 2]" 1
597 1 26 VAL HA 1 100 VAL MG1 . . 3.820 3.199 2.942 3.336 . 0 0 "[ . 1 . 2]" 1
598 1 26 VAL HB 1 27 GLY H . . 4.480 4.386 4.314 4.479 . 0 0 "[ . 1 . 2]" 1
599 1 26 VAL HB 1 102 PRO HA . . 3.900 3.012 2.754 3.268 . 0 0 "[ . 1 . 2]" 1
600 1 26 VAL HB 1 103 ALA H . . 3.200 2.420 2.147 2.773 . 0 0 "[ . 1 . 2]" 1
601 1 26 VAL HB 1 103 ALA HA . . 4.250 4.075 3.849 4.248 . 0 0 "[ . 1 . 2]" 1
602 1 26 VAL HB 1 103 ALA MB . . 3.190 2.241 1.985 2.689 . 0 0 "[ . 1 . 2]" 1
603 1 26 VAL MG1 1 27 GLY H . . 3.130 2.891 2.661 3.092 . 0 0 "[ . 1 . 2]" 1
604 1 26 VAL MG1 1 27 GLY HA2 . . 4.030 3.699 3.574 3.819 . 0 0 "[ . 1 . 2]" 1
605 1 26 VAL MG1 1 27 GLY HA3 . . 3.890 3.465 3.245 3.648 . 0 0 "[ . 1 . 2]" 1
606 1 26 VAL MG1 1 28 GLU H . . 4.680 4.546 4.427 4.666 . 0 0 "[ . 1 . 2]" 1
607 1 26 VAL MG1 1 75 LEU HA . . 3.220 2.965 2.764 3.222 0.002 11 0 "[ . 1 . 2]" 1
608 1 26 VAL MG1 1 76 THR H . . 4.670 3.975 3.567 4.262 . 0 0 "[ . 1 . 2]" 1
609 1 26 VAL MG1 1 76 THR HA . . 3.590 2.863 2.470 3.169 . 0 0 "[ . 1 . 2]" 1
610 1 26 VAL MG1 1 76 THR HB . . 5.500 4.767 4.417 5.027 . 0 0 "[ . 1 . 2]" 1
611 1 26 VAL MG1 1 103 ALA H . . 3.860 3.468 3.305 3.809 . 0 0 "[ . 1 . 2]" 1
612 1 26 VAL MG1 1 103 ALA HA . . 5.500 5.065 4.746 5.331 . 0 0 "[ . 1 . 2]" 1
613 1 26 VAL MG2 1 74 PRO HB2 . . 4.550 3.284 3.121 3.456 . 0 0 "[ . 1 . 2]" 1
614 1 26 VAL MG2 1 76 THR H . . 4.430 3.799 3.398 4.136 . 0 0 "[ . 1 . 2]" 1
615 1 26 VAL MG2 1 76 THR HA . . 3.860 2.599 2.215 3.001 . 0 0 "[ . 1 . 2]" 1
616 1 26 VAL MG2 1 76 THR HB . . 5.500 4.687 4.389 5.041 . 0 0 "[ . 1 . 2]" 1
617 1 26 VAL MG2 1 77 ALA H . . 3.810 2.128 1.867 2.470 . 0 0 "[ . 1 . 2]" 1
618 1 26 VAL MG2 1 77 ALA HA . . 3.570 2.308 2.169 2.542 . 0 0 "[ . 1 . 2]" 1
619 1 26 VAL MG2 1 77 ALA MB . . 2.960 1.925 1.770 2.083 . 0 0 "[ . 1 . 2]" 1
620 1 26 VAL MG2 1 78 GLY H . . 4.390 4.134 4.000 4.383 . 0 0 "[ . 1 . 2]" 1
621 1 26 VAL MG2 1 100 VAL MG1 . . 2.780 2.381 2.176 2.734 . 0 0 "[ . 1 . 2]" 1
622 1 26 VAL MG2 1 102 PRO HA . . 3.250 2.154 1.981 2.298 . 0 0 "[ . 1 . 2]" 1
623 1 26 VAL MG2 1 102 PRO HB2 . . 4.460 4.375 4.175 4.461 0.001 8 0 "[ . 1 . 2]" 1
624 1 26 VAL MG2 1 102 PRO HB3 . . 4.240 3.715 3.485 3.816 . 0 0 "[ . 1 . 2]" 1
625 1 26 VAL MG2 1 103 ALA H . . 3.700 3.103 2.729 3.460 . 0 0 "[ . 1 . 2]" 1
626 1 26 VAL MG2 1 103 ALA HA . . 5.500 4.979 4.711 5.211 . 0 0 "[ . 1 . 2]" 1
627 1 27 GLY H 1 28 GLU H . . 3.230 2.745 2.626 2.866 . 0 0 "[ . 1 . 2]" 1
628 1 27 GLY H 1 73 VAL HA . . 5.080 4.372 4.030 4.501 . 0 0 "[ . 1 . 2]" 1
629 1 27 GLY H 1 73 VAL MG1 . . 3.790 2.911 2.719 3.097 . 0 0 "[ . 1 . 2]" 1
630 1 27 GLY H 1 74 PRO HA . . 5.500 4.774 4.588 4.928 . 0 0 "[ . 1 . 2]" 1
631 1 27 GLY H 1 74 PRO HB2 . . 4.630 3.974 3.781 4.176 . 0 0 "[ . 1 . 2]" 1
632 1 27 GLY H 1 74 PRO HD2 . . 4.700 3.225 2.919 3.377 . 0 0 "[ . 1 . 2]" 1
633 1 27 GLY H 1 74 PRO HD3 . . 4.830 4.688 4.399 4.820 . 0 0 "[ . 1 . 2]" 1
634 1 27 GLY H 1 74 PRO HG2 . . 4.060 2.595 2.368 2.760 . 0 0 "[ . 1 . 2]" 1
635 1 27 GLY H 1 74 PRO HG3 . . 4.730 4.327 4.114 4.479 . 0 0 "[ . 1 . 2]" 1
636 1 27 GLY H 1 75 LEU HA . . 4.240 3.836 3.675 4.067 . 0 0 "[ . 1 . 2]" 1
637 1 27 GLY HA2 1 28 GLU HA . . 5.500 4.749 4.695 4.810 . 0 0 "[ . 1 . 2]" 1
638 1 27 GLY HA2 1 73 VAL MG1 . . 3.420 2.461 2.066 2.561 . 0 0 "[ . 1 . 2]" 1
639 1 27 GLY HA2 1 75 LEU HA . . 5.500 4.291 3.983 4.542 . 0 0 "[ . 1 . 2]" 1
640 1 27 GLY HA2 1 75 LEU MD2 . . 4.440 4.227 3.962 4.442 0.002 11 0 "[ . 1 . 2]" 1
641 1 27 GLY HA3 1 28 GLU H . . 3.510 2.987 2.944 3.069 . 0 0 "[ . 1 . 2]" 1
642 1 27 GLY HA3 1 28 GLU HA . . 4.710 4.368 4.360 4.387 . 0 0 "[ . 1 . 2]" 1
643 1 27 GLY HA3 1 28 GLU HB2 . . 5.500 5.129 5.077 5.172 . 0 0 "[ . 1 . 2]" 1
644 1 27 GLY HA3 1 28 GLU HG2 . . 5.340 4.654 4.519 4.856 . 0 0 "[ . 1 . 2]" 1
645 1 27 GLY HA3 1 73 VAL MG1 . . 3.810 3.750 3.355 3.817 0.007 2 0 "[ . 1 . 2]" 1
646 1 28 GLU H 1 28 GLU HB2 . . 3.160 2.213 2.183 2.248 . 0 0 "[ . 1 . 2]" 1
647 1 28 GLU H 1 28 GLU HB3 . . 3.550 3.510 3.490 3.532 . 0 0 "[ . 1 . 2]" 1
648 1 28 GLU H 1 28 GLU HG2 . . 3.530 2.886 2.775 3.002 . 0 0 "[ . 1 . 2]" 1
649 1 28 GLU H 1 28 GLU HG3 . . 4.060 3.909 3.799 4.012 . 0 0 "[ . 1 . 2]" 1
650 1 28 GLU H 1 29 ALA H . . 4.660 4.542 4.514 4.588 . 0 0 "[ . 1 . 2]" 1
651 1 28 GLU H 1 73 VAL MG1 . . 3.930 3.792 3.596 3.931 0.001 13 0 "[ . 1 . 2]" 1
652 1 28 GLU H 1 73 VAL MG2 . . 5.500 5.074 4.869 5.288 . 0 0 "[ . 1 . 2]" 1
653 1 28 GLU H 1 74 PRO HD2 . . 4.520 3.611 3.457 3.687 . 0 0 "[ . 1 . 2]" 1
654 1 28 GLU H 1 74 PRO HD3 . . 5.290 5.247 5.115 5.295 0.005 11 0 "[ . 1 . 2]" 1
655 1 28 GLU H 1 74 PRO HG2 . . 4.020 3.565 3.426 3.734 . 0 0 "[ . 1 . 2]" 1
656 1 28 GLU H 1 100 VAL MG1 . . 5.500 4.937 4.627 5.114 . 0 0 "[ . 1 . 2]" 1
657 1 28 GLU HA 1 28 GLU HG2 . . 3.770 2.696 2.506 2.757 . 0 0 "[ . 1 . 2]" 1
658 1 28 GLU HA 1 28 GLU HG3 . . 3.680 3.647 3.626 3.671 . 0 0 "[ . 1 . 2]" 1
659 1 28 GLU HA 1 29 ALA H . . 2.630 2.599 2.533 2.633 0.003 9 0 "[ . 1 . 2]" 1
660 1 28 GLU HA 1 29 ALA HA . . 4.500 4.457 4.435 4.480 . 0 0 "[ . 1 . 2]" 1
661 1 28 GLU HA 1 29 ALA MB . . 4.050 3.838 3.798 3.937 . 0 0 "[ . 1 . 2]" 1
662 1 28 GLU HB2 1 29 ALA H . . 3.980 3.523 3.430 3.654 . 0 0 "[ . 1 . 2]" 1
663 1 28 GLU HB2 1 29 ALA HA . . 5.500 4.998 4.905 5.073 . 0 0 "[ . 1 . 2]" 1
664 1 28 GLU HB2 1 74 PRO HD2 . . 5.080 4.083 4.015 4.164 . 0 0 "[ . 1 . 2]" 1
665 1 28 GLU HB3 1 28 GLU HG3 . . 2.860 2.483 2.436 2.577 . 0 0 "[ . 1 . 2]" 1
666 1 28 GLU HB3 1 29 ALA H . . 3.530 2.041 1.959 2.189 . 0 0 "[ . 1 . 2]" 1
667 1 28 GLU HB3 1 29 ALA HA . . 4.860 4.216 4.168 4.252 . 0 0 "[ . 1 . 2]" 1
668 1 28 GLU HG2 1 29 ALA H . . 4.420 4.366 4.213 4.421 0.001 7 0 "[ . 1 . 2]" 1
669 1 28 GLU HG3 1 29 ALA H . . 4.340 4.247 4.140 4.335 . 0 0 "[ . 1 . 2]" 1
670 1 29 ALA H 1 29 ALA MB . . 2.750 2.473 2.367 2.552 . 0 0 "[ . 1 . 2]" 1
671 1 29 ALA H 1 30 GLY H . . 4.350 4.249 4.180 4.343 . 0 0 "[ . 1 . 2]" 1
672 1 29 ALA H 1 73 VAL MG2 . . 4.650 4.285 4.063 4.630 . 0 0 "[ . 1 . 2]" 1
673 1 29 ALA HA 1 30 GLY H . . 2.730 2.147 2.145 2.159 . 0 0 "[ . 1 . 2]" 1
674 1 29 ALA HA 1 30 GLY HA3 . . 4.650 4.382 4.374 4.388 . 0 0 "[ . 1 . 2]" 1
675 1 29 ALA HA 1 31 LEU MD2 . . 5.500 5.395 5.288 5.475 . 0 0 "[ . 1 . 2]" 1
676 1 29 ALA HA 1 71 THR HA . . 5.500 5.283 5.087 5.432 . 0 0 "[ . 1 . 2]" 1
677 1 29 ALA HA 1 71 THR MG . . 3.770 2.821 2.583 2.972 . 0 0 "[ . 1 . 2]" 1
678 1 29 ALA HA 1 72 TYR H . . 3.960 3.653 3.537 3.785 . 0 0 "[ . 1 . 2]" 1
679 1 29 ALA HA 1 73 VAL H . . 5.100 4.695 4.512 4.956 . 0 0 "[ . 1 . 2]" 1
680 1 29 ALA HA 1 73 VAL HA . . 3.950 2.949 2.755 3.348 . 0 0 "[ . 1 . 2]" 1
681 1 29 ALA HA 1 73 VAL MG1 . . 4.180 4.063 3.938 4.182 0.002 5 0 "[ . 1 . 2]" 1
682 1 29 ALA HA 1 73 VAL MG2 . . 3.120 2.579 2.396 2.788 . 0 0 "[ . 1 . 2]" 1
683 1 29 ALA HA 1 74 PRO HD3 . . 4.970 4.255 4.088 4.716 . 0 0 "[ . 1 . 2]" 1
684 1 29 ALA MB 1 30 GLY H . . 3.520 3.250 3.140 3.328 . 0 0 "[ . 1 . 2]" 1
685 1 29 ALA MB 1 71 THR HA . . 4.660 4.408 4.264 4.495 . 0 0 "[ . 1 . 2]" 1
686 1 29 ALA MB 1 71 THR HB . . 3.830 3.711 3.509 3.868 0.038 5 0 "[ . 1 . 2]" 1
687 1 29 ALA MB 1 71 THR MG . . 2.900 1.801 1.740 1.880 . 0 0 "[ . 1 . 2]" 1
688 1 29 ALA MB 1 73 VAL MG1 . . 4.610 4.215 4.044 4.486 . 0 0 "[ . 1 . 2]" 1
689 1 29 ALA MB 1 73 VAL MG2 . . 3.170 2.542 2.308 2.982 . 0 0 "[ . 1 . 2]" 1
690 1 30 GLY H 1 31 LEU H . . 4.330 4.271 4.218 4.326 . 0 0 "[ . 1 . 2]" 1
691 1 30 GLY H 1 71 THR HA . . 4.390 4.068 3.889 4.245 . 0 0 "[ . 1 . 2]" 1
692 1 30 GLY H 1 71 THR HB . . 5.330 5.154 4.993 5.321 . 0 0 "[ . 1 . 2]" 1
693 1 30 GLY H 1 71 THR MG . . 3.850 2.744 2.414 2.980 . 0 0 "[ . 1 . 2]" 1
694 1 30 GLY H 1 72 TYR H . . 3.370 2.335 2.155 2.454 . 0 0 "[ . 1 . 2]" 1
695 1 30 GLY H 1 72 TYR QD . . 4.830 3.696 3.627 3.803 . 0 0 "[ . 1 . 2]" 1
696 1 30 GLY H 1 72 TYR QE . . 5.180 4.079 3.962 4.157 . 0 0 "[ . 1 . 2]" 1
697 1 30 GLY H 1 73 VAL HA . . 4.180 3.792 3.658 4.027 . 0 0 "[ . 1 . 2]" 1
698 1 30 GLY H 1 73 VAL MG2 . . 3.980 3.937 3.789 3.983 0.003 10 0 "[ . 1 . 2]" 1
699 1 30 GLY H 1 74 PRO HD2 . . 4.990 4.297 4.142 4.571 . 0 0 "[ . 1 . 2]" 1
700 1 30 GLY H 1 74 PRO HD3 . . 4.540 3.899 3.691 4.263 . 0 0 "[ . 1 . 2]" 1
701 1 30 GLY HA2 1 31 LEU H . . 2.970 2.198 2.178 2.231 . 0 0 "[ . 1 . 2]" 1
702 1 30 GLY HA2 1 32 LEU HG . . 5.010 4.675 4.580 4.754 . 0 0 "[ . 1 . 2]" 1
703 1 30 GLY HA2 1 71 THR HA . . 5.500 5.115 5.030 5.204 . 0 0 "[ . 1 . 2]" 1
704 1 30 GLY HA2 1 72 TYR H . . 4.510 4.409 4.340 4.486 . 0 0 "[ . 1 . 2]" 1
705 1 30 GLY HA2 1 72 TYR QE . . 4.570 3.780 3.602 4.027 . 0 0 "[ . 1 . 2]" 1
706 1 30 GLY HA3 1 31 LEU H . . 3.460 3.426 3.399 3.460 . 0 0 "[ . 1 . 2]" 1
707 1 30 GLY HA3 1 71 THR HA . . 5.250 4.197 4.027 4.353 . 0 0 "[ . 1 . 2]" 1
708 1 30 GLY HA3 1 72 TYR H . . 4.090 3.220 3.099 3.315 . 0 0 "[ . 1 . 2]" 1
709 1 30 GLY HA3 1 72 TYR QD . . 5.010 2.982 2.797 3.230 . 0 0 "[ . 1 . 2]" 1
710 1 30 GLY HA3 1 72 TYR QE . . 4.130 2.527 2.438 2.761 . 0 0 "[ . 1 . 2]" 1
711 1 31 LEU H 1 31 LEU HB2 . . 3.470 2.495 2.435 2.561 . 0 0 "[ . 1 . 2]" 1
712 1 31 LEU H 1 31 LEU HB3 . . 3.750 3.586 3.582 3.591 . 0 0 "[ . 1 . 2]" 1
713 1 31 LEU H 1 31 LEU MD1 . . 4.340 3.553 3.431 3.651 . 0 0 "[ . 1 . 2]" 1
714 1 31 LEU H 1 31 LEU MD2 . . 4.240 3.371 3.244 3.454 . 0 0 "[ . 1 . 2]" 1
715 1 31 LEU H 1 31 LEU HG . . 3.090 2.231 2.109 2.350 . 0 0 "[ . 1 . 2]" 1
716 1 31 LEU H 1 32 LEU H . . 4.600 4.487 4.444 4.531 . 0 0 "[ . 1 . 2]" 1
717 1 31 LEU H 1 71 THR MG . . 5.160 3.773 3.596 4.025 . 0 0 "[ . 1 . 2]" 1
718 1 31 LEU HA 1 31 LEU MD1 . . 4.440 3.895 3.862 3.928 . 0 0 "[ . 1 . 2]" 1
719 1 31 LEU HA 1 31 LEU MD2 . . 3.850 2.191 1.966 2.337 . 0 0 "[ . 1 . 2]" 1
720 1 31 LEU HA 1 32 LEU H . . 2.970 2.142 2.139 2.147 . 0 0 "[ . 1 . 2]" 1
721 1 31 LEU HA 1 71 THR HA . . 4.140 3.670 3.478 3.983 . 0 0 "[ . 1 . 2]" 1
722 1 31 LEU HA 1 71 THR MG . . 3.880 2.800 2.589 3.180 . 0 0 "[ . 1 . 2]" 1
723 1 31 LEU HB2 1 31 LEU MD1 . . 3.220 2.251 2.148 2.371 . 0 0 "[ . 1 . 2]" 1
724 1 31 LEU HB2 1 31 LEU MD2 . . 3.380 3.182 3.168 3.192 . 0 0 "[ . 1 . 2]" 1
725 1 31 LEU HB2 1 32 LEU H . . 4.390 4.267 4.211 4.343 . 0 0 "[ . 1 . 2]" 1
726 1 31 LEU HB3 1 31 LEU MD1 . . 3.560 2.406 2.275 2.519 . 0 0 "[ . 1 . 2]" 1
727 1 31 LEU HB3 1 31 LEU MD2 . . 3.220 2.263 2.178 2.377 . 0 0 "[ . 1 . 2]" 1
728 1 31 LEU HB3 1 32 LEU H . . 3.780 3.434 3.309 3.545 . 0 0 "[ . 1 . 2]" 1
729 1 31 LEU HB3 1 32 LEU HA . . 4.680 4.520 4.417 4.583 . 0 0 "[ . 1 . 2]" 1
730 1 31 LEU MD2 1 32 LEU H . . 4.150 3.668 3.424 3.866 . 0 0 "[ . 1 . 2]" 1
731 1 31 LEU MD2 1 71 THR HA . . 4.860 4.636 4.428 4.862 0.002 11 0 "[ . 1 . 2]" 1
732 1 31 LEU MD2 1 71 THR MG . . 3.240 2.739 2.520 3.055 . 0 0 "[ . 1 . 2]" 1
733 1 31 LEU HG 1 32 LEU H . . 5.190 5.139 5.090 5.187 . 0 0 "[ . 1 . 2]" 1
734 1 31 LEU HG 1 71 THR MG . . 4.820 3.985 3.851 4.247 . 0 0 "[ . 1 . 2]" 1
735 1 32 LEU H 1 32 LEU HB2 . . 3.410 2.766 2.682 2.857 . 0 0 "[ . 1 . 2]" 1
736 1 32 LEU H 1 32 LEU HB3 . . 4.100 3.841 3.794 3.888 . 0 0 "[ . 1 . 2]" 1
737 1 32 LEU H 1 32 LEU MD2 . . 3.770 3.719 3.639 3.766 . 0 0 "[ . 1 . 2]" 1
738 1 32 LEU H 1 32 LEU HG . . 3.800 3.001 2.914 3.095 . 0 0 "[ . 1 . 2]" 1
739 1 32 LEU H 1 33 SER HA . . 5.500 4.803 4.730 4.884 . 0 0 "[ . 1 . 2]" 1
740 1 32 LEU H 1 69 ALA HA . . 5.320 4.634 4.462 4.774 . 0 0 "[ . 1 . 2]" 1
741 1 32 LEU H 1 70 VAL HB . . 4.340 4.297 4.091 4.343 0.003 9 0 "[ . 1 . 2]" 1
742 1 32 LEU H 1 70 VAL MG1 . . 4.600 4.375 4.105 4.519 . 0 0 "[ . 1 . 2]" 1
743 1 32 LEU H 1 71 THR HA . . 4.040 3.619 3.392 3.825 . 0 0 "[ . 1 . 2]" 1
744 1 32 LEU H 1 71 THR MG . . 4.240 3.903 3.638 4.185 . 0 0 "[ . 1 . 2]" 1
745 1 32 LEU HA 1 32 LEU MD1 . . 4.160 3.881 3.840 3.910 . 0 0 "[ . 1 . 2]" 1
746 1 32 LEU HA 1 32 LEU MD2 . . 3.580 2.069 1.973 2.228 . 0 0 "[ . 1 . 2]" 1
747 1 32 LEU HA 1 32 LEU HG . . 3.780 3.234 3.186 3.287 . 0 0 "[ . 1 . 2]" 1
748 1 32 LEU HA 1 33 SER H . . 2.800 2.170 2.158 2.205 . 0 0 "[ . 1 . 2]" 1
749 1 32 LEU HB2 1 32 LEU MD1 . . 3.260 2.346 2.204 2.428 . 0 0 "[ . 1 . 2]" 1
750 1 32 LEU HB2 1 33 SER H . . 4.070 4.057 3.943 4.072 0.002 14 0 "[ . 1 . 2]" 1
751 1 32 LEU HB2 1 70 VAL H . . 3.980 3.116 2.973 3.381 . 0 0 "[ . 1 . 2]" 1
752 1 32 LEU HB2 1 70 VAL HB . . 3.290 2.033 1.999 2.098 . 0 0 "[ . 1 . 2]" 1
753 1 32 LEU HB2 1 70 VAL MG1 . . 3.330 2.600 2.362 2.801 . 0 0 "[ . 1 . 2]" 1
754 1 32 LEU HB2 1 71 THR H . . 5.420 4.648 4.477 4.816 . 0 0 "[ . 1 . 2]" 1
755 1 32 LEU HB2 1 71 THR HA . . 5.500 4.016 3.837 4.209 . 0 0 "[ . 1 . 2]" 1
756 1 32 LEU HB3 1 32 LEU MD1 . . 3.380 2.306 2.221 2.433 . 0 0 "[ . 1 . 2]" 1
757 1 32 LEU HB3 1 32 LEU MD2 . . 3.270 2.349 2.285 2.425 . 0 0 "[ . 1 . 2]" 1
758 1 32 LEU HB3 1 33 SER H . . 3.660 3.153 2.992 3.227 . 0 0 "[ . 1 . 2]" 1
759 1 32 LEU HB3 1 34 VAL MG2 . . 3.940 3.788 3.653 3.895 . 0 0 "[ . 1 . 2]" 1
760 1 32 LEU HB3 1 70 VAL H . . 4.550 4.251 4.032 4.489 . 0 0 "[ . 1 . 2]" 1
761 1 32 LEU HB3 1 70 VAL HB . . 3.830 3.043 2.883 3.176 . 0 0 "[ . 1 . 2]" 1
762 1 32 LEU HB3 1 70 VAL MG1 . . 3.980 3.626 3.395 3.855 . 0 0 "[ . 1 . 2]" 1
763 1 32 LEU HB3 1 70 VAL MG2 . . 5.010 4.347 4.220 4.440 . 0 0 "[ . 1 . 2]" 1
764 1 32 LEU HB3 1 84 MET ME . . 3.890 3.647 3.439 3.892 0.002 7 0 "[ . 1 . 2]" 1
765 1 32 LEU MD1 1 46 LEU MD1 . . 3.350 3.189 2.582 3.355 0.005 5 0 "[ . 1 . 2]" 1
766 1 32 LEU MD1 1 46 LEU MD2 . . 3.220 2.339 2.093 2.628 . 0 0 "[ . 1 . 2]" 1
767 1 32 LEU MD1 1 70 VAL HB . . 3.560 2.954 2.625 3.224 . 0 0 "[ . 1 . 2]" 1
768 1 32 LEU MD1 1 70 VAL MG1 . . 3.320 1.942 1.864 2.055 . 0 0 "[ . 1 . 2]" 1
769 1 32 LEU MD1 1 72 TYR H . . 4.340 4.205 3.983 4.342 0.002 16 0 "[ . 1 . 2]" 1
770 1 32 LEU MD1 1 72 TYR QD . . 3.530 2.399 2.064 2.684 . 0 0 "[ . 1 . 2]" 1
771 1 32 LEU MD1 1 72 TYR QE . . 3.620 3.309 3.038 3.565 . 0 0 "[ . 1 . 2]" 1
772 1 32 LEU MD1 1 84 MET ME . . 3.100 2.984 2.721 3.104 0.004 15 0 "[ . 1 . 2]" 1
773 1 32 LEU MD1 1 94 PHE QE . . 4.400 3.536 3.380 3.707 . 0 0 "[ . 1 . 2]" 1
774 1 32 LEU MD1 1 94 PHE HZ . . 4.270 3.195 2.923 3.519 . 0 0 "[ . 1 . 2]" 1
775 1 32 LEU MD2 1 33 SER H . . 3.810 3.600 3.446 3.712 . 0 0 "[ . 1 . 2]" 1
776 1 32 LEU MD2 1 72 TYR QE . . 3.860 3.176 2.822 3.477 . 0 0 "[ . 1 . 2]" 1
777 1 32 LEU MD2 1 94 PHE QE . . 4.810 4.554 4.392 4.690 . 0 0 "[ . 1 . 2]" 1
778 1 32 LEU MD2 1 94 PHE HZ . . 4.280 4.000 3.778 4.193 . 0 0 "[ . 1 . 2]" 1
779 1 32 LEU HG 1 70 VAL HB . . 4.450 4.252 4.116 4.412 . 0 0 "[ . 1 . 2]" 1
780 1 32 LEU HG 1 70 VAL MG1 . . 3.460 3.375 3.196 3.458 . 0 0 "[ . 1 . 2]" 1
781 1 32 LEU HG 1 71 THR HA . . 5.500 3.344 3.163 3.472 . 0 0 "[ . 1 . 2]" 1
782 1 32 LEU HG 1 72 TYR QD . . 5.040 3.388 3.042 3.633 . 0 0 "[ . 1 . 2]" 1
783 1 32 LEU HG 1 72 TYR QE . . 4.340 3.972 3.674 4.293 . 0 0 "[ . 1 . 2]" 1
784 1 33 SER H 1 33 SER HB2 . . 3.710 2.728 2.448 3.712 0.002 13 0 "[ . 1 . 2]" 1
785 1 33 SER H 1 33 SER QB . . 3.160 2.549 2.410 3.090 . 0 0 "[ . 1 . 2]" 1
786 1 33 SER H 1 33 SER HB3 . . 3.710 3.354 2.806 3.713 0.003 18 0 "[ . 1 . 2]" 1
787 1 33 SER H 1 34 VAL H . . 4.580 4.335 4.273 4.425 . 0 0 "[ . 1 . 2]" 1
788 1 33 SER HA 1 34 VAL H . . 2.700 2.153 2.140 2.196 . 0 0 "[ . 1 . 2]" 1
789 1 33 SER HA 1 34 VAL HB . . 4.800 4.600 4.540 4.677 . 0 0 "[ . 1 . 2]" 1
790 1 33 SER HA 1 34 VAL MG2 . . 4.180 3.659 3.547 3.777 . 0 0 "[ . 1 . 2]" 1
791 1 33 SER HA 1 68 TYR H . . 4.450 4.321 4.128 4.451 0.001 7 0 "[ . 1 . 2]" 1
792 1 33 SER HA 1 68 TYR HB2 . . 5.500 5.063 4.791 5.319 . 0 0 "[ . 1 . 2]" 1
793 1 33 SER HA 1 69 ALA MB . . 4.890 4.441 4.169 4.779 . 0 0 "[ . 1 . 2]" 1
