NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
414997 |
2d7q   |
10332 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2d7q
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 2011
_Distance_constraint_stats_list.Viol_count 284
_Distance_constraint_stats_list.Viol_total 53.040
_Distance_constraint_stats_list.Viol_max 0.085
_Distance_constraint_stats_list.Viol_rms 0.0014
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0093
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 8 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 GLY 0.004 0.003 17 0 "[ . 1 . 2]"
1 10 ASP 0.417 0.045 17 0 "[ . 1 . 2]"
1 11 PRO 0.389 0.045 17 0 "[ . 1 . 2]"
1 12 GLY 0.004 0.004 20 0 "[ . 1 . 2]"
1 13 LEU 0.006 0.003 12 0 "[ . 1 . 2]"
1 14 VAL 0.007 0.003 12 0 "[ . 1 . 2]"
1 15 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 TYR 0.006 0.004 17 0 "[ . 1 . 2]"
1 18 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 LEU 0.001 0.001 12 0 "[ . 1 . 2]"
1 22 GLU 0.001 0.001 12 0 "[ . 1 . 2]"
1 23 GLY 0.000 0.000 17 0 "[ . 1 . 2]"
1 24 GLY 0.008 0.003 13 0 "[ . 1 . 2]"
1 25 THR 0.003 0.002 16 0 "[ . 1 . 2]"
1 26 THR 0.000 0.000 8 0 "[ . 1 . 2]"
1 27 GLY 0.001 0.001 10 0 "[ . 1 . 2]"
1 28 VAL 0.009 0.007 19 0 "[ . 1 . 2]"
1 29 SER 0.009 0.004 9 0 "[ . 1 . 2]"
1 30 SER 0.017 0.006 17 0 "[ . 1 . 2]"
1 31 GLU 0.007 0.003 8 0 "[ . 1 . 2]"
1 32 PHE 0.017 0.005 16 0 "[ . 1 . 2]"
1 33 ILE 0.005 0.003 16 0 "[ . 1 . 2]"
1 34 VAL 0.003 0.003 19 0 "[ . 1 . 2]"
1 35 ASN 0.009 0.003 19 0 "[ . 1 . 2]"
1 36 THR 0.002 0.001 16 0 "[ . 1 . 2]"
1 37 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ALA 0.001 0.001 9 0 "[ . 1 . 2]"
1 40 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 ALA 0.019 0.008 5 0 "[ . 1 . 2]"
1 44 LEU 0.016 0.008 5 0 "[ . 1 . 2]"
1 45 SER 0.007 0.003 15 0 "[ . 1 . 2]"
1 46 VAL 0.040 0.018 5 0 "[ . 1 . 2]"
1 47 THR 0.511 0.079 15 0 "[ . 1 . 2]"
1 48 ILE 0.384 0.079 15 0 "[ . 1 . 2]"
1 49 ASP 0.019 0.012 5 0 "[ . 1 . 2]"
1 50 GLY 0.018 0.012 5 0 "[ . 1 . 2]"
1 51 PRO 0.015 0.004 15 0 "[ . 1 . 2]"
1 52 SER 0.001 0.001 9 0 "[ . 1 . 2]"
1 53 LYS 0.082 0.082 11 0 "[ . 1 . 2]"
1 54 VAL 0.005 0.003 5 0 "[ . 1 . 2]"
1 55 GLN 0.241 0.053 11 0 "[ . 1 . 2]"
1 56 LEU 0.251 0.053 11 0 "[ . 1 . 2]"
1 57 ASP 0.072 0.030 4 0 "[ . 1 . 2]"
1 58 CYS 0.003 0.002 3 0 "[ . 1 . 2]"
1 59 ARG 0.381 0.050 11 0 "[ . 1 . 2]"
1 60 GLU 0.183 0.032 10 0 "[ . 1 . 2]"
1 61 CYS 0.013 0.006 11 0 "[ . 1 . 2]"
1 62 PRO 0.006 0.004 2 0 "[ . 1 . 2]"
1 63 GLU 0.012 0.004 2 0 "[ . 1 . 2]"
1 64 GLY 0.036 0.035 13 0 "[ . 1 . 2]"
1 65 HIS 0.044 0.035 13 0 "[ . 1 . 2]"
1 66 VAL 0.061 0.050 11 0 "[ . 1 . 2]"