794 1 33 SER HA 1 70 VAL H . . 4.430 3.430 3.224 3.662 . 0 0 "[ . 1 . 2]" 1
795 1 33 SER HA 1 70 VAL HB . . 5.300 4.826 4.470 5.086 . 0 0 "[ . 1 . 2]" 1
796 1 33 SER QB 1 34 VAL H . . 3.740 3.397 2.966 3.742 0.002 17 0 "[ . 1 . 2]" 1
797 1 33 SER HB2 1 34 VAL H . . 4.490 4.260 3.075 4.453 . 0 0 "[ . 1 . 2]" 1
798 1 33 SER HB3 1 34 VAL H . . 4.490 3.645 3.258 4.083 . 0 0 "[ . 1 . 2]" 1
799 1 34 VAL H 1 34 VAL HB . . 3.460 2.592 2.514 2.672 . 0 0 "[ . 1 . 2]" 1
800 1 34 VAL H 1 34 VAL MG1 . . 4.100 3.830 3.795 3.868 . 0 0 "[ . 1 . 2]" 1
801 1 34 VAL H 1 34 VAL MG2 . . 3.300 2.717 2.477 2.858 . 0 0 "[ . 1 . 2]" 1
802 1 34 VAL H 1 35 ASP H . . 4.940 4.253 4.127 4.468 . 0 0 "[ . 1 . 2]" 1
803 1 34 VAL H 1 67 THR HA . . 4.750 4.636 4.462 4.749 . 0 0 "[ . 1 . 2]" 1
804 1 34 VAL H 1 67 THR HB . . 4.500 3.692 2.928 4.121 . 0 0 "[ . 1 . 2]" 1
805 1 34 VAL H 1 67 THR MG . . 4.960 4.435 3.879 4.844 . 0 0 "[ . 1 . 2]" 1
806 1 34 VAL H 1 68 TYR H . . 3.570 2.664 2.531 2.805 . 0 0 "[ . 1 . 2]" 1
807 1 34 VAL H 1 68 TYR HB2 . . 4.280 3.446 3.233 3.671 . 0 0 "[ . 1 . 2]" 1
808 1 34 VAL H 1 68 TYR HB3 . . 4.890 4.710 4.446 4.879 . 0 0 "[ . 1 . 2]" 1
809 1 34 VAL H 1 68 TYR QD . . 4.830 4.543 4.376 4.740 . 0 0 "[ . 1 . 2]" 1
810 1 34 VAL H 1 69 ALA HA . . 5.010 4.073 3.871 4.402 . 0 0 "[ . 1 . 2]" 1
811 1 34 VAL H 1 69 ALA MB . . 5.500 5.224 5.048 5.502 0.002 3 0 "[ . 1 . 2]" 1
812 1 34 VAL H 1 70 VAL H . . 4.780 4.242 4.028 4.510 . 0 0 "[ . 1 . 2]" 1
813 1 34 VAL HA 1 34 VAL MG1 . . 3.640 2.382 2.263 2.471 . 0 0 "[ . 1 . 2]" 1
814 1 34 VAL HA 1 35 ASP H . . 3.200 2.151 2.139 2.172 . 0 0 "[ . 1 . 2]" 1
815 1 34 VAL HB 1 44 LEU MD2 . . 3.820 2.884 2.669 3.218 . 0 0 "[ . 1 . 2]" 1
816 1 34 VAL HB 1 68 TYR H . . 4.080 2.868 2.450 3.157 . 0 0 "[ . 1 . 2]" 1
817 1 34 VAL HB 1 68 TYR HB2 . . 3.610 2.081 2.000 2.221 . 0 0 "[ . 1 . 2]" 1
818 1 34 VAL HB 1 68 TYR HB3 . . 4.020 3.797 3.679 3.945 . 0 0 "[ . 1 . 2]" 1
819 1 34 VAL HB 1 68 TYR QD . . 4.070 2.869 2.603 3.270 . 0 0 "[ . 1 . 2]" 1
820 1 34 VAL HB 1 68 TYR QE . . 5.390 5.010 4.816 5.220 . 0 0 "[ . 1 . 2]" 1
821 1 34 VAL HB 1 70 VAL MG2 . . 4.170 4.110 3.890 4.172 0.002 13 0 "[ . 1 . 2]" 1
822 1 34 VAL MG1 1 35 ASP H . . 3.530 2.836 2.181 3.099 . 0 0 "[ . 1 . 2]" 1
823 1 34 VAL MG1 1 36 CYS H . . 4.800 3.762 3.455 4.086 . 0 0 "[ . 1 . 2]" 1
824 1 34 VAL MG1 1 44 LEU MD2 . . 3.110 2.574 2.103 2.884 . 0 0 "[ . 1 . 2]" 1
825 1 34 VAL MG1 1 68 TYR H . . 4.460 3.969 3.731 4.182 . 0 0 "[ . 1 . 2]" 1
826 1 34 VAL MG1 1 68 TYR HB2 . . 3.680 3.436 3.343 3.570 . 0 0 "[ . 1 . 2]" 1
827 1 34 VAL MG1 1 68 TYR QD . . 3.770 2.993 2.507 3.407 . 0 0 "[ . 1 . 2]" 1
828 1 34 VAL MG1 1 68 TYR QE . . 4.330 4.157 3.652 4.332 0.002 9 0 "[ . 1 . 2]" 1
829 1 34 VAL MG2 1 44 LEU MD2 . . 3.490 2.221 1.993 2.460 . 0 0 "[ . 1 . 2]" 1
830 1 34 VAL MG2 1 68 TYR H . . 4.880 4.169 3.766 4.393 . 0 0 "[ . 1 . 2]" 1
831 1 34 VAL MG2 1 68 TYR HB2 . . 4.280 2.938 2.748 3.120 . 0 0 "[ . 1 . 2]" 1
832 1 34 VAL MG2 1 68 TYR HB3 . . 4.160 3.959 3.772 4.116 . 0 0 "[ . 1 . 2]" 1
833 1 34 VAL MG2 1 70 VAL H . . 4.290 3.978 3.613 4.288 . 0 0 "[ . 1 . 2]" 1
834 1 34 VAL MG2 1 84 MET ME . . 2.570 2.250 1.925 2.568 . 0 0 "[ . 1 . 2]" 1
835 1 35 ASP H 1 35 ASP HB2 . . 3.800 2.578 2.245 2.971 . 0 0 "[ . 1 . 2]" 1
836 1 35 ASP H 1 35 ASP QB . . 3.310 2.355 2.221 2.501 . 0 0 "[ . 1 . 2]" 1
837 1 35 ASP H 1 35 ASP HB3 . . 3.800 2.933 2.477 3.655 . 0 0 "[ . 1 . 2]" 1
838 1 35 ASP H 1 36 CYS H . . 4.620 4.257 4.044 4.409 . 0 0 "[ . 1 . 2]" 1
839 1 35 ASP HA 1 36 CYS H . . 3.150 2.159 2.139 2.204 . 0 0 "[ . 1 . 2]" 1
840 1 35 ASP HA 1 67 THR HA . . 4.300 3.016 2.736 3.231 . 0 0 "[ . 1 . 2]" 1
841 1 35 ASP HA 1 67 THR HB . . 5.160 3.785 3.181 4.223 . 0 0 "[ . 1 . 2]" 1
842 1 35 ASP HA 1 67 THR MG . . 3.810 2.008 1.836 2.185 . 0 0 "[ . 1 . 2]" 1
843 1 35 ASP HA 1 68 TYR H . . 4.360 4.237 4.090 4.362 0.002 5 0 "[ . 1 . 2]" 1
844 1 35 ASP QB 1 67 THR MG . . 3.470 3.113 2.712 3.425 . 0 0 "[ . 1 . 2]" 1
845 1 35 ASP HB2 1 36 CYS H . . 4.640 4.505 4.393 4.568 . 0 0 "[ . 1 . 2]" 1
846 1 35 ASP HB2 1 67 THR MG . . 4.290 3.380 2.768 4.269 . 0 0 "[ . 1 . 2]" 1
847 1 35 ASP HB3 1 36 CYS H . . 4.640 4.134 3.565 4.430 . 0 0 "[ . 1 . 2]" 1
848 1 35 ASP HB3 1 67 THR MG . . 4.290 3.987 3.415 4.293 0.003 20 0 "[ . 1 . 2]" 1
849 1 36 CYS H 1 36 CYS QB . . 3.520 2.520 2.272 2.808 . 0 0 "[ . 1 . 2]" 1
850 1 36 CYS H 1 67 THR HA . . 3.660 3.043 2.534 3.493 . 0 0 "[ . 1 . 2]" 1
851 1 36 CYS H 1 67 THR HB . . 5.210 4.980 4.635 5.210 . 10 0 "[ . 1 . 2]" 1
852 1 36 CYS H 1 67 THR MG . . 3.890 3.065 2.755 3.354 . 0 0 "[ . 1 . 2]" 1
853 1 36 CYS H 1 68 TYR QD . . 4.530 4.208 3.561 4.390 . 0 0 "[ . 1 . 2]" 1
854 1 36 CYS H 1 68 TYR QE . . 4.990 4.506 3.887 4.873 . 0 0 "[ . 1 . 2]" 1
855 1 36 CYS HA 1 38 GLU H . . 4.970 4.421 4.072 4.708 . 0 0 "[ . 1 . 2]" 1
856 1 36 CYS HA 1 39 ALA H . . 4.550 3.920 3.598 4.280 . 0 0 "[ . 1 . 2]" 1
857 1 36 CYS HA 1 39 ALA MB . . 3.680 3.059 2.784 3.481 . 0 0 "[ . 1 . 2]" 1
858 1 36 CYS QB 1 37 SER H . . 4.440 3.406 2.793 3.874 . 0 0 "[ . 1 . 2]" 1
859 1 36 CYS QB 1 39 ALA H . . 4.430 3.772 3.217 4.425 . 0 0 "[ . 1 . 2]" 1
860 1 36 CYS QB 1 39 ALA MB . . 3.840 2.499 2.018 3.031 . 0 0 "[ . 1 . 2]" 1
861 1 36 CYS QB 1 68 TYR QD . . 4.470 3.686 3.148 4.148 . 0 0 "[ . 1 . 2]" 1
862 1 36 CYS QB 1 68 TYR QE . . 3.670 2.974 1.983 3.300 . 0 0 "[ . 1 . 2]" 1
863 1 36 CYS QB 1 86 TYR QE . . 4.520 3.718 3.275 4.271 . 0 0 "[ . 1 . 2]" 1
864 1 37 SER H 1 37 SER HB2 . . 3.660 2.764 2.333 3.682 0.022 14 0 "[ . 1 . 2]" 1
865 1 37 SER H 1 37 SER QB . . 3.040 2.544 2.302 3.076 0.036 14 0 "[ . 1 . 2]" 1
866 1 37 SER H 1 37 SER HB3 . . 3.660 3.375 2.656 3.665 0.005 5 0 "[ . 1 . 2]" 1
867 1 37 SER H 1 38 GLU H . . 3.640 2.416 2.141 2.673 . 0 0 "[ . 1 . 2]" 1
868 1 37 SER H 1 39 ALA H . . 4.750 2.804 2.542 3.135 . 0 0 "[ . 1 . 2]" 1
869 1 37 SER HB2 1 38 GLU H . . 4.000 2.712 2.170 3.501 . 0 0 "[ . 1 . 2]" 1
870 1 37 SER HB3 1 38 GLU H . . 4.000 2.877 1.920 3.900 . 0 0 "[ . 1 . 2]" 1
871 1 38 GLU H 1 38 GLU HB2 . . 3.650 2.420 2.259 2.489 . 0 0 "[ . 1 . 2]" 1
872 1 38 GLU H 1 38 GLU QB . . 3.150 2.385 2.234 2.450 . 0 0 "[ . 1 . 2]" 1
873 1 38 GLU H 1 38 GLU HB3 . . 3.650 3.603 3.537 3.657 0.007 8 0 "[ . 1 . 2]" 1
874 1 38 GLU H 1 38 GLU QG . . 3.510 3.289 2.974 3.447 . 0 0 "[ . 1 . 2]" 1
875 1 38 GLU H 1 39 ALA H . . 3.060 2.342 2.109 2.459 . 0 0 "[ . 1 . 2]" 1
876 1 38 GLU H 1 39 ALA HA . . 5.420 4.420 4.290 4.744 . 0 0 "[ . 1 . 2]" 1
877 1 38 GLU H 1 39 ALA MB . . 4.250 3.814 3.677 3.943 . 0 0 "[ . 1 . 2]" 1
878 1 38 GLU H 1 40 GLY H . . 4.550 4.497 4.332 4.558 0.008 14 0 "[ . 1 . 2]" 1
879 1 38 GLU HA 1 38 GLU QG . . 3.730 2.520 2.166 2.842 . 0 0 "[ . 1 . 2]" 1
880 1 38 GLU HA 1 40 GLY H . . 4.460 3.121 2.917 4.193 . 0 0 "[ . 1 . 2]" 1
881 1 38 GLU QB 1 39 ALA H . . 4.020 3.606 3.112 3.738 . 0 0 "[ . 1 . 2]" 1
882 1 38 GLU HB2 1 39 ALA H . . 4.600 3.915 3.284 4.111 . 0 0 "[ . 1 . 2]" 1
883 1 38 GLU HB3 1 39 ALA H . . 4.600 4.226 3.858 4.329 . 0 0 "[ . 1 . 2]" 1
884 1 39 ALA H 1 39 ALA MB . . 3.000 2.122 2.027 2.250 . 0 0 "[ . 1 . 2]" 1
885 1 39 ALA H 1 40 GLY H . . 3.110 2.677 2.562 2.934 . 0 0 "[ . 1 . 2]" 1
886 1 39 ALA H 1 40 GLY HA2 . . 5.210 4.937 4.793 5.149 . 0 0 "[ . 1 . 2]" 1
887 1 39 ALA MB 1 40 GLY H . . 3.800 3.121 2.464 3.344 . 0 0 "[ . 1 . 2]" 1
888 1 39 ALA MB 1 86 TYR QD . . 4.200 3.448 3.264 3.654 . 0 0 "[ . 1 . 2]" 1
889 1 39 ALA MB 1 86 TYR QE . . 3.580 2.632 2.406 2.904 . 0 0 "[ . 1 . 2]" 1
890 1 40 GLY H 1 41 PRO HD2 . . 5.370 4.758 4.697 4.801 . 0 0 "[ . 1 . 2]" 1
891 1 40 GLY H 1 41 PRO QD . . 4.510 4.350 4.315 4.380 . 0 0 "[ . 1 . 2]" 1
892 1 40 GLY H 1 41 PRO HD3 . . 5.370 5.034 5.014 5.062 . 0 0 "[ . 1 . 2]" 1
893 1 40 GLY HA2 1 41 PRO QD . . 3.110 2.668 2.626 2.713 . 0 0 "[ . 1 . 2]" 1
894 1 40 GLY HA2 1 41 PRO HG2 . . 5.300 5.164 5.124 5.207 . 0 0 "[ . 1 . 2]" 1
895 1 40 GLY HA2 1 41 PRO HG3 . . 5.300 5.100 5.054 5.150 . 0 0 "[ . 1 . 2]" 1
896 1 40 GLY HA3 1 41 PRO HD2 . . 3.640 1.988 1.965 2.012 . 0 0 "[ . 1 . 2]" 1
897 1 40 GLY HA3 1 41 PRO QD . . 3.100 1.945 1.921 1.970 . 0 0 "[ . 1 . 2]" 1
898 1 40 GLY HA3 1 41 PRO HD3 . . 3.640 2.759 2.709 2.804 . 0 0 "[ . 1 . 2]" 1
899 1 40 GLY HA3 1 41 PRO HG2 . . 4.920 4.152 4.138 4.166 . 0 0 "[ . 1 . 2]" 1
900 1 40 GLY HA3 1 41 PRO QG . . 4.110 3.846 3.827 3.865 . 0 0 "[ . 1 . 2]" 1
901 1 40 GLY HA3 1 41 PRO HG3 . . 4.920 4.545 4.510 4.578 . 0 0 "[ . 1 . 2]" 1
902 1 41 PRO HA 1 42 GLY H . . 2.930 2.659 2.558 2.730 . 0 0 "[ . 1 . 2]" 1
903 1 41 PRO HB2 1 42 GLY H . . 3.640 2.043 1.899 2.254 . 0 0 "[ . 1 . 2]" 1
904 1 41 PRO HB3 1 42 GLY H . . 3.640 3.201 3.147 3.286 . 0 0 "[ . 1 . 2]" 1
905 1 41 PRO QG 1 42 GLY H . . 4.220 3.725 3.595 3.903 . 0 0 "[ . 1 . 2]" 1
906 1 41 PRO HG2 1 42 GLY H . . 4.820 3.925 3.777 4.127 . 0 0 "[ . 1 . 2]" 1
907 1 41 PRO HG3 1 42 GLY H . . 4.820 4.635 4.507 4.814 . 0 0 "[ . 1 . 2]" 1
908 1 42 GLY H 1 43 ALA H . . 4.580 4.230 4.041 4.426 . 0 0 "[ . 1 . 2]" 1
909 1 42 GLY H 1 86 TYR QE . . 5.240 4.996 4.850 5.155 . 0 0 "[ . 1 . 2]" 1
910 1 42 GLY QA 1 43 ALA H . . 2.990 2.209 2.149 2.280 . 0 0 "[ . 1 . 2]" 1
911 1 42 GLY QA 1 43 ALA MB . . 4.120 3.726 3.645 3.781 . 0 0 "[ . 1 . 2]" 1
912 1 42 GLY QA 1 86 TYR QD . . 4.870 3.825 3.671 4.014 . 0 0 "[ . 1 . 2]" 1
913 1 42 GLY QA 1 86 TYR QE . . 4.410 3.416 3.220 3.536 . 0 0 "[ . 1 . 2]" 1
914 1 42 GLY QA 1 87 GLY H . . 4.040 3.644 3.350 3.857 . 0 0 "[ . 1 . 2]" 1
915 1 42 GLY HA2 1 43 ALA H . . 3.470 2.308 2.198 2.508 . 0 0 "[ . 1 . 2]" 1
916 1 42 GLY HA2 1 43 ALA MB . . 4.940 3.927 3.860 3.975 . 0 0 "[ . 1 . 2]" 1
917 1 42 GLY HA2 1 86 TYR QE . . 5.080 5.050 4.879 5.083 0.003 10 0 "[ . 1 . 2]" 1
918 1 42 GLY HA2 1 87 GLY H . . 4.750 4.530 4.217 4.746 . 0 0 "[ . 1 . 2]" 1
919 1 42 GLY HA2 1 87 GLY HA2 . . 4.990 3.098 2.788 3.330 . 0 0 "[ . 1 . 2]" 1
920 1 42 GLY HA2 1 87 GLY HA3 . . 5.110 3.710 3.425 3.964 . 0 0 "[ . 1 . 2]" 1
921 1 42 GLY HA3 1 43 ALA H . . 3.470 2.867 2.618 3.037 . 0 0 "[ . 1 . 2]" 1
922 1 42 GLY HA3 1 43 ALA MB . . 4.940 4.634 4.479 4.734 . 0 0 "[ . 1 . 2]" 1
923 1 42 GLY HA3 1 86 TYR QE . . 5.080 3.474 3.267 3.609 . 0 0 "[ . 1 . 2]" 1
924 1 42 GLY HA3 1 87 GLY H . . 4.750 3.842 3.516 4.082 . 0 0 "[ . 1 . 2]" 1
925 1 42 GLY HA3 1 87 GLY HA2 . . 4.990 2.999 2.750 3.309 . 0 0 "[ . 1 . 2]" 1
926 1 42 GLY HA3 1 87 GLY HA3 . . 5.110 2.875 2.634 3.150 . 0 0 "[ . 1 . 2]" 1
927 1 43 ALA H 1 43 ALA MB . . 3.240 2.348 2.215 2.522 . 0 0 "[ . 1 . 2]" 1
928 1 43 ALA H 1 44 LEU H . . 4.790 4.511 4.382 4.591 . 0 0 "[ . 1 . 2]" 1
929 1 43 ALA H 1 87 GLY H . . 3.870 3.108 2.622 3.578 . 0 0 "[ . 1 . 2]" 1
930 1 43 ALA H 1 87 GLY HA2 . . 4.080 2.488 2.238 2.977 . 0 0 "[ . 1 . 2]" 1
931 1 43 ALA H 1 87 GLY HA3 . . 4.500 3.830 3.514 4.245 . 0 0 "[ . 1 . 2]" 1
932 1 43 ALA HA 1 44 LEU H . . 3.060 2.219 2.172 2.312 . 0 0 "[ . 1 . 2]" 1
933 1 43 ALA MB 1 44 LEU H . . 2.990 2.848 2.576 2.991 0.001 4 0 "[ . 1 . 2]" 1
934 1 43 ALA MB 1 87 GLY H . . 4.170 4.001 3.750 4.168 . 0 0 "[ . 1 . 2]" 1
935 1 43 ALA MB 1 87 GLY HA2 . . 4.640 4.047 3.576 4.243 . 0 0 "[ . 1 . 2]" 1
936 1 44 LEU H 1 44 LEU HB2 . . 3.390 2.971 2.784 3.168 . 0 0 "[ . 1 . 2]" 1
937 1 44 LEU H 1 44 LEU HB3 . . 3.010 2.319 2.239 2.455 . 0 0 "[ . 1 . 2]" 1
938 1 44 LEU H 1 44 LEU MD2 . . 4.420 4.188 4.038 4.286 . 0 0 "[ . 1 . 2]" 1
939 1 44 LEU H 1 44 LEU HG . . 4.980 4.247 4.113 4.414 . 0 0 "[ . 1 . 2]" 1
940 1 44 LEU H 1 45 GLY H . . 4.710 4.558 4.473 4.586 . 0 0 "[ . 1 . 2]" 1
941 1 44 LEU H 1 68 TYR QE . . 4.770 4.512 4.118 4.767 . 0 0 "[ . 1 . 2]" 1
942 1 44 LEU H 1 86 TYR QD . . 5.150 4.623 4.048 4.955 . 0 0 "[ . 1 . 2]" 1
943 1 44 LEU H 1 86 TYR QE . . 4.730 4.239 3.439 4.666 . 0 0 "[ . 1 . 2]" 1
944 1 44 LEU HA 1 44 LEU MD1 . . 3.340 2.291 1.986 2.610 . 0 0 "[ . 1 . 2]" 1
945 1 44 LEU HA 1 44 LEU MD2 . . 4.470 3.957 3.898 4.017 . 0 0 "[ . 1 . 2]" 1
946 1 44 LEU HA 1 44 LEU HG . . 4.250 3.269 3.056 3.438 . 0 0 "[ . 1 . 2]" 1
947 1 44 LEU HA 1 45 GLY H . . 2.880 2.235 2.176 2.276 . 0 0 "[ . 1 . 2]" 1
948 1 44 LEU HA 1 45 GLY HA2 . . 5.020 4.464 4.427 4.502 . 0 0 "[ . 1 . 2]" 1
949 1 44 LEU HA 1 45 GLY HA3 . . 4.810 4.315 4.305 4.335 . 0 0 "[ . 1 . 2]" 1
950 1 44 LEU HA 1 86 TYR HA . . 3.800 2.493 2.319 2.651 . 0 0 "[ . 1 . 2]" 1
951 1 44 LEU HA 1 86 TYR QD . . 3.800 2.945 2.143 3.152 . 0 0 "[ . 1 . 2]" 1
952 1 44 LEU HA 1 87 GLY H . . 4.220 3.520 3.285 3.725 . 0 0 "[ . 1 . 2]" 1
953 1 44 LEU HB2 1 44 LEU MD2 . . 3.100 2.454 2.312 2.639 . 0 0 "[ . 1 . 2]" 1
954 1 44 LEU HB2 1 45 GLY H . . 4.170 3.888 3.754 4.038 . 0 0 "[ . 1 . 2]" 1
955 1 44 LEU HB2 1 68 TYR QD . . 5.500 4.651 4.290 5.152 . 0 0 "[ . 1 . 2]" 1
956 1 44 LEU HB2 1 68 TYR QE . . 5.500 4.600 4.083 5.095 . 0 0 "[ . 1 . 2]" 1
957 1 44 LEU HB2 1 86 TYR QD . . 4.090 2.240 1.999 2.797 . 0 0 "[ . 1 . 2]" 1
958 1 44 LEU HB2 1 86 TYR QE . . 4.440 2.389 2.139 2.760 . 0 0 "[ . 1 . 2]" 1
959 1 44 LEU HB3 1 44 LEU MD1 . . 3.370 3.177 3.143 3.192 . 0 0 "[ . 1 . 2]" 1
960 1 44 LEU HB3 1 44 LEU MD2 . . 3.170 2.207 2.072 2.379 . 0 0 "[ . 1 . 2]" 1
961 1 44 LEU HB3 1 45 GLY H . . 4.780 4.095 3.891 4.287 . 0 0 "[ . 1 . 2]" 1
962 1 44 LEU HB3 1 60 ILE MG . . 3.830 3.372 2.978 3.763 . 0 0 "[ . 1 . 2]" 1
963 1 44 LEU HB3 1 68 TYR QD . . 5.150 3.963 3.698 4.371 . 0 0 "[ . 1 . 2]" 1
964 1 44 LEU HB3 1 68 TYR QE . . 4.580 4.036 3.676 4.268 . 0 0 "[ . 1 . 2]" 1
965 1 44 LEU HB3 1 86 TYR QD . . 4.530 3.954 3.749 4.426 . 0 0 "[ . 1 . 2]" 1
966 1 44 LEU HB3 1 86 TYR QE . . 4.410 3.646 3.260 4.296 . 0 0 "[ . 1 . 2]" 1
967 1 44 LEU MD1 1 45 GLY H . . 3.360 2.025 1.852 2.397 . 0 0 "[ . 1 . 2]" 1
968 1 44 LEU MD1 1 46 LEU HB2 . . 4.450 3.856 3.304 4.451 0.001 1 0 "[ . 1 . 2]" 1
969 1 44 LEU MD1 1 84 MET ME . . 3.300 2.684 2.251 3.297 . 0 0 "[ . 1 . 2]" 1
970 1 44 LEU MD1 1 84 MET HG2 . . 3.520 2.483 2.132 3.022 . 0 0 "[ . 1 . 2]" 1
971 1 44 LEU MD1 1 84 MET HG3 . . 3.520 2.230 1.963 2.686 . 0 0 "[ . 1 . 2]" 1
972 1 44 LEU MD1 1 85 LYS H . . 3.900 3.499 3.121 3.773 . 0 0 "[ . 1 . 2]" 1
973 1 44 LEU MD1 1 86 TYR HA . . 4.020 3.212 2.747 3.478 . 0 0 "[ . 1 . 2]" 1
974 1 44 LEU MD1 1 86 TYR HB2 . . 3.940 3.107 2.509 3.697 . 0 0 "[ . 1 . 2]" 1
975 1 44 LEU MD1 1 86 TYR QD . . 3.430 2.055 1.816 2.572 . 0 0 "[ . 1 . 2]" 1
976 1 44 LEU MD1 1 86 TYR QE . . 3.950 3.615 3.305 3.948 . 0 0 "[ . 1 . 2]" 1
977 1 44 LEU MD1 1 87 GLY H . . 5.170 4.838 4.460 5.108 . 0 0 "[ . 1 . 2]" 1
978 1 44 LEU MD2 1 45 GLY H . . 4.490 4.182 3.964 4.447 . 0 0 "[ . 1 . 2]" 1
979 1 44 LEU MD2 1 45 GLY HA2 . . 5.110 4.668 4.399 4.921 . 0 0 "[ . 1 . 2]" 1
980 1 44 LEU MD2 1 60 ILE MG . . 3.180 2.385 2.115 2.902 . 0 0 "[ . 1 . 2]" 1
981 1 44 LEU MD2 1 68 TYR HB2 . . 3.880 2.484 2.193 2.900 . 0 0 "[ . 1 . 2]" 1
982 1 44 LEU MD2 1 68 TYR HB3 . . 4.030 2.604 2.151 3.081 . 0 0 "[ . 1 . 2]" 1
983 1 44 LEU MD2 1 68 TYR QD . . 3.820 2.905 2.594 3.146 . 0 0 "[ . 1 . 2]" 1
984 1 44 LEU MD2 1 68 TYR QE . . 4.160 3.866 3.447 4.035 . 0 0 "[ . 1 . 2]" 1
985 1 44 LEU MD2 1 70 VAL HB . . 4.810 4.419 4.105 4.718 . 0 0 "[ . 1 . 2]" 1
986 1 44 LEU MD2 1 70 VAL MG2 . . 3.090 2.305 2.016 2.618 . 0 0 "[ . 1 . 2]" 1
987 1 44 LEU MD2 1 84 MET ME . . 3.940 3.155 2.763 3.911 . 0 0 "[ . 1 . 2]" 1
988 1 44 LEU MD2 1 86 TYR HA . . 5.500 5.437 5.273 5.505 0.005 11 0 "[ . 1 . 2]" 1
989 1 44 LEU MD2 1 86 TYR QD . . 4.620 3.511 3.253 3.825 . 0 0 "[ . 1 . 2]" 1
990 1 44 LEU MD2 1 86 TYR QE . . 4.920 3.478 3.068 3.952 . 0 0 "[ . 1 . 2]" 1
991 1 44 LEU HG 1 45 GLY H . . 3.450 2.797 2.319 3.261 . 0 0 "[ . 1 . 2]" 1