1 67 VAL 0.003 0.001 7 0 "[ . 1 . 2]"
1 68 THR 0.014 0.006 8 0 "[ . 1 . 2]"
1 69 TYR 0.193 0.021 20 0 "[ . 1 . 2]"
1 70 THR 0.001 0.001 7 0 "[ . 1 . 2]"
1 71 PRO 0.190 0.021 20 0 "[ . 1 . 2]"
1 72 MET 0.136 0.085 10 0 "[ . 1 . 2]"
1 73 ALA 0.159 0.085 10 0 "[ . 1 . 2]"
1 74 PRO 0.003 0.003 19 0 "[ . 1 . 2]"
1 75 GLY 0.009 0.004 15 0 "[ . 1 . 2]"
1 76 ASN 0.021 0.007 12 0 "[ . 1 . 2]"
1 77 TYR 0.017 0.007 12 0 "[ . 1 . 2]"
1 78 LEU 0.013 0.006 17 0 "[ . 1 . 2]"
1 79 ILE 0.032 0.008 11 0 "[ . 1 . 2]"
1 80 ALA 0.198 0.050 19 0 "[ . 1 . 2]"
1 81 ILE 0.014 0.006 9 0 "[ . 1 . 2]"
1 82 LYS 0.025 0.007 17 0 "[ . 1 . 2]"
1 83 TYR 0.007 0.004 13 0 "[ . 1 . 2]"
1 84 GLY 0.019 0.006 20 0 "[ . 1 . 2]"
1 85 GLY 0.018 0.006 20 0 "[ . 1 . 2]"
1 86 PRO 0.003 0.003 15 0 "[ . 1 . 2]"
1 87 GLN 0.001 0.001 5 0 "[ . 1 . 2]"
1 88 HIS 0.084 0.044 15 0 "[ . 1 . 2]"
1 89 ILE 0.024 0.007 17 0 "[ . 1 . 2]"
1 90 VAL 0.001 0.001 12 0 "[ . 1 . 2]"
1 91 GLY 0.019 0.013 16 0 "[ . 1 . 2]"
1 92 SER 0.164 0.044 15 0 "[ . 1 . 2]"
1 93 PRO 0.008 0.006 17 0 "[ . 1 . 2]"
1 94 PHE 0.122 0.020 20 0 "[ . 1 . 2]"
1 95 LYS 0.005 0.004 4 0 "[ . 1 . 2]"
1 96 ALA 0.008 0.007 16 0 "[ . 1 . 2]"
1 97 LYS 0.009 0.007 16 0 "[ . 1 . 2]"
1 98 VAL 0.005 0.003 19 0 "[ . 1 . 2]"
1 99 THR 0.014 0.009 13 0 "[ . 1 . 2]"
1 100 GLY 0.009 0.009 13 0 "[ . 1 . 2]"
1 101 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 ARG 0.031 0.010 8 0 "[ . 1 . 2]"
1 103 LEU 0.001 0.001 15 0 "[ . 1 . 2]"
1 104 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 ALA HA 1 9 GLY H . . 3.300 2.295 2.146 2.817 . 0 0 "[ . 1 . 2]" 1
2 1 8 ALA MB 1 9 GLY H . . 4.210 3.083 2.611 3.693 . 0 0 "[ . 1 . 2]" 1
3 1 9 GLY QA 1 10 ASP H . . 2.940 2.213 2.110 2.282 . 0 0 "[ . 1 . 2]" 1
4 1 9 GLY QA 1 10 ASP HA . . 4.420 3.954 3.930 4.020 . 0 0 "[ . 1 . 2]" 1
5 1 9 GLY QA 1 83 TYR QE . . 4.160 3.530 2.764 4.052 . 0 0 "[ . 1 . 2]" 1
6 1 9 GLY HA2 1 10 ASP H . . 3.470 2.515 2.137 3.132 . 0 0 "[ . 1 . 2]" 1
7 1 9 GLY HA3 1 10 ASP H . . 3.470 2.729 2.157 3.473 0.003 17 0 "[ . 1 . 2]" 1
8 1 10 ASP H 1 10 ASP HB2 . . 3.480 2.916 2.751 3.030 . 0 0 "[ . 1 . 2]" 1
9 1 10 ASP H 1 10 ASP HB3 . . 3.900 3.870 3.796 3.906 0.006 9 0 "[ . 1 . 2]" 1
10 1 10 ASP H 1 11 PRO HD2 . . 4.790 4.421 4.347 4.473 . 0 0 "[ . 1 . 2]" 1
11 1 10 ASP H 1 11 PRO HD3 . . 3.930 3.855 3.729 3.943 0.013 14 0 "[ . 1 . 2]" 1
12 1 10 ASP H 1 13 LEU MD1 . . 5.400 5.160 4.798 5.368 . 0 0 "[ . 1 . 2]" 1
13 1 10 ASP H 1 39 ALA HA . . 4.400 4.245 3.996 4.401 0.001 9 0 "[ . 1 . 2]" 1
14 1 10 ASP H 1 39 ALA MB . . 4.030 2.937 2.692 3.191 . 0 0 "[ . 1 . 2]" 1