992 1 44 LEU HG 1 45 GLY HA2 . . 4.790 3.276 3.097 3.475 . 0 0 "[ . 1 . 2]" 1
993 1 44 LEU HG 1 45 GLY HA3 . . 4.610 4.381 4.155 4.609 . 0 0 "[ . 1 . 2]" 1
994 1 44 LEU HG 1 46 LEU H . . 5.080 4.426 4.120 4.867 . 0 0 "[ . 1 . 2]" 1
995 1 44 LEU HG 1 60 ILE MD . . 3.560 2.667 2.229 3.235 . 0 0 "[ . 1 . 2]" 1
996 1 44 LEU HG 1 60 ILE HG12 . . 5.430 3.751 3.282 4.004 . 0 0 "[ . 1 . 2]" 1
997 1 44 LEU HG 1 60 ILE HG13 . . 5.430 5.127 4.804 5.407 . 0 0 "[ . 1 . 2]" 1
998 1 44 LEU HG 1 60 ILE MG . . 4.020 3.203 2.367 3.782 . 0 0 "[ . 1 . 2]" 1
999 1 44 LEU HG 1 70 VAL MG2 . . 3.890 3.517 3.225 3.877 . 0 0 "[ . 1 . 2]" 1
1000 1 44 LEU HG 1 86 TYR QD . . 4.990 4.431 4.139 4.596 . 0 0 "[ . 1 . 2]" 1
1001 1 45 GLY H 1 46 LEU H . . 4.340 4.218 4.118 4.347 0.007 9 0 "[ . 1 . 2]" 1
1002 1 45 GLY H 1 46 LEU HA . . 4.980 4.672 4.600 4.750 . 0 0 "[ . 1 . 2]" 1
1003 1 45 GLY H 1 60 ILE MD . . 4.790 3.884 3.520 4.238 . 0 0 "[ . 1 . 2]" 1
1004 1 45 GLY H 1 84 MET HA . . 5.500 4.507 4.243 4.817 . 0 0 "[ . 1 . 2]" 1
1005 1 45 GLY H 1 84 MET HG2 . . 4.990 4.152 3.749 4.993 0.003 15 0 "[ . 1 . 2]" 1
1006 1 45 GLY H 1 84 MET QG . . 4.360 3.378 2.819 3.755 . 0 0 "[ . 1 . 2]" 1
1007 1 45 GLY H 1 84 MET HG3 . . 4.990 3.630 2.906 4.000 . 0 0 "[ . 1 . 2]" 1
1008 1 45 GLY H 1 85 LYS H . . 3.610 3.182 2.893 3.399 . 0 0 "[ . 1 . 2]" 1
1009 1 45 GLY H 1 85 LYS HB2 . . 4.930 4.623 4.295 4.862 . 0 0 "[ . 1 . 2]" 1
1010 1 45 GLY H 1 86 TYR HA . . 3.950 3.661 3.464 3.870 . 0 0 "[ . 1 . 2]" 1
1011 1 45 GLY H 1 86 TYR QD . . 4.430 4.350 3.844 4.437 0.007 15 0 "[ . 1 . 2]" 1
1012 1 45 GLY HA2 1 46 LEU H . . 2.850 2.178 2.140 2.261 . 0 0 "[ . 1 . 2]" 1
1013 1 45 GLY HA2 1 60 ILE MD . . 3.490 2.008 1.846 2.302 . 0 0 "[ . 1 . 2]" 1
1014 1 45 GLY HA3 1 46 LEU H . . 3.220 3.098 2.926 3.220 . 0 0 "[ . 1 . 2]" 1
1015 1 45 GLY HA3 1 60 ILE MD . . 3.840 3.438 3.247 3.788 . 0 0 "[ . 1 . 2]" 1
1016 1 46 LEU H 1 46 LEU HB2 . . 3.750 3.083 2.911 3.238 . 0 0 "[ . 1 . 2]" 1
1017 1 46 LEU H 1 46 LEU HB3 . . 3.510 2.586 2.478 2.722 . 0 0 "[ . 1 . 2]" 1
1018 1 46 LEU H 1 46 LEU MD1 . . 4.710 4.431 4.314 4.520 . 0 0 "[ . 1 . 2]" 1
1019 1 46 LEU H 1 46 LEU MD2 . . 4.490 4.325 4.195 4.435 . 0 0 "[ . 1 . 2]" 1
1020 1 46 LEU H 1 46 LEU HG . . 5.450 4.430 4.306 4.496 . 0 0 "[ . 1 . 2]" 1
1021 1 46 LEU H 1 47 GLU H . . 4.540 4.472 4.409 4.520 . 0 0 "[ . 1 . 2]" 1
1022 1 46 LEU H 1 58 VAL MG1 . . 4.080 3.479 3.150 3.762 . 0 0 "[ . 1 . 2]" 1
1023 1 46 LEU H 1 60 ILE MD . . 3.310 2.339 1.874 2.725 . 0 0 "[ . 1 . 2]" 1
1024 1 46 LEU HA 1 46 LEU MD1 . . 3.550 2.402 2.122 2.675 . 0 0 "[ . 1 . 2]" 1
1025 1 46 LEU HA 1 46 LEU MD2 . . 4.620 3.947 3.922 3.990 . 0 0 "[ . 1 . 2]" 1
1026 1 46 LEU HA 1 47 GLU H . . 3.040 2.277 2.214 2.346 . 0 0 "[ . 1 . 2]" 1
1027 1 46 LEU HA 1 47 GLU HB3 . . 5.180 4.600 4.379 4.931 . 0 0 "[ . 1 . 2]" 1
1028 1 46 LEU HA 1 83 THR MG . . 5.500 4.709 4.464 5.125 . 0 0 "[ . 1 . 2]" 1
1029 1 46 LEU HA 1 85 LYS H . . 5.420 3.483 3.209 3.618 . 0 0 "[ . 1 . 2]" 1
1030 1 46 LEU HB2 1 46 LEU MD1 . . 3.330 2.168 2.000 2.296 . 0 0 "[ . 1 . 2]" 1
1031 1 46 LEU HB2 1 46 LEU MD2 . . 3.440 2.603 2.525 2.689 . 0 0 "[ . 1 . 2]" 1
1032 1 46 LEU HB2 1 47 GLU H . . 4.080 3.937 3.831 4.072 . 0 0 "[ . 1 . 2]" 1
1033 1 46 LEU HB2 1 60 ILE MD . . 4.790 3.993 3.474 4.508 . 0 0 "[ . 1 . 2]" 1
1034 1 46 LEU HB2 1 60 ILE QG . . 5.340 4.346 3.939 4.727 . 0 0 "[ . 1 . 2]" 1
1035 1 46 LEU HB2 1 70 VAL MG1 . . 4.260 2.971 2.688 3.567 . 0 0 "[ . 1 . 2]" 1
1036 1 46 LEU HB2 1 84 MET ME . . 3.790 2.757 2.176 3.789 . 0 0 "[ . 1 . 2]" 1
1037 1 46 LEU HB2 1 84 MET HG2 . . 4.790 4.624 4.356 4.818 0.028 15 0 "[ . 1 . 2]" 1
1038 1 46 LEU HB2 1 84 MET QG . . 4.110 3.092 2.590 4.118 0.008 12 0 "[ . 1 . 2]" 1
1039 1 46 LEU HB2 1 84 MET HG3 . . 4.790 3.178 2.610 4.476 . 0 0 "[ . 1 . 2]" 1
1040 1 46 LEU HB3 1 46 LEU MD1 . . 3.260 3.146 3.104 3.176 . 0 0 "[ . 1 . 2]" 1
1041 1 46 LEU HB3 1 46 LEU MD2 . . 3.230 2.083 1.965 2.207 . 0 0 "[ . 1 . 2]" 1
1042 1 46 LEU HB3 1 47 GLU H . . 4.340 3.882 3.726 4.024 . 0 0 "[ . 1 . 2]" 1
1043 1 46 LEU HB3 1 58 VAL MG1 . . 3.280 2.224 2.019 2.696 . 0 0 "[ . 1 . 2]" 1
1044 1 46 LEU HB3 1 60 ILE MD . . 3.960 3.594 3.126 3.903 . 0 0 "[ . 1 . 2]" 1
1045 1 46 LEU HB3 1 70 VAL MG1 . . 3.290 2.869 2.608 3.108 . 0 0 "[ . 1 . 2]" 1
1046 1 46 LEU MD1 1 47 GLU H . . 3.310 2.604 2.086 3.041 . 0 0 "[ . 1 . 2]" 1
1047 1 46 LEU MD1 1 82 LEU HA . . 3.740 3.313 2.992 3.703 . 0 0 "[ . 1 . 2]" 1
1048 1 46 LEU MD1 1 82 LEU HB2 . . 4.110 3.658 3.459 3.905 . 0 0 "[ . 1 . 2]" 1
1049 1 46 LEU MD1 1 82 LEU HB3 . . 3.770 2.429 2.088 2.634 . 0 0 "[ . 1 . 2]" 1
1050 1 46 LEU MD1 1 83 THR H . . 3.680 2.600 2.277 3.329 . 0 0 "[ . 1 . 2]" 1
1051 1 46 LEU MD1 1 83 THR HA . . 4.620 3.787 3.596 4.412 . 0 0 "[ . 1 . 2]" 1
1052 1 46 LEU MD1 1 84 MET H . . 4.480 3.254 3.024 3.738 . 0 0 "[ . 1 . 2]" 1
1053 1 46 LEU MD1 1 84 MET HA . . 3.900 2.508 2.121 2.904 . 0 0 "[ . 1 . 2]" 1
1054 1 46 LEU MD1 1 84 MET HB3 . . 3.570 3.397 3.179 3.559 . 0 0 "[ . 1 . 2]" 1
1055 1 46 LEU MD1 1 84 MET ME . . 2.840 2.249 1.907 2.781 . 0 0 "[ . 1 . 2]" 1
1056 1 46 LEU MD1 1 84 MET HG2 . . 4.110 3.997 3.851 4.113 0.003 9 0 "[ . 1 . 2]" 1
1057 1 46 LEU MD1 1 84 MET QG . . 3.430 2.966 2.512 3.438 0.008 12 0 "[ . 1 . 2]" 1
1058 1 46 LEU MD1 1 84 MET HG3 . . 4.110 3.102 2.543 3.839 . 0 0 "[ . 1 . 2]" 1
1059 1 46 LEU MD1 1 85 LYS H . . 4.560 4.350 4.078 4.571 0.011 5 0 "[ . 1 . 2]" 1
1060 1 46 LEU MD1 1 94 PHE QD . . 4.550 2.971 2.783 3.144 . 0 0 "[ . 1 . 2]" 1
1061 1 46 LEU MD1 1 94 PHE QE . . 4.050 2.138 1.946 2.350 . 0 0 "[ . 1 . 2]" 1
1062 1 46 LEU MD2 1 58 VAL HB . . 4.840 4.334 3.991 4.698 . 0 0 "[ . 1 . 2]" 1
1063 1 46 LEU MD2 1 58 VAL MG1 . . 3.110 2.105 1.910 2.642 . 0 0 "[ . 1 . 2]" 1
1064 1 46 LEU MD2 1 70 VAL HB . . 4.630 3.936 3.614 4.137 . 0 0 "[ . 1 . 2]" 1
1065 1 46 LEU MD2 1 70 VAL MG1 . . 2.950 1.827 1.683 2.013 . 0 0 "[ . 1 . 2]" 1
1066 1 46 LEU MD2 1 72 TYR HA . . 4.850 4.654 4.270 4.853 0.003 3 0 "[ . 1 . 2]" 1
1067 1 46 LEU MD2 1 72 TYR HB2 . . 4.160 3.960 3.607 4.161 0.001 15 0 "[ . 1 . 2]" 1
1068 1 46 LEU MD2 1 72 TYR HB3 . . 3.870 2.950 2.696 3.146 . 0 0 "[ . 1 . 2]" 1
1069 1 46 LEU MD2 1 72 TYR QD . . 3.930 3.480 3.299 3.618 . 0 0 "[ . 1 . 2]" 1
1070 1 46 LEU MD2 1 72 TYR QE . . 5.030 4.974 4.761 5.033 0.003 15 0 "[ . 1 . 2]" 1
1071 1 46 LEU MD2 1 82 LEU HB3 . . 4.010 3.543 3.263 3.887 . 0 0 "[ . 1 . 2]" 1
1072 1 46 LEU HG 1 47 GLU H . . 3.700 2.184 1.968 2.480 . 0 0 "[ . 1 . 2]" 1
1073 1 46 LEU HG 1 47 GLU HA . . 5.020 3.631 3.470 3.793 . 0 0 "[ . 1 . 2]" 1
1074 1 46 LEU HG 1 48 ALA H . . 5.000 3.854 3.544 4.055 . 0 0 "[ . 1 . 2]" 1
1075 1 46 LEU HG 1 48 ALA HA . . 5.430 4.368 4.182 4.482 . 0 0 "[ . 1 . 2]" 1
1076 1 46 LEU HG 1 58 VAL MG1 . . 3.790 3.364 3.116 3.707 . 0 0 "[ . 1 . 2]" 1
1077 1 46 LEU HG 1 58 VAL MG2 . . 4.080 3.433 3.053 3.734 . 0 0 "[ . 1 . 2]" 1
1078 1 46 LEU HG 1 82 LEU HA . . 5.500 4.243 3.970 4.394 . 0 0 "[ . 1 . 2]" 1
1079 1 47 GLU H 1 47 GLU HB2 . . 3.870 3.128 2.801 3.343 . 0 0 "[ . 1 . 2]" 1
1080 1 47 GLU H 1 47 GLU HB3 . . 3.550 2.809 2.706 2.972 . 0 0 "[ . 1 . 2]" 1
1081 1 47 GLU H 1 47 GLU HG2 . . 4.890 4.642 4.388 4.886 . 0 0 "[ . 1 . 2]" 1
1082 1 47 GLU H 1 47 GLU QG . . 4.150 4.130 4.043 4.171 0.021 2 0 "[ . 1 . 2]" 1
1083 1 47 GLU H 1 47 GLU HG3 . . 4.890 4.662 4.425 4.877 . 0 0 "[ . 1 . 2]" 1
1084 1 47 GLU H 1 48 ALA H . . 4.540 4.046 3.920 4.222 . 0 0 "[ . 1 . 2]" 1
1085 1 47 GLU H 1 48 ALA HA . . 5.100 4.633 4.528 4.773 . 0 0 "[ . 1 . 2]" 1
1086 1 47 GLU H 1 48 ALA MB . . 4.890 4.781 4.614 4.876 . 0 0 "[ . 1 . 2]" 1
1087 1 47 GLU H 1 82 LEU HA . . 5.410 4.504 4.278 4.638 . 0 0 "[ . 1 . 2]" 1
1088 1 47 GLU H 1 83 THR H . . 3.730 2.761 2.606 2.965 . 0 0 "[ . 1 . 2]" 1
1089 1 47 GLU H 1 83 THR HB . . 4.230 3.102 2.864 3.382 . 0 0 "[ . 1 . 2]" 1
1090 1 47 GLU H 1 83 THR MG . . 4.610 4.142 3.950 4.436 . 0 0 "[ . 1 . 2]" 1
1091 1 47 GLU H 1 84 MET H . . 4.970 4.736 4.558 4.887 . 0 0 "[ . 1 . 2]" 1
1092 1 47 GLU H 1 85 LYS H . . 5.500 5.208 4.869 5.505 0.005 12 0 "[ . 1 . 2]" 1
1093 1 47 GLU HA 1 47 GLU HG2 . . 3.990 3.241 2.176 3.818 . 0 0 "[ . 1 . 2]" 1
1094 1 47 GLU HA 1 47 GLU HG3 . . 3.990 2.631 2.359 3.469 . 0 0 "[ . 1 . 2]" 1
1095 1 47 GLU HA 1 48 ALA H . . 2.770 2.150 2.139 2.183 . 0 0 "[ . 1 . 2]" 1
1096 1 47 GLU HA 1 48 ALA HA . . 5.180 4.408 4.393 4.434 . 0 0 "[ . 1 . 2]" 1
1097 1 47 GLU HA 1 58 VAL HB . . 4.860 4.414 4.208 4.660 . 0 0 "[ . 1 . 2]" 1
1098 1 47 GLU HA 1 58 VAL MG2 . . 4.160 3.205 2.860 3.578 . 0 0 "[ . 1 . 2]" 1
1099 1 47 GLU HB2 1 48 ALA H . . 4.550 4.440 4.318 4.523 . 0 0 "[ . 1 . 2]" 1
1100 1 47 GLU HB2 1 83 THR H . . 5.200 5.053 4.651 5.204 0.004 12 0 "[ . 1 . 2]" 1
1101 1 47 GLU HB2 1 83 THR HB . . 3.980 3.589 3.020 3.864 . 0 0 "[ . 1 . 2]" 1
1102 1 47 GLU HB2 1 83 THR MG . . 4.630 4.240 3.781 4.489 . 0 0 "[ . 1 . 2]" 1
1103 1 47 GLU HB3 1 48 ALA H . . 4.580 4.316 4.044 4.395 . 0 0 "[ . 1 . 2]" 1
1104 1 47 GLU HB3 1 48 ALA HA . . 5.500 4.890 4.598 5.044 . 0 0 "[ . 1 . 2]" 1
1105 1 47 GLU HB3 1 83 THR H . . 4.340 3.750 3.479 3.907 . 0 0 "[ . 1 . 2]" 1
1106 1 47 GLU HB3 1 83 THR HB . . 3.590 2.117 1.998 2.372 . 0 0 "[ . 1 . 2]" 1
1107 1 47 GLU HB3 1 83 THR MG . . 3.740 3.390 3.164 3.632 . 0 0 "[ . 1 . 2]" 1
1108 1 47 GLU HG2 1 48 ALA H . . 4.800 3.939 3.309 4.800 . 15 0 "[ . 1 . 2]" 1
1109 1 47 GLU HG2 1 49 VAL MG2 . . 4.200 2.593 2.080 3.850 . 0 0 "[ . 1 . 2]" 1
1110 1 47 GLU HG3 1 48 ALA H . . 4.800 3.562 3.032 4.801 0.001 2 0 "[ . 1 . 2]" 1
1111 1 47 GLU HG3 1 49 VAL MG2 . . 4.200 3.117 2.104 4.120 . 0 0 "[ . 1 . 2]" 1
1112 1 48 ALA H 1 48 ALA MB . . 3.570 2.292 2.162 2.391 . 0 0 "[ . 1 . 2]" 1
1113 1 48 ALA H 1 49 VAL H . . 4.570 4.440 4.341 4.530 . 0 0 "[ . 1 . 2]" 1
1114 1 48 ALA H 1 49 VAL MG2 . . 3.990 3.879 3.753 3.986 . 0 0 "[ . 1 . 2]" 1
1115 1 48 ALA H 1 56 ALA H . . 4.370 4.173 3.870 4.353 . 0 0 "[ . 1 . 2]" 1
1116 1 48 ALA H 1 56 ALA MB . . 4.580 4.290 3.885 4.511 . 0 0 "[ . 1 . 2]" 1
1117 1 48 ALA H 1 58 VAL HB . . 4.660 4.308 3.877 4.646 . 0 0 "[ . 1 . 2]" 1
1118 1 48 ALA H 1 58 VAL MG2 . . 3.920 2.314 2.074 2.680 . 0 0 "[ . 1 . 2]" 1
1119 1 48 ALA HA 1 49 VAL H . . 2.730 2.150 2.141 2.169 . 0 0 "[ . 1 . 2]" 1
1120 1 48 ALA HA 1 49 VAL HB . . 4.590 4.512 4.416 4.601 0.011 11 0 "[ . 1 . 2]" 1
1121 1 48 ALA HA 1 56 ALA MB . . 4.980 4.382 4.061 4.705 . 0 0 "[ . 1 . 2]" 1
1122 1 48 ALA HA 1 81 THR H . . 5.220 4.432 4.265 4.769 . 0 0 "[ . 1 . 2]" 1
1123 1 48 ALA HA 1 82 LEU HB3 . . 5.440 4.768 4.423 5.116 . 0 0 "[ . 1 . 2]" 1
1124 1 48 ALA HA 1 82 LEU MD2 . . 4.000 3.286 2.877 3.477 . 0 0 "[ . 1 . 2]" 1
1125 1 48 ALA HA 1 83 THR H . . 4.460 3.621 3.373 3.853 . 0 0 "[ . 1 . 2]" 1
1126 1 48 ALA MB 1 49 VAL H . . 3.510 3.158 3.001 3.309 . 0 0 "[ . 1 . 2]" 1
1127 1 48 ALA MB 1 56 ALA H . . 3.810 2.768 2.459 3.140 . 0 0 "[ . 1 . 2]" 1
1128 1 48 ALA MB 1 56 ALA MB . . 2.740 2.021 1.820 2.372 . 0 0 "[ . 1 . 2]" 1
1129 1 48 ALA MB 1 58 VAL MG2 . . 2.930 2.186 1.902 2.356 . 0 0 "[ . 1 . 2]" 1
1130 1 48 ALA MB 1 72 TYR HB2 . . 3.890 2.702 2.468 2.936 . 0 0 "[ . 1 . 2]" 1
1131 1 48 ALA MB 1 72 TYR HB3 . . 3.820 3.328 3.066 3.578 . 0 0 "[ . 1 . 2]" 1
1132 1 48 ALA MB 1 72 TYR QD . . 3.980 3.596 3.296 3.778 . 0 0 "[ . 1 . 2]" 1
1133 1 48 ALA MB 1 80 TYR QD . . 5.090 3.056 2.656 3.635 . 0 0 "[ . 1 . 2]" 1
1134 1 48 ALA MB 1 80 TYR QE . . 4.230 3.606 3.241 4.046 . 0 0 "[ . 1 . 2]" 1
1135 1 48 ALA MB 1 83 THR H . . 4.800 4.589 4.261 4.792 . 0 0 "[ . 1 . 2]" 1
1136 1 49 VAL H 1 49 VAL HB . . 3.450 2.797 2.666 2.945 . 0 0 "[ . 1 . 2]" 1
1137 1 49 VAL H 1 49 VAL MG1 . . 4.100 3.867 3.802 3.951 . 0 0 "[ . 1 . 2]" 1
1138 1 49 VAL H 1 49 VAL MG2 . . 3.190 3.138 2.982 3.236 0.046 16 0 "[ . 1 . 2]" 1
1139 1 49 VAL H 1 50 SER H . . 4.560 4.248 4.130 4.358 . 0 0 "[ . 1 . 2]" 1
1140 1 49 VAL H 1 56 ALA MB . . 4.850 4.674 4.340 4.871 0.021 16 0 "[ . 1 . 2]" 1
1141 1 49 VAL H 1 80 TYR QD . . 4.310 3.092 2.790 3.312 . 0 0 "[ . 1 . 2]" 1
1142 1 49 VAL H 1 80 TYR QE . . 4.860 4.687 4.365 4.861 0.001 12 0 "[ . 1 . 2]" 1
1143 1 49 VAL H 1 81 THR H . . 3.620 2.901 2.723 3.121 . 0 0 "[ . 1 . 2]" 1
1144 1 49 VAL H 1 81 THR HB . . 4.360 3.650 3.422 3.979 . 0 0 "[ . 1 . 2]" 1
1145 1 49 VAL H 1 82 LEU HA . . 4.680 3.943 3.710 4.116 . 0 0 "[ . 1 . 2]" 1
1146 1 49 VAL H 1 82 LEU MD2 . . 4.510 4.188 3.823 4.388 . 0 0 "[ . 1 . 2]" 1
1147 1 49 VAL H 1 83 THR H . . 5.120 4.876 4.647 5.105 . 0 0 "[ . 1 . 2]" 1
1148 1 49 VAL HA 1 49 VAL MG2 . . 3.750 2.301 2.228 2.418 . 0 0 "[ . 1 . 2]" 1
1149 1 49 VAL HA 1 50 SER H . . 2.880 2.171 2.141 2.253 . 0 0 "[ . 1 . 2]" 1
1150 1 49 VAL HA 1 50 SER QB . . 4.700 4.069 4.015 4.153 . 0 0 "[ . 1 . 2]" 1
1151 1 49 VAL HA 1 56 ALA H . . 3.640 3.353 2.789 3.606 . 0 0 "[ . 1 . 2]" 1
1152 1 49 VAL HA 1 80 TYR QE . . 4.990 3.788 3.364 4.141 . 0 0 "[ . 1 . 2]" 1
1153 1 49 VAL HB 1 50 SER H . . 4.270 4.183 4.018 4.273 0.003 2 0 "[ . 1 . 2]" 1
1154 1 49 VAL HB 1 81 THR H . . 4.720 4.212 3.984 4.537 . 0 0 "[ . 1 . 2]" 1
1155 1 49 VAL HB 1 81 THR HB . . 4.560 3.253 2.959 3.679 . 0 0 "[ . 1 . 2]" 1
1156 1 49 VAL HB 1 81 THR MG . . 5.210 4.225 3.897 4.568 . 0 0 "[ . 1 . 2]" 1
1157 1 49 VAL MG1 1 50 SER H . . 3.270 2.371 1.973 2.600 . 0 0 "[ . 1 . 2]" 1
1158 1 49 VAL MG1 1 50 SER QB . . 4.650 3.863 3.495 4.200 . 0 0 "[ . 1 . 2]" 1
1159 1 49 VAL MG1 1 53 GLY H . . 3.660 3.242 2.945 3.498 . 0 0 "[ . 1 . 2]" 1
1160 1 49 VAL MG1 1 53 GLY HA2 . . 3.790 2.196 1.905 2.363 . 0 0 "[ . 1 . 2]" 1
1161 1 49 VAL MG1 1 53 GLY QA . . 3.320 2.177 1.891 2.341 . 0 0 "[ . 1 . 2]" 1
1162 1 49 VAL MG1 1 53 GLY HA3 . . 3.790 3.577 3.205 3.792 0.002 15 0 "[ . 1 . 2]" 1
1163 1 49 VAL MG1 1 54 THR H . . 4.070 2.555 1.963 3.140 . 0 0 "[ . 1 . 2]" 1
1164 1 49 VAL MG1 1 55 LYS H . . 5.140 4.302 3.485 4.803 . 0 0 "[ . 1 . 2]" 1
1165 1 49 VAL MG1 1 81 THR H . . 4.530 4.451 4.252 4.532 0.002 5 0 "[ . 1 . 2]" 1
1166 1 49 VAL MG1 1 81 THR HB . . 4.040 3.863 3.634 4.039 . 0 0 "[ . 1 . 2]" 1
1167 1 49 VAL MG2 1 55 LYS H . . 5.480 4.071 2.837 4.809 . 0 0 "[ . 1 . 2]" 1
1168 1 49 VAL MG2 1 55 LYS HA . . 4.370 2.530 1.807 3.107 . 0 0 "[ . 1 . 2]" 1
1169 1 49 VAL MG2 1 55 LYS HG2 . . 3.970 2.990 2.258 3.804 . 0 0 "[ . 1 . 2]" 1
1170 1 49 VAL MG2 1 55 LYS QG . . 3.320 2.612 2.065 3.367 0.047 16 0 "[ . 1 . 2]" 1
1171 1 49 VAL MG2 1 55 LYS HG3 . . 3.970 3.107 2.079 3.988 0.018 8 0 "[ . 1 . 2]" 1
1172 1 49 VAL MG2 1 56 ALA H . . 4.080 3.763 3.274 4.076 . 0 0 "[ . 1 . 2]" 1
1173 1 50 SER H 1 50 SER HB2 . . 3.690 2.737 2.371 3.687 . 0 0 "[ . 1 . 2]" 1
1174 1 50 SER H 1 50 SER QB . . 3.050 2.327 2.254 2.559 . 0 0 "[ . 1 . 2]" 1
1175 1 50 SER H 1 50 SER HB3 . . 3.690 2.650 2.327 2.832 . 0 0 "[ . 1 . 2]" 1
1176 1 50 SER H 1 51 ASP H . . 4.790 4.592 4.551 4.619 . 0 0 "[ . 1 . 2]" 1
1177 1 50 SER H 1 53 GLY H . . 4.760 4.112 3.460 4.580 . 0 0 "[ . 1 . 2]" 1
1178 1 50 SER H 1 54 THR H . . 4.030 2.289 1.870 3.617 . 0 0 "[ . 1 . 2]" 1
1179 1 50 SER H 1 54 THR HB . . 4.290 3.129 2.724 4.204 . 0 0 "[ . 1 . 2]" 1
1180 1 50 SER H 1 80 TYR QE . . 4.040 3.425 2.817 3.798 . 0 0 "[ . 1 . 2]" 1
1181 1 50 SER HA 1 51 ASP H . . 3.150 2.373 2.325 2.447 . 0 0 "[ . 1 . 2]" 1
1182 1 50 SER HA 1 80 TYR HA . . 3.690 2.119 2.001 2.280 . 0 0 "[ . 1 . 2]" 1
1183 1 50 SER HA 1 80 TYR QD . . 4.940 3.281 2.803 3.731 . 0 0 "[ . 1 . 2]" 1
1184 1 50 SER HA 1 80 TYR QE . . 4.820 4.059 3.588 4.500 . 0 0 "[ . 1 . 2]" 1
1185 1 50 SER HA 1 81 THR H . . 3.640 3.288 3.073 3.457 . 0 0 "[ . 1 . 2]" 1
1186 1 50 SER QB 1 51 ASP H . . 3.350 3.114 2.503 3.352 0.002 16 0 "[ . 1 . 2]" 1