15 1 10 ASP H 1 83 TYR QE . . 4.200 3.365 2.557 4.024 . 0 0 "[ . 1 . 2]" 1
16 1 10 ASP HA 1 11 PRO HD2 . . 3.100 1.929 1.916 1.968 . 0 0 "[ . 1 . 2]" 1
17 1 10 ASP HA 1 11 PRO HD3 . . 3.060 2.476 2.332 2.585 . 0 0 "[ . 1 . 2]" 1
18 1 10 ASP HA 1 11 PRO HG2 . . 4.730 4.130 4.116 4.168 . 0 0 "[ . 1 . 2]" 1
19 1 10 ASP HA 1 11 PRO HG3 . . 4.730 4.376 4.317 4.429 . 0 0 "[ . 1 . 2]" 1
20 1 10 ASP HA 1 12 GLY H . . 4.260 3.659 3.411 3.869 . 0 0 "[ . 1 . 2]" 1
21 1 10 ASP HB2 1 11 PRO HD2 . . 4.910 4.587 4.497 4.674 . 0 0 "[ . 1 . 2]" 1
22 1 10 ASP HB2 1 11 PRO HD3 . . 5.150 5.113 5.057 5.149 . 0 0 "[ . 1 . 2]" 1
23 1 10 ASP HB2 1 12 GLY H . . 5.110 4.822 4.302 5.114 0.004 20 0 "[ . 1 . 2]" 1
24 1 10 ASP HB2 1 13 LEU H . . 4.280 3.822 3.379 4.108 . 0 0 "[ . 1 . 2]" 1
25 1 10 ASP HB2 1 13 LEU HB2 . . 4.730 3.306 2.663 3.758 . 0 0 "[ . 1 . 2]" 1
26 1 10 ASP HB2 1 13 LEU HB3 . . 5.190 4.820 4.241 5.151 . 0 0 "[ . 1 . 2]" 1
27 1 10 ASP HB2 1 13 LEU MD1 . . 3.820 2.755 2.348 2.985 . 0 0 "[ . 1 . 2]" 1
28 1 10 ASP HB2 1 13 LEU HG . . 4.130 3.147 2.519 3.468 . 0 0 "[ . 1 . 2]" 1
29 1 10 ASP HB3 1 11 PRO HD2 . . 5.030 3.629 3.404 3.770 . 0 0 "[ . 1 . 2]" 1
30 1 10 ASP HB3 1 11 PRO HD3 . . 4.740 4.686 4.522 4.785 0.045 17 0 "[ . 1 . 2]" 1
31 1 10 ASP HB3 1 12 GLY H . . 4.950 3.639 3.116 4.187 . 0 0 "[ . 1 . 2]" 1
32 1 10 ASP HB3 1 13 LEU H . . 4.890 3.245 2.863 3.943 . 0 0 "[ . 1 . 2]" 1
33 1 10 ASP HB3 1 13 LEU HB2 . . 4.810 3.761 3.289 4.724 . 0 0 "[ . 1 . 2]" 1
34 1 10 ASP HB3 1 13 LEU MD1 . . 4.170 3.120 2.584 3.469 . 0 0 "[ . 1 . 2]" 1
35 1 10 ASP HB3 1 13 LEU HG . . 4.630 2.552 2.091 2.900 . 0 0 "[ . 1 . 2]" 1
36 1 11 PRO HA 1 13 LEU H . . 4.300 3.850 3.633 4.019 . 0 0 "[ . 1 . 2]" 1
37 1 11 PRO HA 1 14 VAL H . . 4.440 3.739 3.317 4.003 . 0 0 "[ . 1 . 2]" 1
38 1 11 PRO HA 1 14 VAL HB . . 4.080 2.628 2.384 3.076 . 0 0 "[ . 1 . 2]" 1
39 1 11 PRO HA 1 14 VAL MG2 . . 3.640 2.568 2.136 2.901 . 0 0 "[ . 1 . 2]" 1
40 1 11 PRO HA 1 83 TYR QB . . 3.890 2.779 2.292 3.034 . 0 0 "[ . 1 . 2]" 1
41 1 11 PRO HA 1 83 TYR QD . . 3.960 3.232 2.662 3.816 . 0 0 "[ . 1 . 2]" 1
42 1 11 PRO HA 1 89 ILE MG . . 4.070 2.802 2.324 3.226 . 0 0 "[ . 1 . 2]" 1
43 1 11 PRO HB2 1 12 GLY H . . 3.500 3.287 3.122 3.494 . 0 0 "[ . 1 . 2]" 1
44 1 11 PRO HB2 1 13 LEU H . . 5.190 5.042 4.892 5.178 . 0 0 "[ . 1 . 2]" 1
45 1 11 PRO HB2 1 83 TYR H . . 5.500 4.919 4.580 5.240 . 0 0 "[ . 1 . 2]" 1
46 1 11 PRO HB2 1 89 ILE HA . . 4.040 2.355 2.045 2.785 . 0 0 "[ . 1 . 2]" 1
47 1 11 PRO HB2 1 89 ILE HB . . 4.160 3.539 3.227 3.841 . 0 0 "[ . 1 . 2]" 1
48 1 11 PRO HB2 1 89 ILE MG . . 4.170 2.798 2.620 2.995 . 0 0 "[ . 1 . 2]" 1
49 1 11 PRO HB3 1 12 GLY H . . 4.430 4.116 4.020 4.236 . 0 0 "[ . 1 . 2]" 1
50 1 11 PRO HB3 1 83 TYR H . . 3.960 3.663 3.394 3.957 . 0 0 "[ . 1 . 2]" 1
51 1 11 PRO HB3 1 83 TYR QB . . 4.040 3.118 2.583 3.513 . 0 0 "[ . 1 . 2]" 1
52 1 11 PRO HB3 1 83 TYR QD . . 4.750 4.203 3.511 4.687 . 0 0 "[ . 1 . 2]" 1
53 1 11 PRO HB3 1 89 ILE HA . . 4.790 3.461 3.008 3.907 . 0 0 "[ . 1 . 2]" 1
54 1 11 PRO HB3 1 89 ILE MG . . 3.740 2.599 2.306 2.968 . 0 0 "[ . 1 . 2]" 1
55 1 11 PRO HD2 1 12 GLY H . . 4.230 2.659 2.648 2.675 . 0 0 "[ . 1 . 2]" 1
56 1 11 PRO HD3 1 12 GLY H . . 4.060 3.843 3.838 3.856 . 0 0 "[ . 1 . 2]" 1
57 1 11 PRO QG 1 83 TYR H . . 5.350 5.073 4.784 5.349 . 0 0 "[ . 1 . 2]" 1
58 1 11 PRO HG2 1 12 GLY H . . 4.560 2.316 2.126 2.576 . 0 0 "[ . 1 . 2]" 1
59 1 11 PRO HG3 1 12 GLY H . . 4.560 3.843 3.702 4.036 . 0 0 "[ . 1 . 2]" 1
60 1 12 GLY H 1 13 LEU H . . 3.260 2.750 2.660 2.829 . 0 0 "[ . 1 . 2]" 1
61 1 12 GLY H 1 13 LEU HG . . 4.510 4.258 4.068 4.375 . 0 0 "[ . 1 . 2]" 1
62 1 12 GLY H 1 14 VAL H . . 4.600 4.276 4.079 4.411 . 0 0 "[ . 1 . 2]" 1
63 1 12 GLY H 1 90 VAL MG1 . . 5.090 4.593 4.093 4.839 . 0 0 "[ . 1 . 2]" 1
64 1 12 GLY HA2 1 14 VAL H . . 3.800 3.633 3.558 3.752 . 0 0 "[ . 1 . 2]" 1
65 1 12 GLY HA2 1 90 VAL H . . 4.710 3.278 3.084 3.438 . 0 0 "[ . 1 . 2]" 1
66 1 12 GLY HA2 1 90 VAL HA . . 5.080 4.710 4.464 4.966 . 0 0 "[ . 1 . 2]" 1
67 1 12 GLY HA2 1 90 VAL MG1 . . 3.830 2.445 1.978 2.737 . 0 0 "[ . 1 . 2]" 1
68 1 12 GLY HA3 1 14 VAL H . . 4.960 4.340 4.248 4.483 . 0 0 "[ . 1 . 2]" 1
69 1 12 GLY HA3 1 90 VAL H . . 5.210 4.973 4.755 5.169 . 0 0 "[ . 1 . 2]" 1
70 1 12 GLY HA3 1 90 VAL MG1 . . 4.240 3.800 3.414 4.076 . 0 0 "[ . 1 . 2]" 1
71 1 13 LEU H 1 13 LEU HB2 . . 3.110 2.629 2.591 2.721 . 0 0 "[ . 1 . 2]" 1
72 1 13 LEU H 1 13 LEU HB3 . . 3.920 3.683 3.654 3.729 . 0 0 "[ . 1 . 2]" 1
73 1 13 LEU H 1 13 LEU MD1 . . 3.950 3.866 3.786 3.951 0.001 8 0 "[ . 1 . 2]" 1
74 1 13 LEU H 1 13 LEU MD2 . . 3.990 3.154 2.915 3.272 . 0 0 "[ . 1 . 2]" 1
75 1 13 LEU H 1 13 LEU HG . . 2.990 2.436 2.312 2.580 . 0 0 "[ . 1 . 2]" 1
76 1 13 LEU H 1 14 VAL H . . 3.010 2.630 2.334 2.784 . 0 0 "[ . 1 . 2]" 1
77 1 13 LEU H 1 14 VAL HB . . 4.510 4.383 4.186 4.492 . 0 0 "[ . 1 . 2]" 1
78 1 13 LEU H 1 14 VAL MG2 . . 4.120 3.432 3.321 3.674 . 0 0 "[ . 1 . 2]" 1
79 1 13 LEU H 1 39 ALA MB . . 4.200 4.078 3.682 4.198 . 0 0 "[ . 1 . 2]" 1
80 1 13 LEU HA 1 13 LEU MD1 . . 4.060 3.849 3.816 3.864 . 0 0 "[ . 1 . 2]" 1
81 1 13 LEU HA 1 13 LEU MD2 . . 2.870 2.010 1.971 2.178 . 0 0 "[ . 1 . 2]" 1
82 1 13 LEU HA 1 13 LEU HG . . 3.600 3.373 3.334 3.477 . 0 0 "[ . 1 . 2]" 1
83 1 13 LEU HA 1 14 VAL H . . 3.240 3.039 2.975 3.205 . 0 0 "[ . 1 . 2]" 1