1187 1 50 SER QB 1 54 THR H . . 4.340 2.715 1.882 3.961 . 0 0 "[ . 1 . 2]" 1
1188 1 50 SER QB 1 54 THR HB . . 4.340 2.437 1.886 3.792 . 0 0 "[ . 1 . 2]" 1
1189 1 50 SER QB 1 76 THR MG . . 4.450 2.940 2.584 3.393 . 0 0 "[ . 1 . 2]" 1
1190 1 50 SER QB 1 80 TYR QE . . 3.940 2.775 2.396 3.053 . 0 0 "[ . 1 . 2]" 1
1191 1 50 SER HB2 1 51 ASP H . . 4.190 3.684 2.533 4.079 . 0 0 "[ . 1 . 2]" 1
1192 1 50 SER HB2 1 76 THR MG . . 5.070 3.271 2.783 3.816 . 0 0 "[ . 1 . 2]" 1
1193 1 50 SER HB2 1 80 TYR QE . . 4.510 3.045 2.414 4.212 . 0 0 "[ . 1 . 2]" 1
1194 1 50 SER HB3 1 51 ASP H . . 4.190 3.562 3.196 4.001 . 0 0 "[ . 1 . 2]" 1
1195 1 50 SER HB3 1 76 THR MG . . 5.070 3.347 2.989 3.886 . 0 0 "[ . 1 . 2]" 1
1196 1 50 SER HB3 1 80 TYR QE . . 4.510 3.991 2.480 4.505 . 0 0 "[ . 1 . 2]" 1
1197 1 51 ASP H 1 51 ASP QB . . 3.210 2.374 2.170 2.839 . 0 0 "[ . 1 . 2]" 1
1198 1 51 ASP H 1 53 GLY H . . 4.970 4.272 3.896 4.551 . 0 0 "[ . 1 . 2]" 1
1199 1 51 ASP H 1 80 TYR HA . . 4.020 3.448 3.157 3.680 . 0 0 "[ . 1 . 2]" 1
1200 1 51 ASP H 1 81 THR H . . 5.000 4.955 4.709 5.006 0.006 2 0 "[ . 1 . 2]" 1
1201 1 51 ASP HA 1 53 GLY H . . 4.250 3.656 3.313 4.119 . 0 0 "[ . 1 . 2]" 1
1202 1 52 SER QB 1 53 GLY H . . 4.030 3.497 2.925 4.035 0.005 4 0 "[ . 1 . 2]" 1
1203 1 52 SER HB2 1 53 GLY H . . 4.590 4.081 3.114 4.578 . 0 0 "[ . 1 . 2]" 1
1204 1 52 SER HB3 1 53 GLY H . . 4.590 3.945 3.026 4.556 . 0 0 "[ . 1 . 2]" 1
1205 1 53 GLY H 1 54 THR H . . 3.360 2.723 2.167 3.118 . 0 0 "[ . 1 . 2]" 1
1206 1 54 THR H 1 54 THR HB . . 3.370 2.722 2.552 2.938 . 0 0 "[ . 1 . 2]" 1
1207 1 54 THR H 1 54 THR MG . . 4.150 3.875 3.817 3.922 . 0 0 "[ . 1 . 2]" 1
1208 1 54 THR H 1 55 LYS H . . 4.880 4.190 3.986 4.351 . 0 0 "[ . 1 . 2]" 1
1209 1 54 THR HA 1 54 THR MG . . 3.260 2.294 2.116 2.429 . 0 0 "[ . 1 . 2]" 1
1210 1 54 THR HA 1 55 LYS H . . 2.730 2.157 2.140 2.188 . 0 0 "[ . 1 . 2]" 1
1211 1 54 THR HA 1 55 LYS QD . . 5.500 4.908 3.129 5.508 0.008 19 0 "[ . 1 . 2]" 1
1212 1 54 THR HB 1 55 LYS H . . 4.330 4.292 4.212 4.343 0.013 16 0 "[ . 1 . 2]" 1
1213 1 54 THR MG 1 55 LYS H . . 3.390 2.956 2.637 3.285 . 0 0 "[ . 1 . 2]" 1
1214 1 54 THR MG 1 75 LEU QB . . 3.670 2.944 2.418 3.671 0.001 15 0 "[ . 1 . 2]" 1
1215 1 55 LYS H 1 55 LYS HB2 . . 3.800 2.632 2.371 3.591 . 0 0 "[ . 1 . 2]" 1
1216 1 55 LYS H 1 55 LYS QB . . 3.070 2.465 2.340 2.841 . 0 0 "[ . 1 . 2]" 1
1217 1 55 LYS H 1 55 LYS HB3 . . 3.800 3.473 2.677 3.610 . 0 0 "[ . 1 . 2]" 1
1218 1 55 LYS H 1 55 LYS QD . . 3.930 3.302 1.858 3.850 . 0 0 "[ . 1 . 2]" 1
1219 1 55 LYS H 1 55 LYS QE . . 4.930 4.141 2.415 4.930 . 0 0 "[ . 1 . 2]" 1
1220 1 55 LYS H 1 55 LYS HG2 . . 3.960 3.599 1.949 4.037 0.077 4 0 "[ . 1 . 2]" 1
1221 1 55 LYS H 1 55 LYS QG . . 3.250 2.332 1.853 3.115 . 0 0 "[ . 1 . 2]" 1
1222 1 55 LYS H 1 55 LYS HG3 . . 3.960 2.392 1.889 3.257 . 0 0 "[ . 1 . 2]" 1
1223 1 55 LYS H 1 56 ALA H . . 4.590 4.473 4.370 4.610 0.020 16 0 "[ . 1 . 2]" 1
1224 1 55 LYS HA 1 55 LYS QD . . 5.030 3.996 3.284 4.525 . 0 0 "[ . 1 . 2]" 1
1225 1 55 LYS HA 1 56 ALA H . . 3.020 2.150 2.141 2.218 . 0 0 "[ . 1 . 2]" 1
1226 1 55 LYS QB 1 55 LYS QD . . 3.190 2.149 2.036 2.398 . 0 0 "[ . 1 . 2]" 1
1227 1 55 LYS QB 1 55 LYS QE . . 3.970 3.222 1.905 3.767 . 0 0 "[ . 1 . 2]" 1
1228 1 55 LYS QB 1 56 ALA H . . 3.550 3.310 2.880 3.495 . 0 0 "[ . 1 . 2]" 1
1229 1 55 LYS HB2 1 56 ALA H . . 4.410 4.144 2.954 4.410 0.000 10 0 "[ . 1 . 2]" 1
1230 1 55 LYS HB3 1 56 ALA H . . 4.410 3.578 3.298 4.125 . 0 0 "[ . 1 . 2]" 1
1231 1 55 LYS QE 1 55 LYS HG2 . . 3.540 2.634 2.112 3.418 . 0 0 "[ . 1 . 2]" 1
1232 1 55 LYS QE 1 55 LYS HG3 . . 3.540 2.655 2.107 3.343 . 0 0 "[ . 1 . 2]" 1
1233 1 55 LYS QG 1 56 ALA H . . 4.620 4.258 4.074 4.501 . 0 0 "[ . 1 . 2]" 1
1234 1 55 LYS HG2 1 56 ALA H . . 5.500 4.827 4.350 5.410 . 0 0 "[ . 1 . 2]" 1
1235 1 55 LYS HG3 1 56 ALA H . . 5.500 4.814 4.289 5.036 . 0 0 "[ . 1 . 2]" 1
1236 1 56 ALA H 1 56 ALA MB . . 3.000 2.198 2.082 2.359 . 0 0 "[ . 1 . 2]" 1
1237 1 56 ALA H 1 57 GLU H . . 4.630 4.573 4.522 4.613 . 0 0 "[ . 1 . 2]" 1
1238 1 56 ALA H 1 80 TYR QE . . 4.260 3.753 3.339 4.102 . 0 0 "[ . 1 . 2]" 1
1239 1 56 ALA HA 1 57 GLU H . . 3.240 2.345 2.206 2.571 . 0 0 "[ . 1 . 2]" 1
1240 1 56 ALA HA 1 57 GLU HA . . 5.010 4.319 4.304 4.350 . 0 0 "[ . 1 . 2]" 1
1241 1 56 ALA HA 1 75 LEU MD1 . . 5.160 3.417 2.895 3.814 . 0 0 "[ . 1 . 2]" 1
1242 1 56 ALA HA 1 80 TYR QE . . 5.500 4.364 4.050 4.679 . 0 0 "[ . 1 . 2]" 1
1243 1 56 ALA MB 1 57 GLU H . . 3.320 2.616 2.206 2.872 . 0 0 "[ . 1 . 2]" 1
1244 1 56 ALA MB 1 57 GLU QB . . 4.520 4.047 3.836 4.242 . 0 0 "[ . 1 . 2]" 1
1245 1 56 ALA MB 1 58 VAL MG2 . . 3.560 3.066 2.756 3.318 . 0 0 "[ . 1 . 2]" 1
1246 1 56 ALA MB 1 72 TYR HA . . 4.190 3.984 3.827 4.146 . 0 0 "[ . 1 . 2]" 1
1247 1 56 ALA MB 1 72 TYR HB2 . . 3.470 2.933 2.771 3.051 . 0 0 "[ . 1 . 2]" 1
1248 1 56 ALA MB 1 72 TYR HB3 . . 4.500 4.415 4.245 4.494 . 0 0 "[ . 1 . 2]" 1
1249 1 56 ALA MB 1 72 TYR QD . . 3.330 3.171 2.994 3.330 0.000 15 0 "[ . 1 . 2]" 1
1250 1 56 ALA MB 1 72 TYR QE . . 4.820 4.701 4.509 4.821 0.001 15 0 "[ . 1 . 2]" 1
1251 1 56 ALA MB 1 73 VAL H . . 3.650 3.234 2.896 3.546 . 0 0 "[ . 1 . 2]" 1
1252 1 56 ALA MB 1 73 VAL HB . . 5.020 4.419 3.967 4.781 . 0 0 "[ . 1 . 2]" 1
1253 1 56 ALA MB 1 74 PRO HA . . 3.330 2.318 1.979 2.592 . 0 0 "[ . 1 . 2]" 1
1254 1 56 ALA MB 1 75 LEU H . . 3.880 3.223 2.964 3.537 . 0 0 "[ . 1 . 2]" 1
1255 1 56 ALA MB 1 75 LEU HG . . 4.150 3.947 3.630 4.147 . 0 0 "[ . 1 . 2]" 1
1256 1 56 ALA MB 1 80 TYR QE . . 3.450 2.401 1.992 2.921 . 0 0 "[ . 1 . 2]" 1
1257 1 57 GLU H 1 57 GLU QB . . 2.910 2.181 2.146 2.229 . 0 0 "[ . 1 . 2]" 1
1258 1 57 GLU H 1 57 GLU HG2 . . 4.550 4.364 4.193 4.548 . 0 0 "[ . 1 . 2]" 1
1259 1 57 GLU H 1 57 GLU QG . . 3.870 3.814 3.024 3.872 0.002 19 0 "[ . 1 . 2]" 1
1260 1 57 GLU H 1 57 GLU HG3 . . 4.550 4.253 3.094 4.458 . 0 0 "[ . 1 . 2]" 1
1261 1 57 GLU H 1 58 VAL H . . 4.760 4.437 4.352 4.597 . 0 0 "[ . 1 . 2]" 1
1262 1 57 GLU H 1 58 VAL MG2 . . 4.710 4.292 4.106 4.438 . 0 0 "[ . 1 . 2]" 1
1263 1 57 GLU H 1 73 VAL HB . . 4.360 3.637 3.098 3.970 . 0 0 "[ . 1 . 2]" 1
1264 1 57 GLU H 1 73 VAL MG1 . . 4.720 4.416 4.136 4.694 . 0 0 "[ . 1 . 2]" 1
1265 1 57 GLU H 1 75 LEU MD1 . . 5.050 4.085 3.566 4.662 . 0 0 "[ . 1 . 2]" 1
1266 1 57 GLU H 1 75 LEU HG . . 4.460 3.845 3.433 4.217 . 0 0 "[ . 1 . 2]" 1
1267 1 57 GLU HA 1 57 GLU HG2 . . 4.000 3.001 2.210 3.646 . 0 0 "[ . 1 . 2]" 1
1268 1 57 GLU HA 1 57 GLU QG . . 3.420 2.407 2.187 2.604 . 0 0 "[ . 1 . 2]" 1
1269 1 57 GLU HA 1 57 GLU HG3 . . 4.000 2.653 2.351 3.480 . 0 0 "[ . 1 . 2]" 1
1270 1 57 GLU HA 1 58 VAL H . . 2.600 2.145 2.139 2.188 . 0 0 "[ . 1 . 2]" 1
1271 1 57 GLU HA 1 58 VAL HA . . 4.890 4.397 4.394 4.418 . 0 0 "[ . 1 . 2]" 1
1272 1 57 GLU HA 1 58 VAL HB . . 4.670 4.637 4.574 4.672 0.002 8 0 "[ . 1 . 2]" 1
1273 1 57 GLU HA 1 58 VAL MG2 . . 3.850 3.731 3.493 3.850 0.000 11 0 "[ . 1 . 2]" 1
1274 1 57 GLU QB 1 58 VAL H . . 3.860 3.794 3.372 3.866 0.006 3 0 "[ . 1 . 2]" 1
1275 1 57 GLU QB 1 58 VAL MG2 . . 5.220 4.576 4.396 4.754 . 0 0 "[ . 1 . 2]" 1
1276 1 57 GLU QB 1 73 VAL H . . 4.120 3.222 2.933 3.513 . 0 0 "[ . 1 . 2]" 1
1277 1 57 GLU QB 1 73 VAL MG1 . . 4.150 3.768 3.397 4.119 . 0 0 "[ . 1 . 2]" 1
1278 1 57 GLU QB 1 73 VAL MG2 . . 4.010 3.472 2.907 3.871 . 0 0 "[ . 1 . 2]" 1
1279 1 57 GLU QB 1 75 LEU MD1 . . 5.500 4.285 4.013 4.842 . 0 0 "[ . 1 . 2]" 1
1280 1 57 GLU QB 1 75 LEU MD2 . . 4.690 4.143 3.648 4.690 . 0 0 "[ . 1 . 2]" 1
1281 1 57 GLU HG2 1 58 VAL H . . 4.330 3.584 2.826 4.185 . 0 0 "[ . 1 . 2]" 1
1282 1 57 GLU HG3 1 58 VAL H . . 4.330 3.685 2.830 4.349 0.019 14 0 "[ . 1 . 2]" 1
1283 1 58 VAL H 1 58 VAL HB . . 2.810 2.635 2.580 2.777 . 0 0 "[ . 1 . 2]" 1
1284 1 58 VAL H 1 58 VAL MG2 . . 3.190 2.749 2.650 2.870 . 0 0 "[ . 1 . 2]" 1
1285 1 58 VAL H 1 59 SER H . . 4.540 4.465 4.367 4.509 . 0 0 "[ . 1 . 2]" 1
1286 1 58 VAL HA 1 58 VAL MG1 . . 3.280 2.365 2.297 2.471 . 0 0 "[ . 1 . 2]" 1
1287 1 58 VAL HA 1 58 VAL MG2 . . 3.530 2.389 2.290 2.448 . 0 0 "[ . 1 . 2]" 1
1288 1 58 VAL HA 1 59 SER H . . 2.790 2.240 2.203 2.374 . 0 0 "[ . 1 . 2]" 1
1289 1 58 VAL HA 1 59 SER HB2 . . 4.680 4.420 4.284 4.585 . 0 0 "[ . 1 . 2]" 1
1290 1 58 VAL HA 1 59 SER HB3 . . 4.680 4.508 4.339 4.659 . 0 0 "[ . 1 . 2]" 1
1291 1 58 VAL HA 1 72 TYR HA . . 3.400 2.615 2.444 2.782 . 0 0 "[ . 1 . 2]" 1
1292 1 58 VAL HA 1 72 TYR HB2 . . 4.900 4.102 3.931 4.289 . 0 0 "[ . 1 . 2]" 1
1293 1 58 VAL HA 1 72 TYR HB3 . . 4.770 3.993 3.825 4.287 . 0 0 "[ . 1 . 2]" 1
1294 1 58 VAL HA 1 73 VAL H . . 4.160 3.981 3.701 4.113 . 0 0 "[ . 1 . 2]" 1
1295 1 58 VAL HB 1 59 SER H . . 4.000 3.921 3.647 3.992 . 0 0 "[ . 1 . 2]" 1
1296 1 58 VAL MG1 1 59 SER H . . 3.100 2.056 1.829 2.294 . 0 0 "[ . 1 . 2]" 1
1297 1 58 VAL MG1 1 59 SER HA . . 4.920 3.381 3.152 3.520 . 0 0 "[ . 1 . 2]" 1
1298 1 58 VAL MG1 1 60 ILE H . . 4.790 4.269 3.420 4.547 . 0 0 "[ . 1 . 2]" 1
1299 1 58 VAL MG1 1 60 ILE QG . . 3.340 2.863 2.517 3.091 . 0 0 "[ . 1 . 2]" 1
1300 1 58 VAL MG2 1 72 TYR HA . . 3.720 2.920 2.675 3.156 . 0 0 "[ . 1 . 2]" 1
1301 1 58 VAL MG2 1 72 TYR HB2 . . 3.560 2.615 2.356 2.848 . 0 0 "[ . 1 . 2]" 1
1302 1 58 VAL MG2 1 72 TYR HB3 . . 3.310 2.691 2.422 2.977 . 0 0 "[ . 1 . 2]" 1
1303 1 58 VAL MG2 1 72 TYR QD . . 4.350 4.191 4.013 4.342 . 0 0 "[ . 1 . 2]" 1
1304 1 58 VAL MG2 1 73 VAL H . . 4.360 3.959 3.673 4.159 . 0 0 "[ . 1 . 2]" 1
1305 1 59 SER H 1 59 SER HB2 . . 3.630 3.294 3.141 3.445 . 0 0 "[ . 1 . 2]" 1
1306 1 59 SER H 1 59 SER HB3 . . 3.630 2.851 2.696 2.997 . 0 0 "[ . 1 . 2]" 1
1307 1 59 SER H 1 60 ILE H . . 4.420 4.297 3.936 4.399 . 0 0 "[ . 1 . 2]" 1
1308 1 59 SER H 1 60 ILE HG12 . . 5.390 5.256 5.057 5.385 . 0 0 "[ . 1 . 2]" 1
1309 1 59 SER H 1 60 ILE QG . . 4.620 4.005 3.832 4.115 . 0 0 "[ . 1 . 2]" 1
1310 1 59 SER H 1 60 ILE HG13 . . 5.390 4.155 3.952 4.292 . 0 0 "[ . 1 . 2]" 1
1311 1 59 SER H 1 72 TYR HA . . 4.280 4.152 3.957 4.261 . 0 0 "[ . 1 . 2]" 1
1312 1 59 SER HA 1 60 ILE H . . 2.960 2.214 2.146 2.273 . 0 0 "[ . 1 . 2]" 1
1313 1 59 SER HA 1 60 ILE HB . . 4.830 4.612 4.526 4.766 . 0 0 "[ . 1 . 2]" 1
1314 1 59 SER HA 1 60 ILE QG . . 5.340 3.490 3.298 3.769 . 0 0 "[ . 1 . 2]" 1
1315 1 59 SER QB 1 71 THR H . . 4.560 3.934 3.722 4.313 . 0 0 "[ . 1 . 2]" 1
1316 1 59 SER QB 1 71 THR HB . . 4.180 3.608 3.207 4.011 . 0 0 "[ . 1 . 2]" 1
1317 1 59 SER HB2 1 60 ILE H . . 4.460 4.090 3.844 4.436 . 0 0 "[ . 1 . 2]" 1
1318 1 59 SER HB3 1 60 ILE H . . 4.460 4.006 3.802 4.379 . 0 0 "[ . 1 . 2]" 1
1319 1 60 ILE H 1 60 ILE HB . . 3.230 2.664 2.535 2.738 . 0 0 "[ . 1 . 2]" 1
1320 1 60 ILE H 1 60 ILE MD . . 4.280 3.687 3.457 3.912 . 0 0 "[ . 1 . 2]" 1
1321 1 60 ILE H 1 60 ILE QG . . 3.770 2.709 2.320 2.890 . 0 0 "[ . 1 . 2]" 1
1322 1 60 ILE H 1 60 ILE MG . . 3.890 3.858 3.792 3.893 0.003 2 0 "[ . 1 . 2]" 1
1323 1 60 ILE H 1 61 GLN H . . 4.670 4.387 4.260 4.520 . 0 0 "[ . 1 . 2]" 1
1324 1 60 ILE HA 1 60 ILE MD . . 4.020 3.896 3.864 3.955 . 0 0 "[ . 1 . 2]" 1
1325 1 60 ILE HA 1 60 ILE HG12 . . 4.030 2.755 2.661 2.882 . 0 0 "[ . 1 . 2]" 1
1326 1 60 ILE HA 1 60 ILE HG13 . . 4.030 2.817 2.739 2.926 . 0 0 "[ . 1 . 2]" 1
1327 1 60 ILE HA 1 60 ILE MG . . 3.260 2.331 2.165 2.439 . 0 0 "[ . 1 . 2]" 1
1328 1 60 ILE HA 1 61 GLN H . . 2.870 2.170 2.142 2.237 . 0 0 "[ . 1 . 2]" 1
1329 1 60 ILE HA 1 61 GLN HB2 . . 5.130 4.294 4.147 4.578 . 0 0 "[ . 1 . 2]" 1
1330 1 60 ILE HA 1 61 GLN HB3 . . 5.130 4.807 4.568 4.963 . 0 0 "[ . 1 . 2]" 1
1331 1 60 ILE HA 1 69 ALA H . . 4.880 4.534 4.252 4.883 0.003 3 0 "[ . 1 . 2]" 1
1332 1 60 ILE HA 1 70 VAL HA . . 4.340 2.651 2.482 2.871 . 0 0 "[ . 1 . 2]" 1
1333 1 60 ILE HA 1 70 VAL MG2 . . 3.980 2.769 2.366 3.142 . 0 0 "[ . 1 . 2]" 1
1334 1 60 ILE HA 1 71 THR H . . 4.360 4.092 3.911 4.307 . 0 0 "[ . 1 . 2]" 1
1335 1 60 ILE HB 1 60 ILE MD . . 3.220 2.270 2.160 2.367 . 0 0 "[ . 1 . 2]" 1
1336 1 60 ILE HB 1 61 GLN H . . 4.530 4.096 3.929 4.253 . 0 0 "[ . 1 . 2]" 1
1337 1 60 ILE MD 1 60 ILE MG . . 2.680 2.292 2.119 2.417 . 0 0 "[ . 1 . 2]" 1
1338 1 60 ILE QG 1 60 ILE MG . . 3.240 2.127 2.050 2.243 . 0 0 "[ . 1 . 2]" 1
1339 1 60 ILE QG 1 61 GLN H . . 4.340 4.134 3.940 4.261 . 0 0 "[ . 1 . 2]" 1
1340 1 60 ILE QG 1 70 VAL HA . . 4.500 3.399 3.066 3.734 . 0 0 "[ . 1 . 2]" 1
1341 1 60 ILE QG 1 70 VAL MG2 . . 3.070 1.959 1.763 2.251 . 0 0 "[ . 1 . 2]" 1
1342 1 60 ILE QG 1 71 THR H . . 4.570 4.294 4.018 4.567 . 0 0 "[ . 1 . 2]" 1
1343 1 60 ILE HG12 1 61 GLN H . . 4.950 4.477 4.206 4.666 . 0 0 "[ . 1 . 2]" 1
1344 1 60 ILE HG12 1 70 VAL HA . . 5.320 3.632 3.189 3.992 . 0 0 "[ . 1 . 2]" 1
1345 1 60 ILE HG12 1 70 VAL MG2 . . 3.560 1.978 1.774 2.278 . 0 0 "[ . 1 . 2]" 1
1346 1 60 ILE HG12 1 71 THR H . . 5.280 4.916 4.473 5.231 . 0 0 "[ . 1 . 2]" 1
1347 1 60 ILE HG13 1 61 GLN H . . 4.950 4.862 4.755 4.936 . 0 0 "[ . 1 . 2]" 1
1348 1 60 ILE HG13 1 70 VAL HA . . 5.320 4.107 3.705 4.524 . 0 0 "[ . 1 . 2]" 1
1349 1 60 ILE HG13 1 70 VAL MG2 . . 3.560 3.188 2.960 3.517 . 0 0 "[ . 1 . 2]" 1
1350 1 60 ILE HG13 1 71 THR H . . 5.280 4.743 4.396 5.102 . 0 0 "[ . 1 . 2]" 1
1351 1 60 ILE MG 1 61 GLN H . . 3.330 2.303 2.039 2.568 . 0 0 "[ . 1 . 2]" 1
1352 1 60 ILE MG 1 62 ASN HA . . 4.610 4.136 3.424 4.608 . 0 0 "[ . 1 . 2]" 1
1353 1 60 ILE MG 1 68 TYR HB2 . . 4.040 3.754 3.390 3.997 . 0 0 "[ . 1 . 2]" 1
1354 1 60 ILE MG 1 68 TYR HB3 . . 3.900 2.466 2.103 2.764 . 0 0 "[ . 1 . 2]" 1
1355 1 60 ILE MG 1 68 TYR QD . . 3.040 2.376 2.152 2.686 . 0 0 "[ . 1 . 2]" 1
1356 1 60 ILE MG 1 68 TYR QE . . 3.930 3.787 3.508 3.930 0.000 3 0 "[ . 1 . 2]" 1
1357 1 60 ILE MG 1 69 ALA H . . 3.970 3.612 3.249 3.939 . 0 0 "[ . 1 . 2]" 1
1358 1 60 ILE MG 1 70 VAL HA . . 4.920 3.880 3.525 4.162 . 0 0 "[ . 1 . 2]" 1
1359 1 61 GLN H 1 61 GLN HB2 . . 3.540 2.846 2.551 3.173 . 0 0 "[ . 1 . 2]" 1
1360 1 61 GLN H 1 61 GLN QB . . 3.020 2.516 2.350 2.645 . 0 0 "[ . 1 . 2]" 1
1361 1 61 GLN H 1 61 GLN HB3 . . 3.540 2.826 2.493 3.004 . 0 0 "[ . 1 . 2]" 1
1362 1 61 GLN H 1 61 GLN QG . . 4.330 4.156 4.010 4.302 . 0 0 "[ . 1 . 2]" 1
1363 1 61 GLN H 1 68 TYR HA . . 4.930 4.336 3.965 4.926 . 0 0 "[ . 1 . 2]" 1
1364 1 61 GLN H 1 68 TYR QD . . 4.680 4.331 3.985 4.676 . 0 0 "[ . 1 . 2]" 1
1365 1 61 GLN H 1 69 ALA HA . . 5.500 4.641 4.469 4.822 . 0 0 "[ . 1 . 2]" 1
1366 1 61 GLN H 1 69 ALA MB . . 4.100 3.244 3.002 3.530 . 0 0 "[ . 1 . 2]" 1
1367 1 61 GLN H 1 70 VAL HA . . 3.840 3.779 3.505 3.842 0.002 7 0 "[ . 1 . 2]" 1
1368 1 61 GLN QB 1 69 ALA H . . 3.870 2.899 2.475 3.174 . 0 0 "[ . 1 . 2]" 1
1369 1 61 GLN QB 1 69 ALA MB . . 2.890 2.092 1.944 2.405 . 0 0 "[ . 1 . 2]" 1
1370 1 61 GLN HB2 1 69 ALA H . . 4.410 4.261 4.031 4.411 0.001 16 0 "[ . 1 . 2]" 1
1371 1 61 GLN HB2 1 69 ALA MB . . 3.510 3.049 2.618 3.379 . 0 0 "[ . 1 . 2]" 1
1372 1 61 GLN HB3 1 69 ALA H . . 4.410 2.953 2.496 3.255 . 0 0 "[ . 1 . 2]" 1
1373 1 61 GLN HB3 1 69 ALA MB . . 3.510 2.135 1.977 2.462 . 0 0 "[ . 1 . 2]" 1
1374 1 61 GLN QG 1 62 ASN H . . 4.120 2.864 2.256 3.818 . 0 0 "[ . 1 . 2]" 1
1375 1 62 ASN H 1 63 ASN H . . 4.910 4.547 4.318 4.619 . 0 0 "[ . 1 . 2]" 1
1376 1 62 ASN H 1 68 TYR QD . . 4.940 4.504 3.764 4.899 . 0 0 "[ . 1 . 2]" 1
1377 1 62 ASN HA 1 63 ASN H . . 2.900 2.275 2.146 2.369 . 0 0 "[ . 1 . 2]" 1
1378 1 62 ASN HA 1 68 TYR HA . . 3.910 3.020 2.444 3.889 . 0 0 "[ . 1 . 2]" 1
1379 1 62 ASN HA 1 68 TYR QD . . 3.670 2.965 2.141 3.403 . 0 0 "[ . 1 . 2]" 1
1380 1 62 ASN HA 1 68 TYR QE . . 4.190 3.709 2.710 4.175 . 0 0 "[ . 1 . 2]" 1
1381 1 62 ASN HA 1 69 ALA H . . 4.600 4.066 3.641 4.561 . 0 0 "[ . 1 . 2]" 1