84 1 13 LEU HB2 1 13 LEU MD1 . . 3.110 2.424 2.364 2.475 . 0 0 "[ . 1 . 2]" 1
85 1 13 LEU HB2 1 13 LEU MD2 . . 3.260 3.188 3.183 3.190 . 0 0 "[ . 1 . 2]" 1
86 1 13 LEU HB2 1 14 VAL H . . 4.000 3.913 3.656 4.001 0.001 2 0 "[ . 1 . 2]" 1
87 1 13 LEU HB2 1 38 ASN HB2 . . 4.900 4.023 3.579 4.408 . 0 0 "[ . 1 . 2]" 1
88 1 13 LEU HB2 1 38 ASN QB . . 4.290 3.309 3.188 3.456 . 0 0 "[ . 1 . 2]" 1
89 1 13 LEU HB2 1 38 ASN HB3 . . 4.900 3.572 3.330 4.093 . 0 0 "[ . 1 . 2]" 1
90 1 13 LEU HB2 1 39 ALA H . . 4.820 3.734 3.312 3.962 . 0 0 "[ . 1 . 2]" 1
91 1 13 LEU HB2 1 39 ALA HA . . 3.750 2.374 2.155 2.635 . 0 0 "[ . 1 . 2]" 1
92 1 13 LEU HB2 1 39 ALA MB . . 3.700 3.002 2.481 3.196 . 0 0 "[ . 1 . 2]" 1
93 1 13 LEU HB3 1 13 LEU MD1 . . 3.260 2.263 2.198 2.340 . 0 0 "[ . 1 . 2]" 1
94 1 13 LEU HB3 1 13 LEU MD2 . . 3.320 2.479 2.458 2.508 . 0 0 "[ . 1 . 2]" 1
95 1 13 LEU HB3 1 14 VAL H . . 4.830 4.479 4.447 4.495 . 0 0 "[ . 1 . 2]" 1
96 1 13 LEU HB3 1 38 ASN HB2 . . 4.640 3.099 2.615 3.762 . 0 0 "[ . 1 . 2]" 1
97 1 13 LEU HB3 1 38 ASN QB . . 4.070 2.169 1.966 2.549 . 0 0 "[ . 1 . 2]" 1
98 1 13 LEU HB3 1 38 ASN HB3 . . 4.640 2.243 2.000 2.634 . 0 0 "[ . 1 . 2]" 1
99 1 13 LEU HB3 1 39 ALA H . . 4.620 4.045 3.485 4.459 . 0 0 "[ . 1 . 2]" 1
100 1 13 LEU HB3 1 39 ALA HA . . 3.740 3.516 3.205 3.728 . 0 0 "[ . 1 . 2]" 1
101 1 13 LEU HB3 1 39 ALA MB . . 4.460 4.165 3.742 4.356 . 0 0 "[ . 1 . 2]" 1
102 1 13 LEU MD1 1 38 ASN HB2 . . 5.170 4.392 3.929 4.786 . 0 0 "[ . 1 . 2]" 1
103 1 13 LEU MD1 1 38 ASN QB . . 4.300 3.056 2.600 3.327 . 0 0 "[ . 1 . 2]" 1
104 1 13 LEU MD1 1 38 ASN HB3 . . 5.170 3.124 2.633 3.394 . 0 0 "[ . 1 . 2]" 1
105 1 13 LEU MD1 1 39 ALA HA . . 3.700 2.747 2.252 2.952 . 0 0 "[ . 1 . 2]" 1
106 1 13 LEU MD2 1 14 VAL H . . 4.370 4.353 4.298 4.373 0.003 12 0 "[ . 1 . 2]" 1
107 1 13 LEU HG 1 14 VAL H . . 5.260 4.781 4.495 4.863 . 0 0 "[ . 1 . 2]" 1
108 1 13 LEU HG 1 39 ALA HA . . 4.530 4.092 3.649 4.408 . 0 0 "[ . 1 . 2]" 1
109 1 13 LEU HG 1 39 ALA MB . . 5.130 4.634 4.144 4.811 . 0 0 "[ . 1 . 2]" 1
110 1 14 VAL H 1 14 VAL HB . . 3.060 2.613 2.467 2.722 . 0 0 "[ . 1 . 2]" 1
111 1 14 VAL H 1 14 VAL MG1 . . 3.970 3.820 3.728 3.878 . 0 0 "[ . 1 . 2]" 1
112 1 14 VAL H 1 14 VAL MG2 . . 3.230 2.908 2.588 3.062 . 0 0 "[ . 1 . 2]" 1
113 1 14 VAL H 1 15 SER H . . 4.500 4.357 4.275 4.497 . 0 0 "[ . 1 . 2]" 1
114 1 14 VAL H 1 89 ILE HB . . 4.870 4.137 3.990 4.252 . 0 0 "[ . 1 . 2]" 1
115 1 14 VAL H 1 89 ILE MD . . 4.480 4.405 4.202 4.482 0.002 1 0 "[ . 1 . 2]" 1
116 1 14 VAL H 1 89 ILE MG . . 4.680 4.528 4.378 4.670 . 0 0 "[ . 1 . 2]" 1
117 1 14 VAL H 1 90 VAL MG1 . . 4.150 2.912 2.613 3.164 . 0 0 "[ . 1 . 2]" 1
118 1 14 VAL HA 1 14 VAL MG1 . . 3.390 2.394 2.335 2.489 . 0 0 "[ . 1 . 2]" 1
119 1 14 VAL HA 1 14 VAL MG2 . . 3.430 2.281 2.136 2.397 . 0 0 "[ . 1 . 2]" 1
120 1 14 VAL HA 1 15 SER H . . 2.720 2.159 2.145 2.185 . 0 0 "[ . 1 . 2]" 1
121 1 14 VAL HA 1 36 THR HA . . 4.070 3.052 2.799 3.235 . 0 0 "[ . 1 . 2]" 1
122 1 14 VAL HA 1 36 THR MG . . 4.540 3.724 3.453 3.893 . 0 0 "[ . 1 . 2]" 1
123 1 14 VAL HA 1 39 ALA MB . . 4.070 3.778 3.538 3.949 . 0 0 "[ . 1 . 2]" 1
124 1 14 VAL HA 1 89 ILE MD . . 4.930 4.316 4.120 4.439 . 0 0 "[ . 1 . 2]" 1
125 1 14 VAL HB 1 15 SER H . . 4.280 4.200 4.095 4.279 . 0 0 "[ . 1 . 2]" 1
126 1 14 VAL HB 1 89 ILE HB . . 3.110 2.945 2.547 3.096 . 0 0 "[ . 1 . 2]" 1
127 1 14 VAL HB 1 89 ILE MD . . 3.900 3.141 2.604 3.397 . 0 0 "[ . 1 . 2]" 1
128 1 14 VAL HB 1 89 ILE MG . . 3.380 2.589 2.431 2.779 . 0 0 "[ . 1 . 2]" 1
129 1 14 VAL HB 1 90 VAL H . . 4.740 4.563 4.379 4.730 . 0 0 "[ . 1 . 2]" 1
130 1 14 VAL MG1 1 15 SER H . . 3.250 2.422 2.145 2.737 . 0 0 "[ . 1 . 2]" 1
131 1 14 VAL MG1 1 15 SER HA . . 4.760 3.391 3.277 3.476 . 0 0 "[ . 1 . 2]" 1
132 1 14 VAL MG1 1 36 THR HA . . 4.050 2.926 2.651 3.516 . 0 0 "[ . 1 . 2]" 1
133 1 14 VAL MG1 1 89 ILE HB . . 4.390 3.196 2.842 3.673 . 0 0 "[ . 1 . 2]" 1
134 1 14 VAL MG1 1 89 ILE MD . . 3.180 1.975 1.822 2.178 . 0 0 "[ . 1 . 2]" 1
135 1 14 VAL MG1 1 89 ILE MG . . 3.220 2.500 1.968 2.952 . 0 0 "[ . 1 . 2]" 1
136 1 14 VAL MG1 1 90 VAL H . . 5.450 5.115 4.846 5.344 . 0 0 "[ . 1 . 2]" 1
137 1 14 VAL MG2 1 15 SER H . . 3.970 3.900 3.744 3.959 . 0 0 "[ . 1 . 2]" 1
138 1 14 VAL MG2 1 36 THR HA . . 3.600 2.244 2.030 2.714 . 0 0 "[ . 1 . 2]" 1
139 1 14 VAL MG2 1 36 THR HB . . 4.490 3.135 2.746 3.621 . 0 0 "[ . 1 . 2]" 1
140 1 14 VAL MG2 1 39 ALA H . . 4.500 3.311 2.966 3.647 . 0 0 "[ . 1 . 2]" 1
141 1 14 VAL MG2 1 39 ALA MB . . 2.990 1.873 1.751 2.127 . 0 0 "[ . 1 . 2]" 1
142 1 14 VAL MG2 1 83 TYR HB2 . . 4.090 3.412 3.112 3.774 . 0 0 "[ . 1 . 2]" 1
143 1 14 VAL MG2 1 83 TYR QB . . 3.590 2.740 2.309 3.026 . 0 0 "[ . 1 . 2]" 1
144 1 14 VAL MG2 1 83 TYR HB3 . . 4.090 2.895 2.380 3.293 . 0 0 "[ . 1 . 2]" 1
145 1 14 VAL MG2 1 83 TYR QD . . 3.650 2.583 2.250 2.944 . 0 0 "[ . 1 . 2]" 1
146 1 14 VAL MG2 1 83 TYR QE . . 4.020 3.316 2.964 3.809 . 0 0 "[ . 1 . 2]" 1
147 1 14 VAL MG2 1 89 ILE MG . . 3.630 3.412 3.019 3.629 . 0 0 "[ . 1 . 2]" 1
148 1 15 SER H 1 15 SER HB2 . . 4.020 3.068 2.627 3.898 . 0 0 "[ . 1 . 2]" 1
149 1 15 SER H 1 15 SER QB . . 3.510 2.796 2.575 3.187 . 0 0 "[ . 1 . 2]" 1
150 1 15 SER H 1 15 SER HB3 . . 4.020 3.522 2.876 3.934 . 0 0 "[ . 1 . 2]" 1