1382 1 62 ASN QB 1 63 ASN H . . 3.940 3.136 2.496 3.958 0.018 3 0 "[ . 1 . 2]" 1
1383 1 62 ASN QB 1 68 TYR QD . . 5.340 3.759 2.878 4.631 . 0 0 "[ . 1 . 2]" 1
1384 1 62 ASN QB 1 68 TYR QE . . 4.570 3.266 2.206 4.341 . 0 0 "[ . 1 . 2]" 1
1385 1 62 ASN HB2 1 63 ASN H . . 4.580 3.816 2.555 4.389 . 0 0 "[ . 1 . 2]" 1
1386 1 62 ASN HB3 1 63 ASN H . . 4.580 3.458 2.533 4.504 . 0 0 "[ . 1 . 2]" 1
1387 1 62 ASN QD 1 68 TYR QE . . 4.060 2.568 1.939 3.708 . 0 0 "[ . 1 . 2]" 1
1388 1 62 ASN HD21 1 68 TYR QE . . 4.680 2.849 1.976 4.232 . 0 0 "[ . 1 . 2]" 1
1389 1 62 ASN HD22 1 68 TYR QE . . 4.680 3.388 2.539 4.614 . 0 0 "[ . 1 . 2]" 1
1390 1 63 ASN H 1 63 ASN HB2 . . 3.940 2.673 2.444 2.855 . 0 0 "[ . 1 . 2]" 1
1391 1 63 ASN H 1 63 ASN QB . . 3.240 2.621 2.408 2.788 . 0 0 "[ . 1 . 2]" 1
1392 1 63 ASN H 1 63 ASN HB3 . . 3.940 3.793 3.644 3.901 . 0 0 "[ . 1 . 2]" 1
1393 1 63 ASN H 1 63 ASN HD21 . . 4.680 3.458 3.106 3.829 . 0 0 "[ . 1 . 2]" 1
1394 1 63 ASN H 1 63 ASN QD . . 4.020 3.349 3.045 3.664 . 0 0 "[ . 1 . 2]" 1
1395 1 63 ASN H 1 63 ASN HD22 . . 4.680 4.517 4.334 4.671 . 0 0 "[ . 1 . 2]" 1
1396 1 63 ASN H 1 64 LYS H . . 4.590 4.415 4.095 4.509 . 0 0 "[ . 1 . 2]" 1
1397 1 63 ASN H 1 64 LYS HA . . 5.040 4.973 4.728 5.041 0.001 18 0 "[ . 1 . 2]" 1
1398 1 63 ASN H 1 65 ASP H . . 4.750 4.512 4.276 4.748 . 0 0 "[ . 1 . 2]" 1
1399 1 63 ASN H 1 68 TYR HA . . 4.040 3.746 2.782 3.989 . 0 0 "[ . 1 . 2]" 1
1400 1 63 ASN H 1 68 TYR QD . . 5.140 4.554 3.401 5.078 . 0 0 "[ . 1 . 2]" 1
1401 1 63 ASN H 1 68 TYR QE . . 5.500 4.803 3.955 5.441 . 0 0 "[ . 1 . 2]" 1
1402 1 63 ASN H 1 69 ALA H . . 5.500 5.157 4.007 5.451 . 0 0 "[ . 1 . 2]" 1
1403 1 63 ASN QB 1 63 ASN QD . . 2.980 2.082 2.064 2.108 . 0 0 "[ . 1 . 2]" 1
1404 1 63 ASN QB 1 65 ASP H . . 3.650 2.494 2.290 3.013 . 0 0 "[ . 1 . 2]" 1
1405 1 63 ASN QB 1 67 THR H . . 3.960 2.777 2.320 3.611 . 0 0 "[ . 1 . 2]" 1
1406 1 63 ASN HB2 1 63 ASN HD22 . . 4.030 3.440 3.433 3.451 . 0 0 "[ . 1 . 2]" 1
1407 1 63 ASN HB2 1 65 ASP H . . 4.170 3.064 2.668 3.608 . 0 0 "[ . 1 . 2]" 1
1408 1 63 ASN HB2 1 67 THR H . . 4.640 2.830 2.348 3.794 . 0 0 "[ . 1 . 2]" 1
1409 1 63 ASN HB3 1 63 ASN HD22 . . 4.030 3.966 3.839 4.011 . 0 0 "[ . 1 . 2]" 1
1410 1 63 ASN HB3 1 65 ASP H . . 4.170 2.652 2.405 3.228 . 0 0 "[ . 1 . 2]" 1
1411 1 63 ASN HB3 1 67 THR H . . 4.640 4.118 3.608 4.531 . 0 0 "[ . 1 . 2]" 1
1412 1 63 ASN QD 1 67 THR H . . 4.850 3.946 3.262 4.848 . 0 0 "[ . 1 . 2]" 1
1413 1 63 ASN QD 1 69 ALA H . . 4.180 3.056 2.366 3.682 . 0 0 "[ . 1 . 2]" 1
1414 1 63 ASN QD 1 69 ALA MB . . 3.510 2.484 2.054 3.270 . 0 0 "[ . 1 . 2]" 1
1415 1 63 ASN HD21 1 68 TYR HA . . 4.880 3.060 2.442 3.710 . 0 0 "[ . 1 . 2]" 1
1416 1 63 ASN HD21 1 69 ALA H . . 4.800 3.652 3.039 4.271 . 0 0 "[ . 1 . 2]" 1
1417 1 63 ASN HD21 1 69 ALA MB . . 4.200 3.609 2.740 3.932 . 0 0 "[ . 1 . 2]" 1
1418 1 63 ASN HD22 1 68 TYR HA . . 4.880 3.805 3.030 4.661 . 0 0 "[ . 1 . 2]" 1
1419 1 63 ASN HD22 1 69 ALA H . . 4.800 3.372 2.441 4.401 . 0 0 "[ . 1 . 2]" 1
1420 1 63 ASN HD22 1 69 ALA MB . . 4.200 2.556 2.068 3.546 . 0 0 "[ . 1 . 2]" 1
1421 1 64 LYS H 1 64 LYS HG2 . . 4.850 4.147 1.955 4.719 . 0 0 "[ . 1 . 2]" 1
1422 1 64 LYS H 1 64 LYS HG3 . . 4.850 3.916 2.830 4.616 . 0 0 "[ . 1 . 2]" 1
1423 1 64 LYS H 1 65 ASP H . . 4.110 2.724 2.257 3.388 . 0 0 "[ . 1 . 2]" 1
1424 1 64 LYS HA 1 64 LYS HD2 . . 4.750 4.089 2.880 4.704 . 0 0 "[ . 1 . 2]" 1
1425 1 64 LYS HA 1 64 LYS QD . . 4.150 3.541 2.142 4.126 . 0 0 "[ . 1 . 2]" 1
1426 1 64 LYS HA 1 64 LYS HD3 . . 4.750 4.073 2.159 4.758 0.008 15 0 "[ . 1 . 2]" 1
1427 1 64 LYS HA 1 64 LYS QE . . 5.200 4.298 1.970 4.950 . 0 0 "[ . 1 . 2]" 1
1428 1 64 LYS HA 1 64 LYS HG2 . . 3.970 2.900 2.219 3.621 . 0 0 "[ . 1 . 2]" 1
1429 1 64 LYS HA 1 64 LYS QG . . 3.370 2.341 2.177 2.876 . 0 0 "[ . 1 . 2]" 1
1430 1 64 LYS HA 1 64 LYS HG3 . . 3.970 2.759 2.199 3.822 . 0 0 "[ . 1 . 2]" 1
1431 1 64 LYS HA 1 66 GLY H . . 4.460 3.704 3.234 4.456 . 0 0 "[ . 1 . 2]" 1
1432 1 64 LYS QB 1 64 LYS QE . . 4.160 3.192 2.069 3.805 . 0 0 "[ . 1 . 2]" 1
1433 1 64 LYS QB 1 65 ASP H . . 4.280 3.365 2.926 3.939 . 0 0 "[ . 1 . 2]" 1
1434 1 64 LYS HB2 1 64 LYS HD2 . . 4.030 2.951 2.061 3.727 . 0 0 "[ . 1 . 2]" 1
1435 1 64 LYS HB2 1 64 LYS HD3 . . 4.030 3.126 2.158 3.888 . 0 0 "[ . 1 . 2]" 1
1436 1 64 LYS HB2 1 64 LYS QE . . 4.920 3.641 2.099 4.539 . 0 0 "[ . 1 . 2]" 1
1437 1 64 LYS HB2 1 65 ASP H . . 4.920 3.946 3.085 4.611 . 0 0 "[ . 1 . 2]" 1
1438 1 64 LYS HB3 1 64 LYS HD2 . . 4.030 3.031 2.242 3.898 . 0 0 "[ . 1 . 2]" 1
1439 1 64 LYS HB3 1 64 LYS HD3 . . 4.030 3.022 2.188 4.039 0.009 8 0 "[ . 1 . 2]" 1
1440 1 64 LYS HB3 1 64 LYS QE . . 4.920 3.718 2.091 4.410 . 0 0 "[ . 1 . 2]" 1
1441 1 64 LYS HB3 1 65 ASP H . . 4.920 3.789 3.100 4.415 . 0 0 "[ . 1 . 2]" 1
1442 1 65 ASP H 1 65 ASP QB . . 3.640 2.433 2.196 2.646 . 0 0 "[ . 1 . 2]" 1
1443 1 65 ASP H 1 66 GLY H . . 3.170 2.527 1.939 3.167 . 0 0 "[ . 1 . 2]" 1
1444 1 65 ASP H 1 66 GLY QA . . 4.840 4.303 3.839 4.662 . 0 0 "[ . 1 . 2]" 1
1445 1 65 ASP H 1 67 THR H . . 3.650 3.424 3.113 3.613 . 0 0 "[ . 1 . 2]" 1
1446 1 66 GLY H 1 67 THR H . . 3.200 2.436 1.805 2.990 . 0 0 "[ . 1 . 2]" 1
1447 1 66 GLY H 1 67 THR MG . . 4.900 4.460 3.719 4.871 . 0 0 "[ . 1 . 2]" 1
1448 1 66 GLY QA 1 67 THR HA . . 4.560 4.015 3.993 4.077 . 0 0 "[ . 1 . 2]" 1
1449 1 67 THR H 1 67 THR MG . . 3.410 3.066 2.731 3.342 . 0 0 "[ . 1 . 2]" 1
1450 1 67 THR H 1 68 TYR H . . 4.830 4.474 4.375 4.572 . 0 0 "[ . 1 . 2]" 1
1451 1 67 THR HA 1 67 THR MG . . 3.470 2.241 2.083 2.388 . 0 0 "[ . 1 . 2]" 1
1452 1 67 THR HA 1 68 TYR H . . 2.990 2.431 2.336 2.609 . 0 0 "[ . 1 . 2]" 1
1453 1 67 THR HA 1 68 TYR QD . . 4.260 2.973 2.414 3.522 . 0 0 "[ . 1 . 2]" 1
1454 1 67 THR HB 1 68 TYR H . . 3.190 2.340 2.023 2.633 . 0 0 "[ . 1 . 2]" 1
1455 1 67 THR MG 1 68 TYR H . . 3.840 3.515 3.186 3.681 . 0 0 "[ . 1 . 2]" 1
1456 1 67 THR MG 1 68 TYR QD . . 4.840 4.631 4.146 4.802 . 0 0 "[ . 1 . 2]" 1
1457 1 68 TYR H 1 68 TYR HB2 . . 3.730 2.670 2.534 2.822 . 0 0 "[ . 1 . 2]" 1
1458 1 68 TYR H 1 68 TYR HB3 . . 4.000 3.796 3.714 3.884 . 0 0 "[ . 1 . 2]" 1
1459 1 68 TYR H 1 68 TYR QD . . 3.490 2.738 2.299 2.993 . 0 0 "[ . 1 . 2]" 1
1460 1 68 TYR H 1 68 TYR QE . . 5.030 4.860 4.618 5.031 0.001 20 0 "[ . 1 . 2]" 1
1461 1 68 TYR H 1 69 ALA H . . 4.450 4.374 4.301 4.498 0.048 3 0 "[ . 1 . 2]" 1
1462 1 68 TYR HA 1 68 TYR QD . . 4.090 3.067 2.858 3.204 . 0 0 "[ . 1 . 2]" 1
1463 1 68 TYR HA 1 68 TYR QE . . 4.940 4.696 4.592 4.776 . 0 0 "[ . 1 . 2]" 1
1464 1 68 TYR HA 1 69 ALA H . . 2.810 2.197 2.153 2.338 . 0 0 "[ . 1 . 2]" 1
1465 1 68 TYR HA 1 69 ALA HA . . 4.570 4.380 4.372 4.419 . 0 0 "[ . 1 . 2]" 1
1466 1 68 TYR HA 1 69 ALA MB . . 4.020 3.922 3.863 3.983 . 0 0 "[ . 1 . 2]" 1
1467 1 68 TYR HB2 1 69 ALA H . . 4.250 4.077 3.699 4.222 . 0 0 "[ . 1 . 2]" 1
1468 1 68 TYR HB2 1 69 ALA HA . . 5.500 4.954 4.701 5.065 . 0 0 "[ . 1 . 2]" 1
1469 1 68 TYR HB2 1 70 VAL MG2 . . 3.900 3.511 3.336 3.711 . 0 0 "[ . 1 . 2]" 1
1470 1 68 TYR HB3 1 69 ALA H . . 3.620 3.058 2.591 3.273 . 0 0 "[ . 1 . 2]" 1
1471 1 68 TYR HB3 1 69 ALA HA . . 5.180 4.721 4.568 4.838 . 0 0 "[ . 1 . 2]" 1
1472 1 68 TYR HB3 1 70 VAL MG2 . . 3.690 3.157 3.007 3.327 . 0 0 "[ . 1 . 2]" 1
1473 1 68 TYR QD 1 69 ALA H . . 4.260 4.146 3.878 4.261 0.001 4 0 "[ . 1 . 2]" 1
1474 1 68 TYR QD 1 70 VAL MG2 . . 4.660 4.449 4.295 4.591 . 0 0 "[ . 1 . 2]" 1
1475 1 69 ALA H 1 69 ALA MB . . 2.950 2.344 2.153 2.437 . 0 0 "[ . 1 . 2]" 1
1476 1 69 ALA HA 1 70 VAL H . . 2.730 2.215 2.182 2.232 . 0 0 "[ . 1 . 2]" 1
1477 1 69 ALA HA 1 70 VAL HA . . 5.420 4.440 4.418 4.450 . 0 0 "[ . 1 . 2]" 1
1478 1 69 ALA HA 1 70 VAL HB . . 4.990 4.607 4.564 4.655 . 0 0 "[ . 1 . 2]" 1
1479 1 69 ALA MB 1 70 VAL H . . 3.540 3.530 3.467 3.552 0.012 11 0 "[ . 1 . 2]" 1
1480 1 70 VAL H 1 70 VAL HB . . 3.310 2.407 2.371 2.446 . 0 0 "[ . 1 . 2]" 1
1481 1 70 VAL H 1 70 VAL MG2 . . 3.220 2.782 2.634 2.912 . 0 0 "[ . 1 . 2]" 1
1482 1 70 VAL HA 1 70 VAL MG1 . . 3.540 2.472 2.412 2.516 . 0 0 "[ . 1 . 2]" 1
1483 1 70 VAL HA 1 70 VAL MG2 . . 3.750 2.227 2.153 2.342 . 0 0 "[ . 1 . 2]" 1
1484 1 70 VAL HA 1 71 THR H . . 2.780 2.205 2.160 2.229 . 0 0 "[ . 1 . 2]" 1
1485 1 70 VAL HA 1 71 THR HA . . 4.800 4.436 4.409 4.447 . 0 0 "[ . 1 . 2]" 1
1486 1 70 VAL HB 1 71 THR H . . 4.510 4.104 4.032 4.234 . 0 0 "[ . 1 . 2]" 1
1487 1 70 VAL HB 1 71 THR HA . . 5.410 4.812 4.741 4.879 . 0 0 "[ . 1 . 2]" 1
1488 1 70 VAL HB 1 84 MET ME . . 3.950 3.398 3.150 3.954 0.004 7 0 "[ . 1 . 2]" 1
1489 1 70 VAL MG1 1 71 THR H . . 3.170 2.263 2.015 2.521 . 0 0 "[ . 1 . 2]" 1
1490 1 70 VAL MG1 1 71 THR HA . . 4.080 3.221 3.135 3.343 . 0 0 "[ . 1 . 2]" 1
1491 1 70 VAL MG1 1 72 TYR H . . 4.480 4.367 4.197 4.481 0.001 10 0 "[ . 1 . 2]" 1
1492 1 70 VAL MG1 1 84 MET ME . . 3.500 2.919 2.699 3.421 . 0 0 "[ . 1 . 2]" 1
1493 1 70 VAL MG2 1 84 MET ME . . 3.660 2.628 2.177 3.402 . 0 0 "[ . 1 . 2]" 1
1494 1 71 THR H 1 71 THR HB . . 3.630 3.090 2.979 3.127 . 0 0 "[ . 1 . 2]" 1
1495 1 71 THR H 1 71 THR MG . . 4.110 4.002 3.970 4.011 . 0 0 "[ . 1 . 2]" 1
1496 1 71 THR H 1 72 TYR H . . 4.580 4.376 4.314 4.424 . 0 0 "[ . 1 . 2]" 1
1497 1 71 THR HA 1 71 THR MG . . 3.210 2.196 2.088 2.303 . 0 0 "[ . 1 . 2]" 1
1498 1 71 THR HA 1 72 TYR H . . 2.800 2.269 2.200 2.318 . 0 0 "[ . 1 . 2]" 1
1499 1 71 THR HA 1 72 TYR HA . . 4.520 4.448 4.412 4.473 . 0 0 "[ . 1 . 2]" 1
1500 1 71 THR HB 1 72 TYR H . . 3.740 3.546 3.409 3.734 . 0 0 "[ . 1 . 2]" 1
1501 1 71 THR HB 1 72 TYR HA . . 4.600 4.288 4.214 4.412 . 0 0 "[ . 1 . 2]" 1
1502 1 71 THR HB 1 73 VAL MG2 . . 4.310 4.156 4.013 4.264 . 0 0 "[ . 1 . 2]" 1
1503 1 71 THR MG 1 72 TYR H . . 3.600 2.165 1.884 2.337 . 0 0 "[ . 1 . 2]" 1
1504 1 71 THR MG 1 73 VAL MG2 . . 3.400 3.163 2.991 3.294 . 0 0 "[ . 1 . 2]" 1
1505 1 72 TYR H 1 72 TYR QD . . 3.510 3.061 2.892 3.279 . 0 0 "[ . 1 . 2]" 1
1506 1 72 TYR H 1 72 TYR QE . . 4.900 4.546 4.408 4.704 . 0 0 "[ . 1 . 2]" 1
1507 1 72 TYR HA 1 72 TYR QD . . 4.300 3.673 3.616 3.706 . 0 0 "[ . 1 . 2]" 1
1508 1 72 TYR HA 1 73 VAL H . . 2.890 2.164 2.143 2.198 . 0 0 "[ . 1 . 2]" 1
1509 1 72 TYR HA 1 73 VAL HA . . 5.280 4.391 4.387 4.402 . 0 0 "[ . 1 . 2]" 1
1510 1 72 TYR HA 1 73 VAL HB . . 4.660 4.563 4.461 4.620 . 0 0 "[ . 1 . 2]" 1
1511 1 72 TYR HA 1 73 VAL MG2 . . 4.070 3.587 3.475 3.711 . 0 0 "[ . 1 . 2]" 1
1512 1 72 TYR HB2 1 73 VAL H . . 3.740 3.249 3.065 3.416 . 0 0 "[ . 1 . 2]" 1
1513 1 72 TYR HB3 1 73 VAL H . . 4.440 4.299 4.198 4.383 . 0 0 "[ . 1 . 2]" 1
1514 1 72 TYR QD 1 72 TYR HH . . 4.660 4.285 4.255 4.322 . 0 0 "[ . 1 . 2]" 1
1515 1 72 TYR QD 1 73 VAL H . . 4.390 3.609 3.452 3.803 . 0 0 "[ . 1 . 2]" 1
1516 1 72 TYR QD 1 74 PRO HB2 . . 5.110 4.894 4.808 5.012 . 0 0 "[ . 1 . 2]" 1
1517 1 72 TYR QD 1 74 PRO HD2 . . 4.460 3.670 3.604 3.805 . 0 0 "[ . 1 . 2]" 1
1518 1 72 TYR QD 1 74 PRO HD3 . . 4.140 2.010 1.994 2.149 . 0 0 "[ . 1 . 2]" 1
1519 1 72 TYR QD 1 74 PRO HG2 . . 4.930 4.729 4.673 4.829 . 0 0 "[ . 1 . 2]" 1
1520 1 72 TYR QD 1 74 PRO HG3 . . 4.450 3.748 3.619 3.853 . 0 0 "[ . 1 . 2]" 1
1521 1 72 TYR QD 1 82 LEU MD1 . . 4.800 4.308 4.111 4.506 . 0 0 "[ . 1 . 2]" 1
1522 1 72 TYR QD 1 82 LEU MD2 . . 4.210 3.303 3.015 3.471 . 0 0 "[ . 1 . 2]" 1
1523 1 72 TYR QE 1 72 TYR HH . . 2.990 2.358 2.241 2.507 . 0 0 "[ . 1 . 2]" 1
1524 1 72 TYR QE 1 74 PRO HB2 . . 4.660 4.272 4.016 4.553 . 0 0 "[ . 1 . 2]" 1
1525 1 72 TYR QE 1 74 PRO HB3 . . 4.870 2.920 2.657 3.223 . 0 0 "[ . 1 . 2]" 1
1526 1 72 TYR QE 1 74 PRO HD2 . . 4.920 3.787 3.617 4.012 . 0 0 "[ . 1 . 2]" 1
1527 1 72 TYR QE 1 74 PRO HD3 . . 4.570 2.305 2.091 2.477 . 0 0 "[ . 1 . 2]" 1
1528 1 72 TYR QE 1 74 PRO HG2 . . 4.370 3.959 3.775 4.180 . 0 0 "[ . 1 . 2]" 1
1529 1 72 TYR QE 1 74 PRO HG3 . . 3.880 2.313 2.130 2.538 . 0 0 "[ . 1 . 2]" 1
1530 1 72 TYR QE 1 82 LEU MD1 . . 3.580 3.428 3.158 3.583 0.003 11 0 "[ . 1 . 2]" 1
1531 1 72 TYR QE 1 82 LEU MD2 . . 3.670 3.143 2.665 3.347 . 0 0 "[ . 1 . 2]" 1
1532 1 72 TYR QE 1 98 VAL MG1 . . 4.280 4.118 3.719 4.237 . 0 0 "[ . 1 . 2]" 1
1533 1 72 TYR QE 1 98 VAL MG2 . . 4.550 4.284 3.869 4.434 . 0 0 "[ . 1 . 2]" 1
1534 1 72 TYR QE 1 100 VAL MG2 . . 3.960 2.803 2.563 3.000 . 0 0 "[ . 1 . 2]" 1
1535 1 72 TYR HH 1 82 LEU MD1 . . 3.830 3.648 3.233 3.831 0.001 16 0 "[ . 1 . 2]" 1
1536 1 72 TYR HH 1 82 LEU MD2 . . 4.050 3.532 3.141 3.798 . 0 0 "[ . 1 . 2]" 1
1537 1 72 TYR HH 1 98 VAL HB . . 4.560 3.450 3.182 3.605 . 0 0 "[ . 1 . 2]" 1
1538 1 72 TYR HH 1 98 VAL MG1 . . 3.520 2.612 2.005 2.838 . 0 0 "[ . 1 . 2]" 1
1539 1 72 TYR HH 1 98 VAL MG2 . . 3.710 3.504 3.138 3.712 0.002 14 0 "[ . 1 . 2]" 1
1540 1 72 TYR HH 1 100 VAL MG2 . . 4.830 3.621 3.343 3.953 . 0 0 "[ . 1 . 2]" 1
1541 1 73 VAL H 1 73 VAL HB . . 3.180 2.566 2.524 2.630 . 0 0 "[ . 1 . 2]" 1
1542 1 73 VAL H 1 73 VAL MG1 . . 3.880 3.817 3.773 3.844 . 0 0 "[ . 1 . 2]" 1
1543 1 73 VAL H 1 73 VAL MG2 . . 3.460 2.672 2.572 2.856 . 0 0 "[ . 1 . 2]" 1
1544 1 73 VAL H 1 74 PRO HD2 . . 4.750 4.578 4.556 4.610 . 0 0 "[ . 1 . 2]" 1
1545 1 73 VAL H 1 74 PRO HD3 . . 4.960 4.145 4.101 4.204 . 0 0 "[ . 1 . 2]" 1
1546 1 73 VAL HA 1 73 VAL MG1 . . 3.400 2.352 2.292 2.436 . 0 0 "[ . 1 . 2]" 1
1547 1 73 VAL HA 1 73 VAL MG2 . . 3.410 2.410 2.349 2.452 . 0 0 "[ . 1 . 2]" 1
1548 1 73 VAL HA 1 74 PRO HD2 . . 3.430 1.913 1.912 1.914 . 0 0 "[ . 1 . 2]" 1
1549 1 73 VAL HA 1 74 PRO HD3 . . 3.560 2.504 2.475 2.533 . 0 0 "[ . 1 . 2]" 1
1550 1 73 VAL HA 1 74 PRO HG2 . . 4.910 4.116 4.115 4.118 . 0 0 "[ . 1 . 2]" 1
1551 1 73 VAL HA 1 74 PRO HG3 . . 4.850 4.384 4.369 4.399 . 0 0 "[ . 1 . 2]" 1
1552 1 73 VAL MG1 1 74 PRO HD2 . . 3.520 2.839 2.709 3.005 . 0 0 "[ . 1 . 2]" 1
1553 1 73 VAL MG1 1 74 PRO HD3 . . 4.200 4.049 3.961 4.134 . 0 0 "[ . 1 . 2]" 1
1554 1 73 VAL MG1 1 75 LEU MD1 . . 5.180 4.862 4.665 5.032 . 0 0 "[ . 1 . 2]" 1
1555 1 73 VAL MG1 1 75 LEU MD2 . . 3.250 3.008 2.735 3.204 . 0 0 "[ . 1 . 2]" 1
1556 1 73 VAL MG1 1 75 LEU HG . . 4.100 3.943 3.567 4.101 0.001 5 0 "[ . 1 . 2]" 1
1557 1 74 PRO HA 1 75 LEU H . . 3.000 2.163 2.151 2.304 . 0 0 "[ . 1 . 2]" 1
1558 1 74 PRO HA 1 75 LEU HG . . 4.500 4.039 3.848 4.261 . 0 0 "[ . 1 . 2]" 1
1559 1 74 PRO HA 1 80 TYR QE . . 4.610 3.426 3.080 3.759 . 0 0 "[ . 1 . 2]" 1
1560 1 74 PRO HB2 1 76 THR H . . 4.110 3.596 3.176 3.971 . 0 0 "[ . 1 . 2]" 1
1561 1 74 PRO HB2 1 80 TYR QE . . 3.890 2.746 2.311 3.022 . 0 0 "[ . 1 . 2]" 1
1562 1 74 PRO HB2 1 100 VAL HB . . 4.630 4.326 4.064 4.598 . 0 0 "[ . 1 . 2]" 1
1563 1 74 PRO HB2 1 100 VAL MG1 . . 3.380 2.707 2.459 2.921 . 0 0 "[ . 1 . 2]" 1
1564 1 74 PRO HB2 1 100 VAL MG2 . . 3.860 3.469 3.169 3.788 . 0 0 "[ . 1 . 2]" 1
1565 1 74 PRO HB3 1 80 TYR QE . . 4.520 2.882 2.487 3.103 . 0 0 "[ . 1 . 2]" 1
1566 1 74 PRO HB3 1 100 VAL HB . . 5.090 4.603 4.382 4.767 . 0 0 "[ . 1 . 2]" 1
1567 1 74 PRO HB3 1 100 VAL MG1 . . 3.460 3.357 3.204 3.462 0.002 15 0 "[ . 1 . 2]" 1
1568 1 74 PRO HB3 1 100 VAL MG2 . . 3.980 2.962 2.648 3.282 . 0 0 "[ . 1 . 2]" 1
1569 1 74 PRO HG2 1 80 TYR QE . . 4.990 4.733 4.365 4.997 0.007 9 0 "[ . 1 . 2]" 1
1570 1 74 PRO HG2 1 100 VAL MG1 . . 3.510 2.864 2.656 3.032 . 0 0 "[ . 1 . 2]" 1
1571 1 74 PRO HG2 1 100 VAL MG2 . . 4.080 3.879 3.615 4.066 . 0 0 "[ . 1 . 2]" 1
1572 1 74 PRO HG3 1 100 VAL MG1 . . 3.550 2.503 2.226 2.875 . 0 0 "[ . 1 . 2]" 1
1573 1 74 PRO HG3 1 100 VAL MG2 . . 3.810 2.640 2.321 2.892 . 0 0 "[ . 1 . 2]" 1
1574 1 75 LEU H 1 75 LEU QB . . 3.120 2.388 2.283 2.501 . 0 0 "[ . 1 . 2]" 1
1575 1 75 LEU H 1 75 LEU MD1 . . 4.260 3.579 3.356 3.728 . 0 0 "[ . 1 . 2]" 1
1576 1 75 LEU H 1 75 LEU MD2 . . 4.090 3.652 3.415 3.844 . 0 0 "[ . 1 . 2]" 1
1577 1 75 LEU H 1 75 LEU HG . . 3.980 2.496 2.125 2.757 . 0 0 "[ . 1 . 2]" 1
1578 1 75 LEU H 1 76 THR H . . 3.050 2.426 2.237 2.823 . 0 0 "[ . 1 . 2]" 1
1579 1 75 LEU H 1 76 THR MG . . 4.780 3.857 3.576 4.373 . 0 0 "[ . 1 . 2]" 1
1580 1 75 LEU H 1 80 TYR QE . . 5.340 4.129 3.842 4.332 . 0 0 "[ . 1 . 2]" 1
1581 1 75 LEU HA 1 75 LEU MD1 . . 4.030 3.897 3.851 3.934 . 0 0 "[ . 1 . 2]" 1
1582 1 75 LEU HA 1 75 LEU MD2 . . 2.920 2.192 1.986 2.381 . 0 0 "[ . 1 . 2]" 1
1583 1 75 LEU HA 1 75 LEU HG . . 3.720 2.992 2.900 3.108 . 0 0 "[ . 1 . 2]" 1
1584 1 75 LEU QB 1 75 LEU MD1 . . 2.720 2.061 2.000 2.097 . 0 0 "[ . 1 . 2]" 1
1585 1 75 LEU QB 1 75 LEU MD2 . . 2.840 2.203 2.118 2.317 . 0 0 "[ . 1 . 2]" 1
1586 1 75 LEU QB 1 76 THR H . . 3.490 2.682 2.404 2.988 . 0 0 "[ . 1 . 2]" 1
1587 1 75 LEU QB 1 76 THR HA . . 4.340 4.178 4.076 4.313 . 0 0 "[ . 1 . 2]" 1
1588 1 75 LEU QB 1 76 THR HB . . 4.340 3.677 3.596 3.834 . 0 0 "[ . 1 . 2]" 1
1589 1 75 LEU QB 1 76 THR MG . . 4.370 3.370 3.007 3.613 . 0 0 "[ . 1 . 2]" 1
1590 1 76 THR H 1 76 THR HB . . 4.080 3.133 2.984 3.296 . 0 0 "[ . 1 . 2]" 1
1591 1 76 THR H 1 76 THR MG . . 3.710 2.134 1.926 2.482 . 0 0 "[ . 1 . 2]" 1
1592 1 76 THR H 1 77 ALA H . . 4.600 4.408 4.239 4.503 . 0 0 "[ . 1 . 2]" 1
1593 1 76 THR H 1 80 TYR QE . . 4.440 3.901 3.649 4.069 . 0 0 "[ . 1 . 2]" 1
1594 1 76 THR HA 1 76 THR MG . . 3.450 3.198 3.190 3.206 . 0 0 "[ . 1 . 2]" 1
1595 1 76 THR HA 1 77 ALA H . . 3.170 2.216 2.154 2.333 . 0 0 "[ . 1 . 2]" 1
1596 1 76 THR HA 1 77 ALA HA . . 5.240 4.340 4.327 4.359 . 0 0 "[ . 1 . 2]" 1
1597 1 76 THR HB 1 77 ALA H . . 4.200 4.064 3.752 4.205 0.005 2 0 "[ . 1 . 2]" 1
1598 1 76 THR MG 1 77 ALA H . . 4.340 3.801 3.533 4.004 . 0 0 "[ . 1 . 2]" 1
1599 1 77 ALA H 1 77 ALA MB . . 3.260 2.103 2.027 2.224 . 0 0 "[ . 1 . 2]" 1
1600 1 77 ALA H 1 78 GLY H . . 4.950 4.627 4.584 4.638 . 0 0 "[ . 1 . 2]" 1
1601 1 77 ALA HA 1 78 GLY H . . 2.960 2.326 2.246 2.426 . 0 0 "[ . 1 . 2]" 1
1602 1 77 ALA HA 1 78 GLY HA3 . . 5.500 4.371 4.350 4.391 . 0 0 "[ . 1 . 2]" 1
1603 1 77 ALA HA 1 80 TYR QE . . 4.820 3.197 2.755 3.488 . 0 0 "[ . 1 . 2]" 1
1604 1 77 ALA HA 1 100 VAL H . . 5.240 4.917 4.397 5.104 . 0 0 "[ . 1 . 2]" 1
1605 1 77 ALA HA 1 100 VAL HB . . 3.780 2.917 2.318 3.164 . 0 0 "[ . 1 . 2]" 1
1606 1 77 ALA HA 1 100 VAL MG1 . . 3.320 2.282 1.962 2.742 . 0 0 "[ . 1 . 2]" 1
1607 1 77 ALA HA 1 100 VAL MG2 . . 4.600 4.192 3.758 4.391 . 0 0 "[ . 1 . 2]" 1
1608 1 77 ALA MB 1 78 GLY H . . 3.100 2.666 2.449 2.868 . 0 0 "[ . 1 . 2]" 1
1609 1 77 ALA MB 1 78 GLY HA2 . . 3.960 3.792 3.657 3.895 . 0 0 "[ . 1 . 2]" 1
1610 1 77 ALA MB 1 100 VAL HB . . 4.150 3.859 3.358 4.089 . 0 0 "[ . 1 . 2]" 1
1611 1 77 ALA MB 1 101 GLU H . . 5.500 4.390 3.911 4.631 . 0 0 "[ . 1 . 2]" 1
1612 1 77 ALA MB 1 101 GLU HA . . 4.230 3.197 2.739 3.407 . 0 0 "[ . 1 . 2]" 1
1613 1 77 ALA MB 1 101 GLU HB3 . . 5.500 4.791 4.418 4.935 . 0 0 "[ . 1 . 2]" 1
1614 1 77 ALA MB 1 102 PRO HA . . 3.240 2.310 2.064 2.599 . 0 0 "[ . 1 . 2]" 1
1615 1 77 ALA MB 1 102 PRO HB2 . . 4.460 4.019 3.804 4.403 . 0 0 "[ . 1 . 2]" 1
1616 1 77 ALA MB 1 102 PRO HB3 . . 3.410 2.786 2.536 3.196 . 0 0 "[ . 1 . 2]" 1
1617 1 77 ALA MB 1 102 PRO HD2 . . 4.160 4.066 3.717 4.168 0.008 11 0 "[ . 1 . 2]" 1
1618 1 77 ALA MB 1 102 PRO HD3 . . 3.670 2.907 2.583 3.041 . 0 0 "[ . 1 . 2]" 1
1619 1 78 GLY H 1 79 MET H . . 4.620 4.418 4.375 4.465 . 0 0 "[ . 1 . 2]" 1
1620 1 78 GLY H 1 80 TYR QE . . 4.430 3.765 3.401 4.160 . 0 0 "[ . 1 . 2]" 1
1621 1 78 GLY H 1 99 LYS HA . . 5.140 4.980 4.510 5.141 0.001 5 0 "[ . 1 . 2]" 1
1622 1 78 GLY H 1 100 VAL H . . 3.670 3.137 2.747 3.331 . 0 0 "[ . 1 . 2]" 1
1623 1 78 GLY H 1 100 VAL HA . . 4.800 4.579 4.430 4.715 . 0 0 "[ . 1 . 2]" 1
1624 1 78 GLY H 1 100 VAL HB . . 3.230 2.325 1.991 2.568 . 0 0 "[ . 1 . 2]" 1
1625 1 78 GLY H 1 100 VAL MG1 . . 3.780 3.166 2.786 3.577 . 0 0 "[ . 1 . 2]" 1
1626 1 78 GLY H 1 100 VAL MG2 . . 4.320 3.943 3.648 4.156 . 0 0 "[ . 1 . 2]" 1
1627 1 78 GLY HA2 1 79 MET H . . 3.110 2.583 2.474 2.752 . 0 0 "[ . 1 . 2]" 1
1628 1 78 GLY HA2 1 99 LYS QG . . 4.500 4.344 4.061 4.503 0.003 11 0 "[ . 1 . 2]" 1
1629 1 78 GLY HA2 1 100 VAL H . . 4.800 4.120 3.937 4.329 . 0 0 "[ . 1 . 2]" 1
1630 1 78 GLY HA3 1 79 MET H . . 3.000 2.548 2.391 2.657 . 0 0 "[ . 1 . 2]" 1
1631 1 78 GLY HA3 1 100 VAL H . . 5.110 4.921 4.675 5.081 . 0 0 "[ . 1 . 2]" 1
1632 1 79 MET H 1 79 MET HB2 . . 3.800 2.319 2.172 2.479 . 0 0 "[ . 1 . 2]" 1
1633 1 79 MET H 1 79 MET QB . . 3.080 2.290 2.152 2.437 . 0 0 "[ . 1 . 2]" 1
1634 1 79 MET H 1 79 MET HB3 . . 3.800 3.552 3.480 3.599 . 0 0 "[ . 1 . 2]" 1
1635 1 79 MET H 1 79 MET HG2 . . 3.950 2.660 2.230 3.142 . 0 0 "[ . 1 . 2]" 1
1636 1 79 MET H 1 79 MET QG . . 3.280 2.594 2.204 2.991 . 0 0 "[ . 1 . 2]" 1
1637 1 79 MET H 1 79 MET HG3 . . 3.950 3.746 3.460 3.899 . 0 0 "[ . 1 . 2]" 1
1638 1 79 MET H 1 80 TYR H . . 4.680 4.501 4.393 4.591 . 0 0 "[ . 1 . 2]" 1
1639 1 79 MET H 1 99 LYS HA . . 4.970 4.789 4.425 4.974 0.004 7 0 "[ . 1 . 2]" 1
1640 1 79 MET H 1 100 VAL H . . 5.080 4.732 4.398 5.012 . 0 0 "[ . 1 . 2]" 1
1641 1 79 MET HA 1 79 MET ME . . 3.770 2.739 1.830 3.443 . 0 0 "[ . 1 . 2]" 1
1642 1 79 MET HA 1 80 TYR H . . 2.880 2.150 2.141 2.186 . 0 0 "[ . 1 . 2]" 1
1643 1 79 MET HA 1 80 TYR HB2 . . 4.830 4.269 4.220 4.319 . 0 0 "[ . 1 . 2]" 1
1644 1 79 MET HA 1 98 VAL H . . 4.520 4.305 4.006 4.479 . 0 0 "[ . 1 . 2]" 1
1645 1 79 MET HA 1 99 LYS H . . 5.360 4.910 4.579 5.290 . 0 0 "[ . 1 . 2]" 1
1646 1 79 MET HA 1 99 LYS HA . . 4.150 2.650 2.228 3.029 . 0 0 "[ . 1 . 2]" 1
1647 1 79 MET HA 1 100 VAL H . . 3.920 3.380 3.011 3.914 . 0 0 "[ . 1 . 2]" 1
1648 1 79 MET QB 1 80 TYR H . . 3.860 3.289 3.016 3.525 . 0 0 "[ . 1 . 2]" 1
1649 1 79 MET ME 1 79 MET HG2 . . 3.880 3.102 2.340 3.398 . 0 0 "[ . 1 . 2]" 1
1650 1 79 MET ME 1 79 MET QG . . 3.300 2.364 2.246 2.507 . 0 0 "[ . 1 . 2]" 1
1651 1 79 MET ME 1 79 MET HG3 . . 3.880 2.695 2.282 3.401 . 0 0 "[ . 1 . 2]" 1
1652 1 79 MET ME 1 80 TYR H . . 4.010 3.148 1.948 3.920 . 0 0 "[ . 1 . 2]" 1
1653 1 79 MET ME 1 97 ARG H . . 5.290 5.043 4.673 5.288 . 0 0 "[ . 1 . 2]" 1
1654 1 79 MET ME 1 97 ARG HB2 . . 3.800 2.572 2.138 3.779 . 0 0 "[ . 1 . 2]" 1
1655 1 79 MET ME 1 97 ARG HB3 . . 3.800 3.270 1.871 3.804 0.004 19 0 "[ . 1 . 2]" 1
1656 1 79 MET ME 1 97 ARG HD2 . . 4.850 3.256 2.446 4.394 . 0 0 "[ . 1 . 2]" 1
1657 1 79 MET ME 1 97 ARG HD3 . . 4.850 2.839 1.836 4.709 . 0 0 "[ . 1 . 2]" 1
1658 1 79 MET ME 1 98 VAL H . . 3.790 2.994 2.253 3.545 . 0 0 "[ . 1 . 2]" 1
1659 1 79 MET ME 1 98 VAL HA . . 4.410 3.623 2.954 4.299 . 0 0 "[ . 1 . 2]" 1
1660 1 79 MET ME 1 99 LYS H . . 4.010 3.460 2.902 4.013 0.003 15 0 "[ . 1 . 2]" 1
1661 1 79 MET ME 1 99 LYS HA . . 4.510 3.143 2.021 3.803 . 0 0 "[ . 1 . 2]" 1
1662 1 80 TYR H 1 80 TYR HB2 . . 3.530 2.328 2.258 2.436 . 0 0 "[ . 1 . 2]" 1
1663 1 80 TYR H 1 80 TYR HB3 . . 3.650 3.536 3.503 3.584 . 0 0 "[ . 1 . 2]" 1
1664 1 80 TYR H 1 80 TYR QD . . 4.120 3.167 2.951 3.301 . 0 0 "[ . 1 . 2]" 1
1665 1 80 TYR H 1 81 THR H . . 4.630 4.532 4.487 4.567 . 0 0 "[ . 1 . 2]" 1
1666 1 80 TYR H 1 97 ARG HA . . 4.740 4.500 4.186 4.699 . 0 0 "[ . 1 . 2]" 1
1667 1 80 TYR H 1 98 VAL H . . 3.610 2.912 2.665 3.180 . 0 0 "[ . 1 . 2]" 1
1668 1 80 TYR H 1 98 VAL HB . . 4.580 4.200 3.959 4.373 . 0 0 "[ . 1 . 2]" 1
1669 1 80 TYR H 1 98 VAL MG1 . . 5.200 4.790 4.502 4.979 . 0 0 "[ . 1 . 2]" 1
1670 1 80 TYR H 1 99 LYS HA . . 4.230 3.663 3.073 3.869 . 0 0 "[ . 1 . 2]" 1
1671 1 80 TYR H 1 100 VAL H . . 4.430 4.108 3.716 4.403 . 0 0 "[ . 1 . 2]" 1
1672 1 80 TYR HA 1 80 TYR QE . . 5.500 4.491 4.436 4.520 . 0 0 "[ . 1 . 2]" 1
1673 1 80 TYR HA 1 81 THR H . . 3.070 2.331 2.297 2.420 . 0 0 "[ . 1 . 2]" 1
1674 1 80 TYR HB2 1 81 THR H . . 4.060 4.004 3.851 4.063 0.003 9 0 "[ . 1 . 2]" 1
1675 1 80 TYR HB2 1 82 LEU MD1 . . 5.220 5.024 4.892 5.148 . 0 0 "[ . 1 . 2]" 1
1676 1 80 TYR HB2 1 82 LEU MD2 . . 4.770 3.788 3.618 4.298 . 0 0 "[ . 1 . 2]" 1
1677 1 80 TYR HB2 1 98 VAL H . . 4.440 3.598 3.355 3.844 . 0 0 "[ . 1 . 2]" 1
1678 1 80 TYR HB2 1 98 VAL HB . . 3.910 3.382 3.110 3.528 . 0 0 "[ . 1 . 2]" 1
1679 1 80 TYR HB2 1 98 VAL MG1 . . 4.530 4.350 4.103 4.532 0.002 13 0 "[ . 1 . 2]" 1
1680 1 80 TYR HB2 1 98 VAL MG2 . . 4.900 4.631 4.249 4.753 . 0 0 "[ . 1 . 2]" 1
1681 1 80 TYR HB2 1 100 VAL MG2 . . 4.290 2.892 2.688 3.164 . 0 0 "[ . 1 . 2]" 1
1682 1 80 TYR HB3 1 81 THR H . . 3.730 2.688 2.456 2.781 . 0 0 "[ . 1 . 2]" 1
1683 1 80 TYR HB3 1 82 LEU HA . . 5.330 4.852 4.731 4.983 . 0 0 "[ . 1 . 2]" 1
1684 1 80 TYR HB3 1 82 LEU MD1 . . 4.850 4.791 4.641 4.861 0.011 15 0 "[ . 1 . 2]" 1
1685 1 80 TYR HB3 1 82 LEU MD2 . . 4.320 2.863 2.604 3.388 . 0 0 "[ . 1 . 2]" 1
1686 1 80 TYR HB3 1 98 VAL H . . 4.580 4.333 4.110 4.578 . 0 0 "[ . 1 . 2]" 1
1687 1 80 TYR HB3 1 98 VAL HB . . 4.880 4.307 4.095 4.532 . 0 0 "[ . 1 . 2]" 1
1688 1 80 TYR HB3 1 98 VAL MG2 . . 5.200 4.998 4.557 5.197 . 0 0 "[ . 1 . 2]" 1
1689 1 80 TYR HB3 1 100 VAL MG2 . . 4.590 4.143 3.972 4.367 . 0 0 "[ . 1 . 2]" 1
1690 1 80 TYR QD 1 81 THR H . . 4.460 3.081 2.776 3.309 . 0 0 "[ . 1 . 2]" 1
1691 1 80 TYR QD 1 82 LEU MD2 . . 4.740 3.899 3.668 4.219 . 0 0 "[ . 1 . 2]" 1
1692 1 80 TYR QD 1 100 VAL H . . 4.540 3.660 3.337 4.013 . 0 0 "[ . 1 . 2]" 1
1693 1 80 TYR QD 1 100 VAL MG2 . . 5.020 2.013 1.902 2.234 . 0 0 "[ . 1 . 2]" 1
1694 1 80 TYR QE 1 100 VAL MG1 . . 4.150 3.078 2.707 3.361 . 0 0 "[ . 1 . 2]" 1
1695 1 80 TYR QE 1 100 VAL MG2 . . 3.860 2.936 2.558 3.219 . 0 0 "[ . 1 . 2]" 1
1696 1 81 THR H 1 81 THR HB . . 3.300 2.673 2.582 2.729 . 0 0 "[ . 1 . 2]" 1
1697 1 81 THR H 1 81 THR MG . . 4.090 3.869 3.825 3.898 . 0 0 "[ . 1 . 2]" 1
1698 1 81 THR H 1 82 LEU H . . 4.670 3.911 3.810 4.055 . 0 0 "[ . 1 . 2]" 1
1699 1 81 THR H 1 82 LEU HA . . 5.500 4.659 4.594 4.733 . 0 0 "[ . 1 . 2]" 1
1700 1 81 THR HA 1 82 LEU H . . 3.180 2.225 2.179 2.258 . 0 0 "[ . 1 . 2]" 1
1701 1 81 THR HA 1 97 ARG HA . . 4.360 2.841 2.333 3.275 . 0 0 "[ . 1 . 2]" 1
1702 1 81 THR HB 1 82 LEU H . . 4.570 4.450 4.398 4.493 . 0 0 "[ . 1 . 2]" 1
1703 1 81 THR MG 1 82 LEU H . . 3.490 3.268 3.136 3.395 . 0 0 "[ . 1 . 2]" 1
1704 1 81 THR MG 1 82 LEU HA . . 4.730 4.261 4.140 4.439 . 0 0 "[ . 1 . 2]" 1
1705 1 81 THR MG 1 83 THR H . . 4.930 4.538 4.273 4.726 . 0 0 "[ . 1 . 2]" 1
1706 1 81 THR MG 1 83 THR HA . . 4.720 4.398 4.297 4.514 . 0 0 "[ . 1 . 2]" 1
1707 1 81 THR MG 1 83 THR HB . . 5.120 4.728 4.449 4.922 . 0 0 "[ . 1 . 2]" 1
1708 1 81 THR MG 1 95 PRO HA . . 4.450 4.233 4.143 4.361 . 0 0 "[ . 1 . 2]" 1
1709 1 81 THR MG 1 95 PRO HB2 . . 3.180 2.758 2.608 2.933 . 0 0 "[ . 1 . 2]" 1
1710 1 81 THR MG 1 95 PRO HB3 . . 3.210 3.124 3.047 3.214 0.004 15 0 "[ . 1 . 2]" 1
1711 1 81 THR MG 1 95 PRO HG2 . . 4.620 4.445 4.283 4.600 . 0 0 "[ . 1 . 2]" 1
1712 1 81 THR MG 1 95 PRO HG3 . . 4.240 4.140 3.988 4.239 . 0 0 "[ . 1 . 2]" 1
1713 1 81 THR MG 1 96 ALA H . . 3.980 3.862 3.731 3.986 0.006 9 0 "[ . 1 . 2]" 1
1714 1 81 THR MG 1 97 ARG HA . . 4.770 4.297 3.929 4.774 0.004 10 0 "[ . 1 . 2]" 1
1715 1 82 LEU H 1 82 LEU HB2 . . 3.480 2.705 2.612 2.748 . 0 0 "[ . 1 . 2]" 1
1716 1 82 LEU H 1 82 LEU MD1 . . 4.090 3.397 3.288 3.505 . 0 0 "[ . 1 . 2]" 1
1717 1 82 LEU H 1 82 LEU MD2 . . 4.570 3.152 2.919 3.497 . 0 0 "[ . 1 . 2]" 1
1718 1 82 LEU H 1 82 LEU HG . . 3.550 1.934 1.898 2.117 . 0 0 "[ . 1 . 2]" 1
1719 1 82 LEU H 1 83 THR H . . 4.650 4.522 4.461 4.567 . 0 0 "[ . 1 . 2]" 1
1720 1 82 LEU H 1 94 PHE QD . . 4.850 4.702 4.504 4.852 0.002 12 0 "[ . 1 . 2]" 1
1721 1 82 LEU H 1 96 ALA H . . 3.720 3.246 3.019 3.370 . 0 0 "[ . 1 . 2]" 1
1722 1 82 LEU H 1 96 ALA MB . . 4.200 4.104 3.909 4.217 0.017 15 0 "[ . 1 . 2]" 1
1723 1 82 LEU H 1 97 ARG HA . . 4.130 3.289 2.671 3.652 . 0 0 "[ . 1 . 2]" 1
1724 1 82 LEU H 1 98 VAL H . . 4.660 4.439 4.115 4.596 . 0 0 "[ . 1 . 2]" 1
1725 1 82 LEU HA 1 82 LEU MD1 . . 4.090 3.975 3.937 3.999 . 0 0 "[ . 1 . 2]" 1
1726 1 82 LEU HA 1 82 LEU MD2 . . 3.320 2.444 2.209 2.559 . 0 0 "[ . 1 . 2]" 1
1727 1 82 LEU HA 1 82 LEU HG . . 3.860 3.227 3.064 3.327 . 0 0 "[ . 1 . 2]" 1
1728 1 82 LEU HA 1 83 THR H . . 2.790 2.151 2.139 2.184 . 0 0 "[ . 1 . 2]" 1
1729 1 82 LEU HA 1 83 THR HA . . 5.240 4.400 4.394 4.415 . 0 0 "[ . 1 . 2]" 1
1730 1 82 LEU HA 1 83 THR HB . . 4.960 4.704 4.668 4.767 . 0 0 "[ . 1 . 2]" 1
1731 1 82 LEU HA 1 96 ALA H . . 4.850 4.615 4.508 4.738 . 0 0 "[ . 1 . 2]" 1
1732 1 82 LEU HB2 1 82 LEU MD1 . . 3.490 2.257 2.081 2.337 . 0 0 "[ . 1 . 2]" 1
1733 1 82 LEU HB2 1 83 THR H . . 4.230 4.028 3.941 4.102 . 0 0 "[ . 1 . 2]" 1
1734 1 82 LEU HB2 1 94 PHE QD . . 3.840 2.567 2.313 2.761 . 0 0 "[ . 1 . 2]" 1
1735 1 82 LEU HB2 1 94 PHE QE . . 3.910 2.737 2.484 2.910 . 0 0 "[ . 1 . 2]" 1
1736 1 82 LEU HB2 1 95 PRO HA . . 4.860 4.122 3.890 4.327 . 0 0 "[ . 1 . 2]" 1
1737 1 82 LEU HB2 1 96 ALA H . . 3.790 2.631 2.375 2.853 . 0 0 "[ . 1 . 2]" 1
1738 1 82 LEU HB2 1 96 ALA MB . . 3.410 2.809 2.465 3.103 . 0 0 "[ . 1 . 2]" 1
1739 1 82 LEU HB3 1 82 LEU MD2 . . 3.140 2.181 2.111 2.309 . 0 0 "[ . 1 . 2]" 1
1740 1 82 LEU HB3 1 83 THR H . . 3.860 3.321 3.089 3.480 . 0 0 "[ . 1 . 2]" 1
1741 1 82 LEU HB3 1 94 PHE QD . . 4.130 2.983 2.680 3.211 . 0 0 "[ . 1 . 2]" 1
1742 1 82 LEU HB3 1 94 PHE QE . . 3.870 2.116 1.993 2.321 . 0 0 "[ . 1 . 2]" 1
1743 1 82 LEU HB3 1 96 ALA H . . 4.740 4.254 3.998 4.453 . 0 0 "[ . 1 . 2]" 1
1744 1 82 LEU HB3 1 96 ALA MB . . 4.560 4.135 3.826 4.451 . 0 0 "[ . 1 . 2]" 1
1745 1 82 LEU MD1 1 94 PHE QE . . 3.830 2.765 2.466 3.051 . 0 0 "[ . 1 . 2]" 1
1746 1 82 LEU MD1 1 94 PHE HZ . . 4.540 3.973 3.779 4.158 . 0 0 "[ . 1 . 2]" 1
1747 1 82 LEU MD1 1 96 ALA MB . . 3.670 2.330 1.990 2.612 . 0 0 "[ . 1 . 2]" 1
1748 1 82 LEU MD1 1 98 VAL H . . 4.470 4.350 4.049 4.475 0.005 15 0 "[ . 1 . 2]" 1
1749 1 82 LEU MD1 1 98 VAL HB . . 3.520 3.257 2.982 3.445 . 0 0 "[ . 1 . 2]" 1
1750 1 82 LEU MD1 1 98 VAL MG2 . . 2.890 1.858 1.758 1.965 . 0 0 "[ . 1 . 2]" 1
1751 1 82 LEU MD2 1 83 THR H . . 4.290 4.014 3.820 4.144 . 0 0 "[ . 1 . 2]" 1
1752 1 82 LEU MD2 1 94 PHE QD . . 5.070 4.705 4.440 4.887 . 0 0 "[ . 1 . 2]" 1
1753 1 82 LEU MD2 1 94 PHE QE . . 4.040 3.681 3.201 3.990 . 0 0 "[ . 1 . 2]" 1
1754 1 82 LEU MD2 1 98 VAL HB . . 4.160 3.686 3.447 3.991 . 0 0 "[ . 1 . 2]" 1
1755 1 82 LEU MD2 1 98 VAL MG2 . . 3.390 3.346 3.150 3.398 0.008 2 0 "[ . 1 . 2]" 1
1756 1 82 LEU HG 1 94 PHE QE . . 4.980 4.690 4.460 4.920 . 0 0 "[ . 1 . 2]" 1
1757 1 82 LEU HG 1 96 ALA H . . 5.250 4.210 3.996 4.357 . 0 0 "[ . 1 . 2]" 1
1758 1 82 LEU HG 1 96 ALA MB . . 4.360 3.821 3.493 4.008 . 0 0 "[ . 1 . 2]" 1
1759 1 82 LEU HG 1 98 VAL MG2 . . 3.770 3.019 2.633 3.450 . 0 0 "[ . 1 . 2]" 1
1760 1 83 THR H 1 83 THR HB . . 3.480 2.773 2.684 2.831 . 0 0 "[ . 1 . 2]" 1
1761 1 83 THR H 1 83 THR MG . . 4.130 3.913 3.874 3.940 . 0 0 "[ . 1 . 2]" 1
1762 1 83 THR H 1 84 MET H . . 4.650 4.074 3.934 4.207 . 0 0 "[ . 1 . 2]" 1
1763 1 83 THR H 1 95 PRO HB3 . . 5.500 5.393 5.268 5.499 . 0 0 "[ . 1 . 2]" 1
1764 1 83 THR HA 1 83 THR MG . . 3.230 2.304 2.202 2.422 . 0 0 "[ . 1 . 2]" 1
1765 1 83 THR HA 1 84 MET H . . 2.960 2.164 2.145 2.189 . 0 0 "[ . 1 . 2]" 1
1766 1 83 THR HA 1 84 MET HB3 . . 5.140 4.777 4.701 4.827 . 0 0 "[ . 1 . 2]" 1
1767 1 83 THR HA 1 90 LEU MD2 . . 3.730 3.478 3.213 3.682 . 0 0 "[ . 1 . 2]" 1
1768 1 83 THR HA 1 94 PHE HA . . 4.770 4.599 4.310 4.765 . 0 0 "[ . 1 . 2]" 1
1769 1 83 THR HA 1 94 PHE HB2 . . 4.180 3.976 3.612 4.137 . 0 0 "[ . 1 . 2]" 1
1770 1 83 THR HA 1 94 PHE HB3 . . 3.840 2.518 2.170 2.681 . 0 0 "[ . 1 . 2]" 1
1771 1 83 THR HA 1 94 PHE QD . . 3.750 2.847 2.436 3.086 . 0 0 "[ . 1 . 2]" 1