151 1 15 SER H 1 16 ALA H . . 4.600 4.413 4.355 4.437 . 0 0 "[ . 1 . 2]" 1
152 1 15 SER H 1 16 ALA HA . . 5.030 4.752 4.713 4.818 . 0 0 "[ . 1 . 2]" 1
153 1 15 SER H 1 35 ASN H . . 3.880 3.741 3.570 3.867 . 0 0 "[ . 1 . 2]" 1
154 1 15 SER H 1 35 ASN HB2 . . 5.040 4.873 4.486 5.027 . 0 0 "[ . 1 . 2]" 1
155 1 15 SER H 1 35 ASN HB3 . . 3.850 3.238 2.782 3.416 . 0 0 "[ . 1 . 2]" 1
156 1 15 SER H 1 36 THR HA . . 4.220 4.060 3.817 4.212 . 0 0 "[ . 1 . 2]" 1
157 1 15 SER H 1 36 THR MG . . 4.230 4.018 3.784 4.192 . 0 0 "[ . 1 . 2]" 1
158 1 15 SER HA 1 16 ALA H . . 2.740 2.387 2.252 2.461 . 0 0 "[ . 1 . 2]" 1
159 1 15 SER HA 1 16 ALA MB . . 4.420 3.835 3.747 3.899 . 0 0 "[ . 1 . 2]" 1
160 1 15 SER HA 1 89 ILE MD . . 3.970 2.367 2.128 2.683 . 0 0 "[ . 1 . 2]" 1
161 1 15 SER QB 1 16 ALA H . . 3.180 2.649 2.280 3.168 . 0 0 "[ . 1 . 2]" 1
162 1 15 SER HB2 1 16 ALA H . . 4.010 3.549 2.318 3.959 . 0 0 "[ . 1 . 2]" 1
163 1 15 SER HB3 1 16 ALA H . . 4.010 2.970 2.303 3.976 . 0 0 "[ . 1 . 2]" 1
164 1 16 ALA H 1 16 ALA MB . . 3.190 2.505 2.418 2.596 . 0 0 "[ . 1 . 2]" 1
165 1 16 ALA H 1 89 ILE MD . . 3.810 3.336 3.064 3.645 . 0 0 "[ . 1 . 2]" 1
166 1 16 ALA H 1 94 PHE HZ . . 5.070 3.102 2.610 3.529 . 0 0 "[ . 1 . 2]" 1
167 1 16 ALA HA 1 17 TYR H . . 2.760 2.206 2.165 2.324 . 0 0 "[ . 1 . 2]" 1
168 1 16 ALA HA 1 17 TYR HA . . 4.990 4.428 4.409 4.484 . 0 0 "[ . 1 . 2]" 1
169 1 16 ALA HA 1 17 TYR QD . . 4.340 3.774 3.503 4.035 . 0 0 "[ . 1 . 2]" 1
170 1 16 ALA HA 1 21 LEU MD1 . . 4.830 3.611 3.367 3.843 . 0 0 "[ . 1 . 2]" 1
171 1 16 ALA HA 1 33 ILE H . . 5.160 5.086 4.893 5.156 . 0 0 "[ . 1 . 2]" 1
172 1 16 ALA HA 1 34 VAL HA . . 3.440 2.078 1.999 2.221 . 0 0 "[ . 1 . 2]" 1
173 1 16 ALA HA 1 35 ASN H . . 3.690 2.807 2.630 3.027 . 0 0 "[ . 1 . 2]" 1
174 1 16 ALA MB 1 17 TYR H . . 3.300 2.912 2.646 3.097 . 0 0 "[ . 1 . 2]" 1
175 1 16 ALA MB 1 17 TYR HA . . 4.920 3.960 3.807 4.030 . 0 0 "[ . 1 . 2]" 1
176 1 16 ALA MB 1 18 GLY H . . 5.440 5.284 5.096 5.422 . 0 0 "[ . 1 . 2]" 1
177 1 16 ALA MB 1 21 LEU MD1 . . 3.030 1.959 1.798 2.147 . 0 0 "[ . 1 . 2]" 1
178 1 16 ALA MB 1 21 LEU MD2 . . 3.280 2.369 2.194 2.550 . 0 0 "[ . 1 . 2]" 1
179 1 16 ALA MB 1 32 PHE QD . . 4.070 2.827 2.486 3.167 . 0 0 "[ . 1 . 2]" 1
180 1 16 ALA MB 1 32 PHE QE . . 4.540 3.664 3.418 3.916 . 0 0 "[ . 1 . 2]" 1
181 1 16 ALA MB 1 34 VAL HA . . 3.900 2.661 2.426 2.878 . 0 0 "[ . 1 . 2]" 1
182 1 16 ALA MB 1 34 VAL MG1 . . 3.610 2.623 2.292 2.874 . 0 0 "[ . 1 . 2]" 1
183 1 16 ALA MB 1 35 ASN H . . 4.360 4.080 3.871 4.251 . 0 0 "[ . 1 . 2]" 1
184 1 16 ALA MB 1 89 ILE MD . . 3.150 3.014 2.809 3.141 . 0 0 "[ . 1 . 2]" 1