1772 1 83 THR HA 1 95 PRO HA . . 3.740 2.749 2.548 2.907 . 0 0 "[ . 1 . 2]" 1
1773 1 83 THR HA 1 95 PRO HB2 . . 4.740 4.534 4.329 4.690 . 0 0 "[ . 1 . 2]" 1
1774 1 83 THR HA 1 95 PRO HB3 . . 4.760 3.260 3.118 3.479 . 0 0 "[ . 1 . 2]" 1
1775 1 83 THR HA 1 96 ALA H . . 4.410 4.135 3.889 4.357 . 0 0 "[ . 1 . 2]" 1
1776 1 83 THR HB 1 84 MET H . . 4.370 4.329 4.274 4.371 0.001 19 0 "[ . 1 . 2]" 1
1777 1 83 THR MG 1 84 MET H . . 3.630 2.995 2.731 3.202 . 0 0 "[ . 1 . 2]" 1
1778 1 83 THR MG 1 84 MET HA . . 5.500 3.948 3.779 4.146 . 0 0 "[ . 1 . 2]" 1
1779 1 83 THR MG 1 90 LEU MD2 . . 2.820 2.259 1.982 2.497 . 0 0 "[ . 1 . 2]" 1
1780 1 83 THR MG 1 94 PHE HB2 . . 4.770 4.485 4.043 4.683 . 0 0 "[ . 1 . 2]" 1
1781 1 83 THR MG 1 94 PHE HB3 . . 4.380 3.755 3.381 3.912 . 0 0 "[ . 1 . 2]" 1
1782 1 83 THR MG 1 95 PRO HB2 . . 5.100 4.919 4.651 5.108 0.008 9 0 "[ . 1 . 2]" 1
1783 1 84 MET H 1 84 MET HB2 . . 3.740 2.861 2.764 2.996 . 0 0 "[ . 1 . 2]" 1
1784 1 84 MET H 1 84 MET HB3 . . 3.700 2.665 2.584 2.757 . 0 0 "[ . 1 . 2]" 1
1785 1 84 MET H 1 84 MET HG2 . . 4.940 4.573 4.479 4.774 . 0 0 "[ . 1 . 2]" 1
1786 1 84 MET H 1 84 MET QG . . 4.310 4.073 4.041 4.102 . 0 0 "[ . 1 . 2]" 1
1787 1 84 MET H 1 84 MET HG3 . . 4.940 4.580 4.432 4.661 . 0 0 "[ . 1 . 2]" 1
1788 1 84 MET H 1 85 LYS H . . 4.870 4.415 4.298 4.519 . 0 0 "[ . 1 . 2]" 1
1789 1 84 MET H 1 90 LEU MD1 . . 5.380 5.305 5.000 5.388 0.008 9 0 "[ . 1 . 2]" 1
1790 1 84 MET H 1 90 LEU MD2 . . 4.350 3.087 2.758 3.189 . 0 0 "[ . 1 . 2]" 1
1791 1 84 MET H 1 91 VAL MG2 . . 4.510 3.475 3.239 3.616 . 0 0 "[ . 1 . 2]" 1
1792 1 84 MET H 1 94 PHE HA . . 4.800 4.401 4.271 4.536 . 0 0 "[ . 1 . 2]" 1
1793 1 84 MET H 1 94 PHE HB2 . . 3.760 2.556 2.469 2.660 . 0 0 "[ . 1 . 2]" 1
1794 1 84 MET H 1 94 PHE HB3 . . 3.580 2.011 1.893 2.181 . 0 0 "[ . 1 . 2]" 1
1795 1 84 MET H 1 94 PHE QD . . 3.530 2.644 2.380 2.972 . 0 0 "[ . 1 . 2]" 1
1796 1 84 MET H 1 94 PHE QE . . 4.780 4.277 4.081 4.544 . 0 0 "[ . 1 . 2]" 1
1797 1 84 MET H 1 95 PRO HA . . 4.080 3.609 3.453 3.884 . 0 0 "[ . 1 . 2]" 1
1798 1 84 MET HA 1 85 LYS H . . 3.010 2.174 2.141 2.239 . 0 0 "[ . 1 . 2]" 1
1799 1 84 MET HB2 1 84 MET ME . . 3.080 2.448 2.283 2.760 . 0 0 "[ . 1 . 2]" 1
1800 1 84 MET HB2 1 85 LYS H . . 4.350 4.252 4.060 4.359 0.009 16 0 "[ . 1 . 2]" 1
1801 1 84 MET HB2 1 91 VAL MG2 . . 3.480 3.331 3.155 3.490 0.010 7 0 "[ . 1 . 2]" 1
1802 1 84 MET HB2 1 94 PHE QD . . 4.620 3.196 2.991 3.564 . 0 0 "[ . 1 . 2]" 1
1803 1 84 MET HB2 1 94 PHE QE . . 5.250 3.113 2.954 3.359 . 0 0 "[ . 1 . 2]" 1
1804 1 84 MET HB3 1 84 MET ME . . 3.520 3.294 1.986 3.516 . 0 0 "[ . 1 . 2]" 1
1805 1 84 MET HB3 1 85 LYS H . . 4.490 4.053 3.829 4.245 . 0 0 "[ . 1 . 2]" 1
1806 1 84 MET HB3 1 91 VAL HB . . 4.620 4.474 4.310 4.625 0.005 16 0 "[ . 1 . 2]" 1
1807 1 84 MET HB3 1 91 VAL MG2 . . 3.810 1.992 1.882 2.111 . 0 0 "[ . 1 . 2]" 1
1808 1 84 MET HB3 1 94 PHE QD . . 4.500 2.758 2.548 3.165 . 0 0 "[ . 1 . 2]" 1
1809 1 84 MET HB3 1 94 PHE QE . . 4.980 3.457 3.360 3.554 . 0 0 "[ . 1 . 2]" 1
1810 1 84 MET ME 1 84 MET HG2 . . 3.620 3.042 2.105 3.369 . 0 0 "[ . 1 . 2]" 1
1811 1 84 MET ME 1 84 MET QG . . 3.110 2.264 2.081 2.541 . 0 0 "[ . 1 . 2]" 1
1812 1 84 MET ME 1 84 MET HG3 . . 3.620 2.600 2.174 3.361 . 0 0 "[ . 1 . 2]" 1
1813 1 84 MET ME 1 94 PHE QD . . 5.010 3.996 3.203 4.367 . 0 0 "[ . 1 . 2]" 1
1814 1 84 MET ME 1 94 PHE QE . . 3.600 2.774 2.207 3.168 . 0 0 "[ . 1 . 2]" 1
1815 1 84 MET ME 1 94 PHE HZ . . 3.500 2.302 2.009 2.607 . 0 0 "[ . 1 . 2]" 1
1816 1 84 MET QG 1 85 LYS H . . 3.380 2.631 2.094 2.991 . 0 0 "[ . 1 . 2]" 1
1817 1 84 MET QG 1 91 VAL MG2 . . 3.070 2.452 2.081 2.653 . 0 0 "[ . 1 . 2]" 1
1818 1 84 MET HG2 1 85 LYS H . . 3.870 3.250 2.546 3.868 . 0 0 "[ . 1 . 2]" 1
1819 1 84 MET HG2 1 91 VAL MG2 . . 3.880 2.501 2.147 2.701 . 0 0 "[ . 1 . 2]" 1
1820 1 84 MET HG3 1 85 LYS H . . 3.870 2.961 2.103 3.463 . 0 0 "[ . 1 . 2]" 1
1821 1 84 MET HG3 1 91 VAL MG2 . . 3.880 3.592 2.789 3.885 0.005 7 0 "[ . 1 . 2]" 1
1822 1 85 LYS H 1 85 LYS HB2 . . 3.680 2.555 2.450 2.721 . 0 0 "[ . 1 . 2]" 1
1823 1 85 LYS H 1 85 LYS HB3 . . 3.780 3.650 3.572 3.748 . 0 0 "[ . 1 . 2]" 1
1824 1 85 LYS H 1 85 LYS HG2 . . 5.040 4.208 4.048 4.364 . 0 0 "[ . 1 . 2]" 1
1825 1 85 LYS H 1 85 LYS HG3 . . 3.950 3.752 3.591 3.950 0.000 12 0 "[ . 1 . 2]" 1
1826 1 85 LYS H 1 86 TYR H . . 4.720 4.217 4.127 4.298 . 0 0 "[ . 1 . 2]" 1
1827 1 85 LYS H 1 91 VAL MG2 . . 4.380 4.086 3.804 4.268 . 0 0 "[ . 1 . 2]" 1
1828 1 85 LYS HA 1 85 LYS HD2 . . 4.640 4.248 3.978 4.421 . 0 0 "[ . 1 . 2]" 1
1829 1 85 LYS HA 1 85 LYS QD . . 4.020 3.698 3.658 3.835 . 0 0 "[ . 1 . 2]" 1
1830 1 85 LYS HA 1 85 LYS HD3 . . 4.640 4.107 3.935 4.444 . 0 0 "[ . 1 . 2]" 1
1831 1 85 LYS HA 1 85 LYS HG2 . . 4.010 2.192 2.160 2.255 . 0 0 "[ . 1 . 2]" 1
1832 1 85 LYS HA 1 85 LYS HG3 . . 4.120 3.121 2.941 3.229 . 0 0 "[ . 1 . 2]" 1
1833 1 85 LYS HA 1 86 TYR H . . 2.950 2.142 2.140 2.149 . 0 0 "[ . 1 . 2]" 1
1834 1 85 LYS HA 1 86 TYR HA . . 4.400 4.390 4.387 4.392 . 0 0 "[ . 1 . 2]" 1
1835 1 85 LYS HA 1 86 TYR HB2 . . 5.090 4.378 4.334 4.469 . 0 0 "[ . 1 . 2]" 1
1836 1 85 LYS HA 1 86 TYR HB3 . . 5.240 4.822 4.707 4.904 . 0 0 "[ . 1 . 2]" 1
1837 1 85 LYS HA 1 89 GLU H . . 4.770 4.328 3.881 4.554 . 0 0 "[ . 1 . 2]" 1
1838 1 85 LYS HA 1 90 LEU HA . . 3.830 2.304 2.027 2.497 . 0 0 "[ . 1 . 2]" 1
1839 1 85 LYS HA 1 90 LEU MD2 . . 4.250 3.163 2.947 3.417 . 0 0 "[ . 1 . 2]" 1
1840 1 85 LYS HA 1 91 VAL H . . 3.960 3.431 3.303 3.631 . 0 0 "[ . 1 . 2]" 1
1841 1 85 LYS HA 1 91 VAL MG1 . . 4.430 3.934 3.785 4.094 . 0 0 "[ . 1 . 2]" 1
1842 1 85 LYS HA 1 91 VAL MG2 . . 3.950 3.288 3.150 3.445 . 0 0 "[ . 1 . 2]" 1
1843 1 85 LYS HB2 1 85 LYS QE . . 3.770 3.464 2.485 3.753 . 0 0 "[ . 1 . 2]" 1
1844 1 85 LYS HB2 1 86 TYR H . . 4.530 4.446 4.400 4.484 . 0 0 "[ . 1 . 2]" 1
1845 1 85 LYS HB2 1 88 GLY H . . 5.170 4.737 4.515 4.997 . 0 0 "[ . 1 . 2]" 1
1846 1 85 LYS HB2 1 89 GLU H . . 5.500 5.363 4.926 5.505 0.005 2 0 "[ . 1 . 2]" 1
1847 1 85 LYS HB2 1 90 LEU HA . . 5.490 4.689 4.366 4.841 . 0 0 "[ . 1 . 2]" 1
1848 1 85 LYS HB3 1 85 LYS QD . . 3.220 2.172 2.063 2.286 . 0 0 "[ . 1 . 2]" 1
1849 1 85 LYS HB3 1 85 LYS QE . . 4.060 3.760 3.142 3.960 . 0 0 "[ . 1 . 2]" 1
1850 1 85 LYS HB3 1 86 TYR H . . 3.680 3.507 3.403 3.572 . 0 0 "[ . 1 . 2]" 1
1851 1 85 LYS HB3 1 86 TYR HA . . 4.950 4.519 4.414 4.655 . 0 0 "[ . 1 . 2]" 1
1852 1 85 LYS HB3 1 88 GLY H . . 4.210 3.247 3.029 3.546 . 0 0 "[ . 1 . 2]" 1
1853 1 85 LYS HB3 1 89 GLU H . . 3.910 3.646 3.224 3.789 . 0 0 "[ . 1 . 2]" 1
1854 1 85 LYS QD 1 88 GLY QA . . 3.810 2.979 2.620 3.285 . 0 0 "[ . 1 . 2]" 1
1855 1 85 LYS QD 1 89 GLU H . . 4.140 3.981 3.811 4.145 0.005 16 0 "[ . 1 . 2]" 1
1856 1 85 LYS QD 1 90 LEU HA . . 4.820 3.862 3.701 4.103 . 0 0 "[ . 1 . 2]" 1
1857 1 85 LYS HD2 1 88 GLY HA2 . . 5.500 3.284 2.681 3.724 . 0 0 "[ . 1 . 2]" 1
1858 1 85 LYS HD2 1 88 GLY HA3 . . 5.500 4.839 4.146 5.315 . 0 0 "[ . 1 . 2]" 1
1859 1 85 LYS HD2 1 90 LEU HA . . 5.500 4.932 4.456 5.239 . 0 0 "[ . 1 . 2]" 1
1860 1 85 LYS HD3 1 88 GLY HA2 . . 5.500 3.871 3.304 4.424 . 0 0 "[ . 1 . 2]" 1
1861 1 85 LYS HD3 1 88 GLY HA3 . . 5.500 5.091 4.610 5.510 0.010 6 0 "[ . 1 . 2]" 1
1862 1 85 LYS HD3 1 90 LEU HA . . 5.500 4.043 3.890 4.295 . 0 0 "[ . 1 . 2]" 1
1863 1 85 LYS QE 1 85 LYS HG3 . . 3.430 2.250 2.092 2.670 . 0 0 "[ . 1 . 2]" 1
1864 1 85 LYS QE 1 90 LEU MD1 . . 4.320 3.569 2.902 4.331 0.011 16 0 "[ . 1 . 2]" 1
1865 1 85 LYS QE 1 90 LEU HG . . 4.350 2.850 2.069 3.910 . 0 0 "[ . 1 . 2]" 1
1866 1 85 LYS HG2 1 86 TYR H . . 4.270 3.916 3.814 4.108 . 0 0 "[ . 1 . 2]" 1
1867 1 85 LYS HG2 1 89 GLU H . . 4.950 4.644 4.174 4.895 . 0 0 "[ . 1 . 2]" 1
1868 1 85 LYS HG2 1 90 LEU H . . 4.650 3.424 2.843 3.691 . 0 0 "[ . 1 . 2]" 1
1869 1 85 LYS HG2 1 90 LEU HA . . 3.740 2.175 1.995 2.365 . 0 0 "[ . 1 . 2]" 1
1870 1 85 LYS HG2 1 90 LEU MD2 . . 3.520 2.366 2.143 2.741 . 0 0 "[ . 1 . 2]" 1
1871 1 85 LYS HG3 1 86 TYR H . . 5.460 5.117 4.948 5.254 . 0 0 "[ . 1 . 2]" 1
1872 1 85 LYS HG3 1 90 LEU H . . 5.370 5.059 4.429 5.355 . 0 0 "[ . 1 . 2]" 1
1873 1 85 LYS HG3 1 90 LEU HA . . 4.050 3.608 3.095 3.898 . 0 0 "[ . 1 . 2]" 1
1874 1 85 LYS HG3 1 90 LEU MD2 . . 3.630 2.256 1.973 2.678 . 0 0 "[ . 1 . 2]" 1
1875 1 86 TYR H 1 86 TYR HB2 . . 3.850 2.702 2.552 2.849 . 0 0 "[ . 1 . 2]" 1
1876 1 86 TYR H 1 86 TYR HB3 . . 4.040 2.731 2.611 2.782 . 0 0 "[ . 1 . 2]" 1
1877 1 86 TYR H 1 86 TYR QD . . 4.670 4.297 4.236 4.341 . 0 0 "[ . 1 . 2]" 1
1878 1 86 TYR H 1 87 GLY H . . 4.880 4.313 4.210 4.461 . 0 0 "[ . 1 . 2]" 1
1879 1 86 TYR H 1 88 GLY H . . 4.630 4.128 3.558 4.470 . 0 0 "[ . 1 . 2]" 1
1880 1 86 TYR H 1 89 GLU H . . 3.590 3.292 2.910 3.570 . 0 0 "[ . 1 . 2]" 1
1881 1 86 TYR H 1 89 GLU HB2 . . 5.270 4.113 3.918 4.308 . 0 0 "[ . 1 . 2]" 1
1882 1 86 TYR H 1 90 LEU HA . . 4.310 3.497 3.294 3.777 . 0 0 "[ . 1 . 2]" 1
1883 1 86 TYR H 1 91 VAL H . . 4.630 4.186 4.008 4.347 . 0 0 "[ . 1 . 2]" 1
1884 1 86 TYR H 1 91 VAL MG1 . . 3.740 3.090 2.955 3.233 . 0 0 "[ . 1 . 2]" 1
1885 1 86 TYR H 1 91 VAL MG2 . . 3.750 3.689 3.547 3.761 0.011 5 0 "[ . 1 . 2]" 1
1886 1 86 TYR HA 1 86 TYR QD . . 3.500 2.900 2.321 3.037 . 0 0 "[ . 1 . 2]" 1
1887 1 86 TYR HA 1 86 TYR QE . . 4.750 4.553 4.328 4.625 . 0 0 "[ . 1 . 2]" 1
1888 1 86 TYR HA 1 87 GLY H . . 2.990 2.149 2.142 2.160 . 0 0 "[ . 1 . 2]" 1
1889 1 86 TYR HA 1 87 GLY HA2 . . 4.620 4.380 4.378 4.386 . 0 0 "[ . 1 . 2]" 1
1890 1 86 TYR HA 1 87 GLY HA3 . . 5.090 4.383 4.359 4.427 . 0 0 "[ . 1 . 2]" 1
1891 1 86 TYR HA 1 88 GLY H . . 4.100 3.706 3.437 3.958 . 0 0 "[ . 1 . 2]" 1
1892 1 86 TYR HB2 1 87 GLY H . . 4.800 4.455 4.317 4.538 . 0 0 "[ . 1 . 2]" 1
1893 1 86 TYR HB2 1 91 VAL MG1 . . 3.900 2.522 2.388 2.680 . 0 0 "[ . 1 . 2]" 1
1894 1 86 TYR HB2 1 91 VAL MG2 . . 3.950 3.919 3.799 3.965 0.015 9 0 "[ . 1 . 2]" 1
1895 1 86 TYR HB3 1 87 GLY H . . 4.610 4.187 4.002 4.283 . 0 0 "[ . 1 . 2]" 1
1896 1 86 TYR HB3 1 91 VAL MG1 . . 4.080 3.018 2.736 3.354 . 0 0 "[ . 1 . 2]" 1
1897 1 86 TYR QD 1 87 GLY H . . 3.930 3.785 3.497 3.939 0.009 12 0 "[ . 1 . 2]" 1
1898 1 86 TYR QD 1 89 GLU HB2 . . 5.060 4.970 4.746 5.057 . 0 0 "[ . 1 . 2]" 1
1899 1 87 GLY H 1 89 GLU H . . 4.980 4.075 3.946 4.292 . 0 0 "[ . 1 . 2]" 1
1900 1 87 GLY HA2 1 89 GLU H . . 4.860 4.404 4.222 4.768 . 0 0 "[ . 1 . 2]" 1
1901 1 87 GLY HA3 1 89 GLU H . . 4.630 3.783 3.635 4.171 . 0 0 "[ . 1 . 2]" 1
1902 1 88 GLY H 1 89 GLU H . . 3.500 2.436 1.999 2.610 . 0 0 "[ . 1 . 2]" 1
1903 1 88 GLY H 1 89 GLU HG2 . . 5.500 5.259 4.412 5.504 0.004 11 0 "[ . 1 . 2]" 1
1904 1 88 GLY H 1 89 GLU HG3 . . 5.500 5.054 4.827 5.518 0.018 9 0 "[ . 1 . 2]" 1
1905 1 89 GLU H 1 89 GLU HB2 . . 3.600 2.694 2.619 2.775 . 0 0 "[ . 1 . 2]" 1
1906 1 89 GLU H 1 89 GLU HB3 . . 3.830 3.790 3.731 3.849 0.019 14 0 "[ . 1 . 2]" 1
1907 1 89 GLU H 1 89 GLU HG2 . . 3.540 3.342 2.970 3.539 . 0 0 "[ . 1 . 2]" 1
1908 1 89 GLU H 1 89 GLU HG3 . . 4.140 3.180 2.799 3.981 . 0 0 "[ . 1 . 2]" 1
1909 1 89 GLU H 1 90 LEU H . . 4.580 4.392 4.300 4.496 . 0 0 "[ . 1 . 2]" 1
1910 1 89 GLU HA 1 89 GLU HG2 . . 4.250 2.535 2.439 2.802 . 0 0 "[ . 1 . 2]" 1
1911 1 89 GLU HA 1 90 LEU H . . 3.070 2.180 2.148 2.241 . 0 0 "[ . 1 . 2]" 1
1912 1 89 GLU HA 1 90 LEU HB2 . . 5.500 4.314 4.276 4.353 . 0 0 "[ . 1 . 2]" 1
1913 1 89 GLU HA 1 90 LEU HG . . 5.160 4.585 4.511 4.666 . 0 0 "[ . 1 . 2]" 1
1914 1 89 GLU HB2 1 90 LEU H . . 4.140 4.045 3.881 4.133 . 0 0 "[ . 1 . 2]" 1
1915 1 89 GLU HB3 1 90 LEU H . . 3.920 3.129 2.871 3.329 . 0 0 "[ . 1 . 2]" 1
1916 1 89 GLU HG2 1 90 LEU H . . 4.820 4.535 4.372 4.838 0.018 5 0 "[ . 1 . 2]" 1
1917 1 89 GLU HG3 1 90 LEU H . . 5.500 5.361 5.236 5.493 . 0 0 "[ . 1 . 2]" 1
1918 1 90 LEU H 1 90 LEU HB2 . . 3.030 2.166 2.156 2.184 . 0 0 "[ . 1 . 2]" 1
1919 1 90 LEU H 1 90 LEU HB3 . . 3.520 3.482 3.469 3.494 . 0 0 "[ . 1 . 2]" 1
1920 1 90 LEU H 1 90 LEU MD1 . . 4.010 3.719 3.596 3.823 . 0 0 "[ . 1 . 2]" 1
1921 1 90 LEU H 1 90 LEU MD2 . . 4.040 3.933 3.863 4.041 0.001 16 0 "[ . 1 . 2]" 1
1922 1 90 LEU H 1 90 LEU HG . . 3.190 2.966 2.896 3.091 . 0 0 "[ . 1 . 2]" 1
1923 1 90 LEU H 1 91 VAL H . . 4.780 4.631 4.614 4.639 . 0 0 "[ . 1 . 2]" 1
1924 1 90 LEU HA 1 90 LEU MD1 . . 3.950 3.812 3.799 3.821 . 0 0 "[ . 1 . 2]" 1
1925 1 90 LEU HA 1 90 LEU MD2 . . 3.150 2.073 1.960 2.225 . 0 0 "[ . 1 . 2]" 1
1926 1 90 LEU HA 1 90 LEU HG . . 3.990 2.739 2.637 2.812 . 0 0 "[ . 1 . 2]" 1
1927 1 90 LEU HA 1 91 VAL H . . 3.060 2.274 2.235 2.334 . 0 0 "[ . 1 . 2]" 1
1928 1 90 LEU HA 1 91 VAL MG2 . . 3.960 3.401 3.351 3.441 . 0 0 "[ . 1 . 2]" 1
1929 1 90 LEU HB2 1 90 LEU MD1 . . 3.180 2.268 2.122 2.332 . 0 0 "[ . 1 . 2]" 1
1930 1 90 LEU HB2 1 90 LEU MD2 . . 3.540 3.178 3.170 3.182 . 0 0 "[ . 1 . 2]" 1
1931 1 90 LEU HB2 1 91 VAL H . . 4.300 4.109 4.002 4.188 . 0 0 "[ . 1 . 2]" 1
1932 1 90 LEU HB3 1 90 LEU MD1 . . 3.320 2.435 2.374 2.547 . 0 0 "[ . 1 . 2]" 1
1933 1 90 LEU HB3 1 90 LEU MD2 . . 3.240 2.317 2.231 2.373 . 0 0 "[ . 1 . 2]" 1
1934 1 90 LEU HB3 1 91 VAL H . . 4.100 2.852 2.677 2.984 . 0 0 "[ . 1 . 2]" 1
1935 1 90 LEU MD1 1 91 VAL H . . 4.540 4.524 4.390 4.554 0.014 6 0 "[ . 1 . 2]" 1
1936 1 90 LEU MD1 1 94 PHE HB2 . . 4.800 4.763 4.670 4.812 0.012 1 0 "[ . 1 . 2]" 1
1937 1 90 LEU MD1 1 94 PHE HB3 . . 4.970 4.873 4.657 4.971 0.001 14 0 "[ . 1 . 2]" 1
1938 1 90 LEU MD1 1 95 PRO HA . . 5.230 5.041 4.871 5.121 . 0 0 "[ . 1 . 2]" 1
1939 1 90 LEU MD1 1 95 PRO HD2 . . 3.730 3.415 3.273 3.545 . 0 0 "[ . 1 . 2]" 1
1940 1 90 LEU MD1 1 95 PRO HD3 . . 3.400 2.387 2.228 2.461 . 0 0 "[ . 1 . 2]" 1
1941 1 90 LEU MD1 1 95 PRO HG2 . . 4.910 4.903 4.782 4.921 0.011 11 0 "[ . 1 . 2]" 1
1942 1 90 LEU MD1 1 95 PRO HG3 . . 4.130 4.035 3.935 4.077 . 0 0 "[ . 1 . 2]" 1
1943 1 90 LEU MD2 1 91 VAL H . . 3.930 2.430 2.338 2.521 . 0 0 "[ . 1 . 2]" 1
1944 1 90 LEU MD2 1 94 PHE HB2 . . 4.210 2.815 2.592 2.896 . 0 0 "[ . 1 . 2]" 1
1945 1 90 LEU MD2 1 94 PHE HB3 . . 4.360 3.155 2.900 3.286 . 0 0 "[ . 1 . 2]" 1
1946 1 90 LEU MD2 1 95 PRO HA . . 4.230 3.904 3.713 4.015 . 0 0 "[ . 1 . 2]" 1
1947 1 90 LEU MD2 1 95 PRO HD2 . . 4.120 4.101 3.971 4.128 0.008 15 0 "[ . 1 . 2]" 1
1948 1 90 LEU MD2 1 95 PRO HD3 . . 3.390 2.750 2.636 2.799 . 0 0 "[ . 1 . 2]" 1
1949 1 90 LEU MD2 1 95 PRO HG2 . . 5.500 5.248 5.152 5.295 . 0 0 "[ . 1 . 2]" 1
1950 1 90 LEU MD2 1 95 PRO HG3 . . 4.670 4.479 4.393 4.546 . 0 0 "[ . 1 . 2]" 1
1951 1 90 LEU HG 1 91 VAL H . . 4.620 4.541 4.415 4.637 0.017 14 0 "[ . 1 . 2]" 1
1952 1 91 VAL H 1 91 VAL HB . . 3.540 3.524 3.504 3.543 0.003 8 0 "[ . 1 . 2]" 1
1953 1 91 VAL H 1 91 VAL MG1 . . 3.770 3.128 3.080 3.202 . 0 0 "[ . 1 . 2]" 1
1954 1 91 VAL H 1 91 VAL MG2 . . 3.340 1.826 1.805 1.857 . 0 0 "[ . 1 . 2]" 1
1955 1 91 VAL H 1 92 PRO HD2 . . 4.860 4.754 4.744 4.763 . 0 0 "[ . 1 . 2]" 1
1956 1 91 VAL H 1 92 PRO HD3 . . 5.500 5.094 5.085 5.100 . 0 0 "[ . 1 . 2]" 1
1957 1 91 VAL H 1 94 PHE HB2 . . 4.720 3.006 2.916 3.066 . 0 0 "[ . 1 . 2]" 1
1958 1 91 VAL HA 1 91 VAL MG1 . . 3.340 2.139 2.021 2.207 . 0 0 "[ . 1 . 2]" 1
1959 1 91 VAL HA 1 91 VAL MG2 . . 3.480 3.138 3.125 3.143 . 0 0 "[ . 1 . 2]" 1
1960 1 91 VAL HA 1 92 PRO HD2 . . 3.460 2.505 2.493 2.530 . 0 0 "[ . 1 . 2]" 1
1961 1 91 VAL HA 1 92 PRO HD3 . . 3.340 2.346 2.339 2.359 . 0 0 "[ . 1 . 2]" 1
1962 1 91 VAL HA 1 92 PRO HG2 . . 4.820 4.599 4.590 4.620 . 0 0 "[ . 1 . 2]" 1
1963 1 91 VAL HA 1 92 PRO QG . . 4.210 4.070 4.062 4.086 . 0 0 "[ . 1 . 2]" 1
1964 1 91 VAL HA 1 92 PRO HG3 . . 4.820 4.539 4.531 4.555 . 0 0 "[ . 1 . 2]" 1
1965 1 91 VAL HB 1 92 PRO HD2 . . 3.970 1.989 1.975 1.998 . 0 0 "[ . 1 . 2]" 1
1966 1 91 VAL HB 1 92 PRO HD3 . . 4.210 3.434 3.421 3.442 . 0 0 "[ . 1 . 2]" 1
1967 1 91 VAL HB 1 92 PRO HG2 . . 4.750 3.634 3.615 3.645 . 0 0 "[ . 1 . 2]" 1
1968 1 91 VAL HB 1 92 PRO QG . . 4.150 3.501 3.483 3.511 . 0 0 "[ . 1 . 2]" 1
1969 1 91 VAL HB 1 92 PRO HG3 . . 4.750 4.576 4.559 4.587 . 0 0 "[ . 1 . 2]" 1
1970 1 91 VAL HB 1 94 PHE QD . . 3.940 3.052 2.955 3.115 . 0 0 "[ . 1 . 2]" 1
1971 1 91 VAL MG1 1 92 PRO HD2 . . 3.500 2.277 2.182 2.386 . 0 0 "[ . 1 . 2]" 1
1972 1 91 VAL MG1 1 92 PRO HD3 . . 3.750 3.057 2.941 3.119 . 0 0 "[ . 1 . 2]" 1
1973 1 91 VAL MG1 1 94 PHE QD . . 4.030 4.016 3.977 4.043 0.013 14 0 "[ . 1 . 2]" 1
1974 1 91 VAL MG1 1 94 PHE QE . . 4.540 4.513 4.369 4.550 0.010 6 0 "[ . 1 . 2]" 1
1975 1 91 VAL MG2 1 92 PRO HD2 . . 4.280 3.687 3.669 3.695 . 0 0 "[ . 1 . 2]" 1
1976 1 91 VAL MG2 1 92 PRO HD3 . . 4.680 4.601 4.592 4.605 . 0 0 "[ . 1 . 2]" 1
1977 1 91 VAL MG2 1 93 HIS H . . 4.590 2.860 2.829 2.906 . 0 0 "[ . 1 . 2]" 1
1978 1 91 VAL MG2 1 93 HIS QB . . 4.750 3.134 3.063 3.240 . 0 0 "[ . 1 . 2]" 1
1979 1 91 VAL MG2 1 94 PHE H . . 4.880 3.057 2.772 3.258 . 0 0 "[ . 1 . 2]" 1
1980 1 91 VAL MG2 1 94 PHE HB2 . . 4.810 1.988 1.962 2.083 . 0 0 "[ . 1 . 2]" 1
1981 1 91 VAL MG2 1 94 PHE HB3 . . 4.920 3.517 3.482 3.609 . 0 0 "[ . 1 . 2]" 1
1982 1 91 VAL MG2 1 94 PHE QD . . 3.380 1.810 1.775 1.848 . 0 0 "[ . 1 . 2]" 1
1983 1 91 VAL MG2 1 94 PHE QE . . 4.220 2.896 2.805 2.961 . 0 0 "[ . 1 . 2]" 1
1984 1 92 PRO HA 1 93 HIS H . . 3.370 3.281 3.272 3.289 . 0 0 "[ . 1 . 2]" 1
1985 1 92 PRO HA 1 93 HIS HA . . 4.630 4.520 4.507 4.536 . 0 0 "[ . 1 . 2]" 1
1986 1 92 PRO HA 1 93 HIS HD2 . . 4.940 4.726 4.111 4.944 0.004 9 0 "[ . 1 . 2]" 1
1987 1 92 PRO HA 1 94 PHE H . . 3.840 3.725 3.696 3.813 . 0 0 "[ . 1 . 2]" 1
1988 1 92 PRO HB2 1 93 HIS H . . 4.130 3.991 3.979 4.004 . 0 0 "[ . 1 . 2]" 1
1989 1 92 PRO HB2 1 93 HIS HD2 . . 4.290 3.521 2.498 3.862 . 0 0 "[ . 1 . 2]" 1
1990 1 92 PRO HB3 1 93 HIS H . . 4.550 4.519 4.511 4.526 . 0 0 "[ . 1 . 2]" 1
1991 1 92 PRO HB3 1 93 HIS HD2 . . 4.630 4.588 3.977 4.680 0.050 11 0 "[ . 1 . 2]" 1
1992 1 92 PRO HD2 1 93 HIS H . . 4.870 3.065 3.047 3.085 . 0 0 "[ . 1 . 2]" 1
1993 1 92 PRO HD2 1 93 HIS HD2 . . 3.820 2.961 2.275 3.766 . 0 0 "[ . 1 . 2]" 1
1994 1 92 PRO HD3 1 93 HIS HD2 . . 5.020 4.317 3.832 4.899 . 0 0 "[ . 1 . 2]" 1
1995 1 92 PRO QG 1 93 HIS H . . 4.200 3.320 3.297 3.344 . 0 0 "[ . 1 . 2]" 1
1996 1 92 PRO QG 1 93 HIS HD2 . . 4.650 2.001 1.969 2.058 . 0 0 "[ . 1 . 2]" 1
1997 1 92 PRO HG2 1 93 HIS H . . 4.900 3.399 3.374 3.424 . 0 0 "[ . 1 . 2]" 1
1998 1 92 PRO HG2 1 93 HIS HD2 . . 5.410 2.010 1.979 2.068 . 0 0 "[ . 1 . 2]" 1
1999 1 92 PRO HG3 1 93 HIS H . . 4.900 4.658 4.638 4.678 . 0 0 "[ . 1 . 2]" 1
2000 1 92 PRO HG3 1 93 HIS HD2 . . 5.410 3.656 3.584 3.772 . 0 0 "[ . 1 . 2]" 1
2001 1 93 HIS H 1 93 HIS HD2 . . 5.040 2.940 2.488 3.463 . 0 0 "[ . 1 . 2]" 1
2002 1 93 HIS H 1 94 PHE H . . 3.310 2.227 2.060 2.322 . 0 0 "[ . 1 . 2]" 1
2003 1 93 HIS HA 1 93 HIS HD2 . . 5.110 3.873 3.121 4.126 . 0 0 "[ . 1 . 2]" 1
2004 1 93 HIS QB 1 94 PHE H . . 4.100 3.600 3.408 3.681 . 0 0 "[ . 1 . 2]" 1
2005 1 93 HIS QB 1 94 PHE QD . . 4.090 2.318 2.141 2.510 . 0 0 "[ . 1 . 2]" 1
2006 1 93 HIS QB 1 94 PHE QE . . 5.150 2.300 2.075 2.488 . 0 0 "[ . 1 . 2]" 1
2007 1 93 HIS HB2 1 94 PHE H . . 4.850 3.839 3.555 3.992 . 0 0 "[ . 1 . 2]" 1
2008 1 93 HIS HB3 1 94 PHE H . . 4.850 4.373 4.240 4.488 . 0 0 "[ . 1 . 2]" 1
2009 1 94 PHE H 1 94 PHE HB2 . . 3.460 2.920 2.759 2.983 . 0 0 "[ . 1 . 2]" 1
2010 1 94 PHE H 1 94 PHE HB3 . . 4.050 3.935 3.848 3.967 . 0 0 "[ . 1 . 2]" 1
2011 1 94 PHE H 1 94 PHE QD . . 3.380 2.914 2.723 3.117 . 0 0 "[ . 1 . 2]" 1
2012 1 94 PHE H 1 95 PRO HA . . 4.840 4.773 4.768 4.781 . 0 0 "[ . 1 . 2]" 1
2013 1 94 PHE HA 1 94 PHE QD . . 4.000 3.136 3.079 3.177 . 0 0 "[ . 1 . 2]" 1
2014 1 94 PHE HA 1 95 PRO HB2 . . 4.870 4.383 4.378 4.388 . 0 0 "[ . 1 . 2]" 1
2015 1 94 PHE HA 1 95 PRO HB3 . . 5.410 4.471 4.464 4.477 . 0 0 "[ . 1 . 2]" 1
2016 1 94 PHE HA 1 96 ALA H . . 3.760 3.005 2.898 3.059 . 0 0 "[ . 1 . 2]" 1
2017 1 94 PHE HA 1 96 ALA MB . . 3.720 2.674 2.488 2.919 . 0 0 "[ . 1 . 2]" 1
2018 1 94 PHE HB2 1 95 PRO HA . . 3.920 3.550 3.538 3.561 . 0 0 "[ . 1 . 2]" 1
2019 1 94 PHE HB2 1 96 ALA H . . 5.220 5.190 5.083 5.231 0.011 9 0 "[ . 1 . 2]" 1
2020 1 94 PHE HB3 1 95 PRO HA . . 3.660 1.981 1.969 1.988 . 0 0 "[ . 1 . 2]" 1
2021 1 94 PHE HB3 1 96 ALA H . . 4.020 3.684 3.580 3.726 . 0 0 "[ . 1 . 2]" 1
2022 1 94 PHE QD 1 95 PRO HA . . 3.830 2.908 2.801 3.043 . 0 0 "[ . 1 . 2]" 1
2023 1 94 PHE QD 1 96 ALA H . . 3.590 3.086 2.936 3.212 . 0 0 "[ . 1 . 2]" 1
2024 1 94 PHE QD 1 96 ALA MB . . 3.670 3.472 3.295 3.636 . 0 0 "[ . 1 . 2]" 1
2025 1 94 PHE QE 1 96 ALA MB . . 4.010 3.810 3.585 4.014 0.004 17 0 "[ . 1 . 2]" 1
2026 1 95 PRO HA 1 96 ALA H . . 3.040 2.270 2.241 2.285 . 0 0 "[ . 1 . 2]" 1
2027 1 95 PRO HA 1 96 ALA MB . . 4.050 3.838 3.780 3.899 . 0 0 "[ . 1 . 2]" 1
2028 1 95 PRO HB2 1 96 ALA H . . 3.940 2.979 2.932 3.080 . 0 0 "[ . 1 . 2]" 1
2029 1 95 PRO HB3 1 96 ALA H . . 3.830 3.653 3.626 3.712 . 0 0 "[ . 1 . 2]" 1
2030 1 96 ALA H 1 96 ALA MB . . 3.360 2.578 2.482 2.672 . 0 0 "[ . 1 . 2]" 1
2031 1 96 ALA H 1 97 ARG H . . 4.620 4.158 3.933 4.420 . 0 0 "[ . 1 . 2]" 1
2032 1 96 ALA HA 1 97 ARG H . . 2.900 2.159 2.142 2.236 . 0 0 "[ . 1 . 2]" 1
2033 1 96 ALA HA 1 97 ARG HA . . 4.840 4.395 4.365 4.421 . 0 0 "[ . 1 . 2]" 1
2034 1 96 ALA MB 1 97 ARG H . . 3.440 3.223 2.884 3.407 . 0 0 "[ . 1 . 2]" 1
2035 1 97 ARG H 1 97 ARG HB2 . . 3.970 3.307 2.215 3.675 . 0 0 "[ . 1 . 2]" 1
2036 1 97 ARG H 1 97 ARG QB . . 3.270 2.496 2.192 2.731 . 0 0 "[ . 1 . 2]" 1
2037 1 97 ARG H 1 97 ARG HB3 . . 3.970 2.848 2.265 3.723 . 0 0 "[ . 1 . 2]" 1
2038 1 97 ARG H 1 97 ARG HD2 . . 5.250 3.734 1.930 4.854 . 0 0 "[ . 1 . 2]" 1
2039 1 97 ARG H 1 97 ARG QD . . 4.520 3.445 1.900 4.219 . 0 0 "[ . 1 . 2]" 1
2040 1 97 ARG H 1 97 ARG HD3 . . 5.250 4.206 2.825 4.972 . 0 0 "[ . 1 . 2]" 1
2041 1 97 ARG H 1 97 ARG HG2 . . 4.510 3.256 2.376 4.102 . 0 0 "[ . 1 . 2]" 1
2042 1 97 ARG H 1 97 ARG HG3 . . 4.510 2.752 1.900 4.333 . 0 0 "[ . 1 . 2]" 1
2043 1 97 ARG H 1 98 VAL H . . 4.630 4.572 4.427 4.618 . 0 0 "[ . 1 . 2]" 1
2044 1 97 ARG HA 1 97 ARG HD2 . . 4.390 3.768 2.077 4.294 . 0 0 "[ . 1 . 2]" 1
2045 1 97 ARG HA 1 97 ARG QD . . 3.810 3.346 2.054 3.772 . 0 0 "[ . 1 . 2]" 1
2046 1 97 ARG HA 1 97 ARG HD3 . . 4.390 3.880 2.310 4.324 . 0 0 "[ . 1 . 2]" 1
2047 1 97 ARG HA 1 98 VAL H . . 2.800 2.231 2.160 2.385 . 0 0 "[ . 1 . 2]" 1
2048 1 97 ARG HA 1 98 VAL HA . . 4.990 4.446 4.409 4.520 . 0 0 "[ . 1 . 2]" 1
2049 1 97 ARG HA 1 98 VAL HB . . 5.110 4.538 4.328 4.675 . 0 0 "[ . 1 . 2]" 1
2050 1 97 ARG HA 1 98 VAL MG2 . . 4.680 3.503 3.340 3.758 . 0 0 "[ . 1 . 2]" 1
2051 1 97 ARG QB 1 97 ARG QD . . 3.240 2.142 2.019 2.448 . 0 0 "[ . 1 . 2]" 1
2052 1 97 ARG QB 1 98 VAL H . . 3.630 2.909 2.656 3.231 . 0 0 "[ . 1 . 2]" 1
2053 1 97 ARG HB2 1 97 ARG HD2 . . 4.220 3.218 2.834 3.583 . 0 0 "[ . 1 . 2]" 1
2054 1 97 ARG HB2 1 97 ARG HD3 . . 4.220 2.791 2.071 4.208 . 0 0 "[ . 1 . 2]" 1
2055 1 97 ARG HB3 1 97 ARG HD2 . . 4.220 3.355 2.231 3.964 . 0 0 "[ . 1 . 2]" 1
2056 1 97 ARG HB3 1 97 ARG HD3 . . 4.220 3.407 2.913 3.735 . 0 0 "[ . 1 . 2]" 1
2057 1 97 ARG QD 1 98 VAL H . . 4.000 3.662 3.323 4.055 0.055 18 0 "[ . 1 . 2]" 1
2058 1 97 ARG QG 1 98 VAL H . . 5.340 4.132 2.865 4.626 . 0 0 "[ . 1 . 2]" 1
2059 1 98 VAL H 1 98 VAL HB . . 3.260 2.864 2.743 2.967 . 0 0 "[ . 1 . 2]" 1
2060 1 98 VAL H 1 98 VAL MG1 . . 4.160 3.926 3.866 3.976 . 0 0 "[ . 1 . 2]" 1
2061 1 98 VAL H 1 98 VAL MG2 . . 3.760 2.982 2.780 3.201 . 0 0 "[ . 1 . 2]" 1
2062 1 98 VAL HA 1 98 VAL MG1 . . 3.250 2.358 2.230 2.474 . 0 0 "[ . 1 . 2]" 1
2063 1 98 VAL HA 1 98 VAL MG2 . . 3.400 2.392 2.267 2.478 . 0 0 "[ . 1 . 2]" 1
2064 1 98 VAL HA 1 99 LYS H . . 2.710 2.154 2.139 2.229 . 0 0 "[ . 1 . 2]" 1
2065 1 98 VAL HA 1 99 LYS HA . . 4.930 4.379 4.361 4.410 . 0 0 "[ . 1 . 2]" 1
2066 1 98 VAL HA 1 99 LYS HB2 . . 5.010 4.467 4.184 4.664 . 0 0 "[ . 1 . 2]" 1
2067 1 98 VAL HA 1 99 LYS QB . . 4.290 4.061 3.983 4.089 . 0 0 "[ . 1 . 2]" 1
2068 1 98 VAL HA 1 99 LYS HB3 . . 5.010 4.693 4.521 5.000 . 0 0 "[ . 1 . 2]" 1
2069 1 98 VAL HB 1 99 LYS H . . 4.540 4.190 3.864 4.385 . 0 0 "[ . 1 . 2]" 1
2070 1 98 VAL HB 1 100 VAL MG2 . . 4.430 3.631 3.487 3.980 . 0 0 "[ . 1 . 2]" 1
2071 1 98 VAL MG1 1 99 LYS H . . 3.560 2.571 2.244 3.008 . 0 0 "[ . 1 . 2]" 1
2072 1 98 VAL MG1 1 100 VAL HA . . 4.600 3.945 3.693 4.239 . 0 0 "[ . 1 . 2]" 1
2073 1 98 VAL MG1 1 100 VAL MG2 . . 3.180 2.887 2.520 3.151 . 0 0 "[ . 1 . 2]" 1
2074 1 98 VAL MG2 1 99 LYS H . . 4.390 4.054 3.858 4.179 . 0 0 "[ . 1 . 2]" 1
2075 1 99 LYS H 1 99 LYS HB2 . . 3.190 2.558 2.360 2.807 . 0 0 "[ . 1 . 2]" 1
2076 1 99 LYS H 1 99 LYS HB3 . . 3.190 2.568 2.408 2.822 . 0 0 "[ . 1 . 2]" 1
2077 1 99 LYS H 1 99 LYS QD . . 4.700 4.509 4.367 4.692 . 0 0 "[ . 1 . 2]" 1
2078 1 99 LYS H 1 99 LYS HG2 . . 4.650 4.476 4.361 4.604 . 0 0 "[ . 1 . 2]" 1
2079 1 99 LYS H 1 99 LYS HG3 . . 4.650 4.447 4.332 4.556 . 0 0 "[ . 1 . 2]" 1
2080 1 99 LYS HA 1 99 LYS QD . . 4.660 3.887 2.384 4.211 . 0 0 "[ . 1 . 2]" 1
2081 1 99 LYS HA 1 100 VAL H . . 3.210 2.149 2.140 2.221 . 0 0 "[ . 1 . 2]" 1
2082 1 99 LYS QB 1 99 LYS QD . . 3.220 2.151 2.087 2.435 . 0 0 "[ . 1 . 2]" 1
2083 1 99 LYS QB 1 99 LYS QE . . 4.060 2.844 1.985 3.660 . 0 0 "[ . 1 . 2]" 1
2084 1 99 LYS HB2 1 99 LYS HE2 . . 5.380 4.135 3.244 5.029 . 0 0 "[ . 1 . 2]" 1
2085 1 99 LYS HB2 1 99 LYS HE3 . . 5.380 3.625 2.090 4.808 . 0 0 "[ . 1 . 2]" 1
2086 1 99 LYS HB2 1 100 VAL H . . 4.530 4.340 4.022 4.475 . 0 0 "[ . 1 . 2]" 1
2087 1 99 LYS HB3 1 99 LYS HE2 . . 5.380 4.182 2.722 4.867 . 0 0 "[ . 1 . 2]" 1
2088 1 99 LYS HB3 1 99 LYS HE3 . . 5.380 3.571 2.028 5.002 . 0 0 "[ . 1 . 2]" 1
2089 1 99 LYS HB3 1 100 VAL H . . 4.530 4.212 3.971 4.362 . 0 0 "[ . 1 . 2]" 1
2090 1 99 LYS QD 1 100 VAL H . . 5.020 4.775 2.812 5.026 0.006 6 0 "[ . 1 . 2]" 1
2091 1 99 LYS QE 1 99 LYS QG . . 3.270 2.297 2.082 2.650 . 0 0 "[ . 1 . 2]" 1
2092 1 99 LYS QG 1 100 VAL H . . 3.520 2.900 2.286 3.083 . 0 0 "[ . 1 . 2]" 1
2093 1 99 LYS HG2 1 100 VAL H . . 4.030 3.360 2.582 3.993 . 0 0 "[ . 1 . 2]" 1
2094 1 99 LYS HG3 1 100 VAL H . . 4.030 3.387 2.300 4.030 0.000 15 0 "[ . 1 . 2]" 1
2095 1 100 VAL H 1 100 VAL HB . . 3.280 2.497 2.395 2.581 . 0 0 "[ . 1 . 2]" 1
2096 1 100 VAL H 1 100 VAL MG1 . . 4.080 3.778 3.709 3.816 . 0 0 "[ . 1 . 2]" 1
2097 1 100 VAL H 1 100 VAL MG2 . . 3.440 2.713 2.439 2.929 . 0 0 "[ . 1 . 2]" 1
2098 1 100 VAL H 1 101 GLU H . . 4.730 4.462 4.343 4.533 . 0 0 "[ . 1 . 2]" 1
2099 1 100 VAL HA 1 100 VAL MG1 . . 3.520 2.443 2.354 2.510 . 0 0 "[ . 1 . 2]" 1
2100 1 100 VAL HA 1 100 VAL MG2 . . 3.400 2.307 2.209 2.406 . 0 0 "[ . 1 . 2]" 1
2101 1 100 VAL HA 1 101 GLU H . . 2.910 2.170 2.141 2.208 . 0 0 "[ . 1 . 2]" 1
2102 1 100 VAL HA 1 101 GLU HA . . 4.840 4.373 4.366 4.390 . 0 0 "[ . 1 . 2]" 1
2103 1 100 VAL HA 1 101 GLU HB2 . . 4.490 4.306 4.277 4.363 . 0 0 "[ . 1 . 2]" 1
2104 1 100 VAL HA 1 101 GLU QG . . 4.370 4.269 4.109 4.363 . 0 0 "[ . 1 . 2]" 1
2105 1 100 VAL HB 1 101 GLU H . . 4.570 4.170 4.007 4.321 . 0 0 "[ . 1 . 2]" 1
2106 1 100 VAL MG1 1 101 GLU H . . 3.750 2.352 1.973 2.729 . 0 0 "[ . 1 . 2]" 1
2107 1 100 VAL MG1 1 101 GLU HA . . 4.610 3.770 3.641 3.979 . 0 0 "[ . 1 . 2]" 1
2108 1 100 VAL MG2 1 101 GLU H . . 4.060 3.899 3.760 4.061 0.001 19 0 "[ . 1 . 2]" 1
2109 1 101 GLU H 1 101 GLU HB2 . . 3.480 2.262 2.212 2.316 . 0 0 "[ . 1 . 2]" 1
2110 1 101 GLU H 1 101 GLU HB3 . . 3.820 3.528 3.494 3.565 . 0 0 "[ . 1 . 2]" 1
2111 1 101 GLU H 1 101 GLU HG2 . . 4.060 3.628 3.092 4.061 0.001 8 0 "[ . 1 . 2]" 1
2112 1 101 GLU H 1 101 GLU QG . . 3.390 3.060 2.851 3.184 . 0 0 "[ . 1 . 2]" 1
2113 1 101 GLU H 1 101 GLU HG3 . . 4.060 3.539 2.946 4.062 0.002 11 0 "[ . 1 . 2]" 1
2114 1 101 GLU H 1 102 PRO HD2 . . 4.880 4.781 4.752 4.800 . 0 0 "[ . 1 . 2]" 1
2115 1 101 GLU H 1 102 PRO HD3 . . 5.160 5.068 5.022 5.094 . 0 0 "[ . 1 . 2]" 1
2116 1 101 GLU HA 1 102 PRO HD2 . . 3.320 2.442 2.333 2.509 . 0 0 "[ . 1 . 2]" 1
2117 1 101 GLU HA 1 102 PRO HD3 . . 3.260 2.316 2.275 2.346 . 0 0 "[ . 1 . 2]" 1
2118 1 101 GLU HA 1 102 PRO HG2 . . 4.770 4.546 4.458 4.601 . 0 0 "[ . 1 . 2]" 1
2119 1 101 GLU HA 1 102 PRO HG3 . . 4.550 4.497 4.432 4.540 . 0 0 "[ . 1 . 2]" 1
2120 1 101 GLU HB2 1 102 PRO HD2 . . 3.920 3.682 3.587 3.850 . 0 0 "[ . 1 . 2]" 1
2121 1 101 GLU HB2 1 102 PRO HD3 . . 4.930 4.738 4.676 4.842 . 0 0 "[ . 1 . 2]" 1
2122 1 101 GLU HB3 1 102 PRO HD2 . . 3.560 2.122 2.005 2.350 . 0 0 "[ . 1 . 2]" 1
2123 1 101 GLU HB3 1 102 PRO HD3 . . 3.920 3.549 3.449 3.739 . 0 0 "[ . 1 . 2]" 1
2124 1 101 GLU HB3 1 102 PRO HG2 . . 4.070 3.773 3.670 3.964 . 0 0 "[ . 1 . 2]" 1
2125 1 101 GLU QG 1 102 PRO HD3 . . 4.290 3.759 3.275 4.272 . 0 0 "[ . 1 . 2]" 1
2126 1 101 GLU HG2 1 102 PRO HD2 . . 4.240 3.181 2.595 3.891 . 0 0 "[ . 1 . 2]" 1
2127 1 101 GLU HG2 1 102 PRO HD3 . . 5.150 3.909 3.332 4.579 . 0 0 "[ . 1 . 2]" 1
2128 1 101 GLU HG3 1 102 PRO HD2 . . 4.240 3.987 3.748 4.212 . 0 0 "[ . 1 . 2]" 1
2129 1 101 GLU HG3 1 102 PRO HD3 . . 5.150 5.002 4.794 5.150 . 0 0 "[ . 1 . 2]" 1
2130 1 102 PRO HA 1 103 ALA H . . 2.850 2.289 2.229 2.437 . 0 0 "[ . 1 . 2]" 1
2131 1 102 PRO HA 1 104 VAL H . . 4.890 4.200 3.964 4.559 . 0 0 "[ . 1 . 2]" 1
2132 1 102 PRO HB2 1 103 ALA H . . 3.350 2.929 2.524 3.119 . 0 0 "[ . 1 . 2]" 1
2133 1 102 PRO HB2 1 103 ALA HA . . 4.880 4.540 4.326 4.653 . 0 0 "[ . 1 . 2]" 1
2134 1 102 PRO HB2 1 103 ALA MB . . 5.000 4.582 4.328 4.781 . 0 0 "[ . 1 . 2]" 1
2135 1 102 PRO HB2 1 104 VAL H . . 3.240 2.702 2.399 3.065 . 0 0 "[ . 1 . 2]" 1
2136 1 102 PRO HB3 1 103 ALA H . . 3.760 3.626 3.409 3.736 . 0 0 "[ . 1 . 2]" 1
2137 1 102 PRO HB3 1 104 VAL H . . 4.740 4.376 4.087 4.660 . 0 0 "[ . 1 . 2]" 1
2138 1 103 ALA H 1 103 ALA MB . . 2.870 2.265 2.098 2.473 . 0 0 "[ . 1 . 2]" 1
2139 1 103 ALA H 1 104 VAL H . . 3.640 3.099 2.745 3.344 . 0 0 "[ . 1 . 2]" 1
2140 1 103 ALA HA 1 104 VAL H . . 3.230 2.790 2.673 2.965 . 0 0 "[ . 1 . 2]" 1
2141 1 103 ALA MB 1 104 VAL H . . 3.670 3.683 3.609 3.715 0.045 8 0 "[ . 1 . 2]" 1
2142 1 103 ALA MB 1 104 VAL HA . . 4.330 4.230 4.139 4.359 0.029 12 0 "[ . 1 . 2]" 1
2143 1 104 VAL H 1 104 VAL HB . . 3.830 3.183 2.333 3.696 . 0 0 "[ . 1 . 2]" 1
2144 1 104 VAL H 1 104 VAL MG1 . . 4.430 2.931 2.135 3.850 . 0 0 "[ . 1 . 2]" 1
2145 1 104 VAL H 1 104 VAL QG . . 3.850 2.092 1.831 2.621 . 0 0 "[ . 1 . 2]" 1
2146 1 104 VAL H 1 104 VAL MG2 . . 4.430 2.243 1.893 3.756 . 0 0 "[ . 1 . 2]" 1
2147 1 104 VAL H 1 105 ASP H . . 4.550 3.832 2.070 4.552 0.002 17 0 "[ . 1 . 2]" 1
2148 1 104 VAL HA 1 104 VAL MG1 . . 3.700 2.327 2.060 3.202 . 0 0 "[ . 1 . 2]" 1
2149 1 104 VAL HA 1 104 VAL MG2 . . 3.700 2.863 2.266 3.202 . 0 0 "[ . 1 . 2]" 1
2150 1 104 VAL HA 1 105 ASP H . . 3.330 2.487 2.141 3.329 . 0 0 "[ . 1 . 2]" 1
2151 1 104 VAL HB 1 105 ASP H . . 4.310 3.891 3.239 4.307 . 0 0 "[ . 1 . 2]" 1
2152 1 104 VAL QG 1 105 ASP H . . 4.200 3.223 1.991 3.727 . 0 0 "[ . 1 . 2]" 1
2153 1 104 VAL MG1 1 105 ASP H . . 4.900 3.768 1.997 4.280 . 0 0 "[ . 1 . 2]" 1
2154 1 104 VAL MG2 1 105 ASP H . . 4.900 3.827 2.490 4.334 . 0 0 "[ . 1 . 2]" 1
2155 1 105 ASP H 1 105 ASP HB2 . . 4.200 2.934 2.290 4.055 . 0 0 "[ . 1 . 2]" 1
2156 1 105 ASP H 1 105 ASP HB3 . . 4.200 3.334 2.585 4.052 . 0 0 "[ . 1 . 2]" 1
2157 1 106 THR HA 1 106 THR MG . . 3.090 2.583 2.161 3.204 0.114 20 0 "[ . 1 . 2]" 1
2158 1 106 THR HB 1 107 SER H . . 5.500 3.777 2.184 4.565 . 0 0 "[ . 1 . 2]" 1
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