185 1 16 ALA MB 1 94 PHE QE . . 4.140 3.006 2.514 3.323 . 0 0 "[ . 1 . 2]" 1
186 1 16 ALA MB 1 94 PHE HZ . . 4.120 3.615 3.139 4.084 . 0 0 "[ . 1 . 2]" 1
187 1 17 TYR H 1 17 TYR HB2 . . 4.070 3.837 3.800 3.891 . 0 0 "[ . 1 . 2]" 1
188 1 17 TYR H 1 17 TYR HB3 . . 4.200 3.315 3.230 3.582 . 0 0 "[ . 1 . 2]" 1
189 1 17 TYR H 1 17 TYR QD . . 3.760 3.098 2.844 3.281 . 0 0 "[ . 1 . 2]" 1
190 1 17 TYR H 1 17 TYR QE . . 4.600 4.284 4.156 4.396 . 0 0 "[ . 1 . 2]" 1
191 1 17 TYR H 1 21 LEU MD1 . . 3.930 2.899 2.560 3.240 . 0 0 "[ . 1 . 2]" 1
192 1 17 TYR H 1 32 PHE HB2 . . 4.410 3.751 3.535 3.868 . 0 0 "[ . 1 . 2]" 1
193 1 17 TYR H 1 32 PHE HB3 . . 5.500 5.382 5.226 5.475 . 0 0 "[ . 1 . 2]" 1
194 1 17 TYR H 1 32 PHE QD . . 4.480 4.269 3.947 4.452 . 0 0 "[ . 1 . 2]" 1
195 1 17 TYR H 1 33 ILE H . . 3.630 3.400 3.268 3.508 . 0 0 "[ . 1 . 2]" 1
196 1 17 TYR H 1 33 ILE HB . . 3.920 3.870 3.785 3.922 0.002 13 0 "[ . 1 . 2]" 1
197 1 17 TYR H 1 33 ILE MG . . 4.510 4.018 3.880 4.168 . 0 0 "[ . 1 . 2]" 1
198 1 17 TYR H 1 34 VAL HA . . 3.940 3.447 3.325 3.620 . 0 0 "[ . 1 . 2]" 1
199 1 17 TYR H 1 34 VAL MG1 . . 5.500 5.055 4.847 5.250 . 0 0 "[ . 1 . 2]" 1
200 1 17 TYR H 1 35 ASN H . . 4.470 4.068 3.846 4.395 . 0 0 "[ . 1 . 2]" 1
201 1 17 TYR H 1 81 ILE MD . . 5.500 5.401 5.263 5.495 . 0 0 "[ . 1 . 2]" 1
202 1 17 TYR HA 1 17 TYR QD . . 4.110 3.732 3.713 3.741 . 0 0 "[ . 1 . 2]" 1
203 1 17 TYR HA 1 18 GLY H . . 2.930 2.242 2.181 2.371 . 0 0 "[ . 1 . 2]" 1
204 1 17 TYR HA 1 18 GLY QA . . 4.880 3.947 3.926 3.994 . 0 0 "[ . 1 . 2]" 1
205 1 17 TYR HA 1 21 LEU MD1 . . 3.570 2.301 1.959 2.501 . 0 0 "[ . 1 . 2]" 1
206 1 17 TYR HB2 1 18 GLY H . . 3.230 2.894 2.545 3.129 . 0 0 "[ . 1 . 2]" 1
207 1 17 TYR HB3 1 18 GLY H . . 4.170 3.963 3.584 4.143 . 0 0 "[ . 1 . 2]" 1
208 1 17 TYR HB3 1 21 LEU MD1 . . 4.840 4.196 3.900 4.390 . 0 0 "[ . 1 . 2]" 1
209 1 17 TYR QD 1 18 GLY H . . 3.920 3.836 3.704 3.920 . 0 0 "[ . 1 . 2]" 1
210 1 17 TYR QD 1 18 GLY QA . . 4.460 3.238 3.135 3.505 . 0 0 "[ . 1 . 2]" 1
211 1 17 TYR QD 1 19 PRO QD . . 5.210 4.810 4.667 5.147 . 0 0 "[ . 1 . 2]" 1
212 1 17 TYR QD 1 33 ILE HB . . 4.230 3.333 2.787 3.681 . 0 0 "[ . 1 . 2]" 1
213 1 17 TYR QD 1 33 ILE MD . . 4.690 4.157 3.865 4.343 . 0 0 "[ . 1 . 2]" 1
214 1 17 TYR QD 1 33 ILE MG . . 4.370 3.931 3.757 4.213 . 0 0 "[ . 1 . 2]" 1
215 1 17 TYR QE 1 33 ILE HB . . 3.950 2.496 2.017 2.886 . 0 0 "[ . 1 . 2]" 1
216 1 17 TYR QE 1 33 ILE MD . . 3.780 2.307 2.055 2.489 . 0 0 "[ . 1 . 2]" 1
217 1 17 TYR QE 1 33 ILE HG12 . . 4.940 4.660 4.403 4.927 . 0 0 "[ . 1 . 2]" 1
218 1 17 TYR QE 1 33 ILE MG . . 3.320 2.783 2.456 3.070 . 0 0 "[ . 1 . 2]" 1
219 1 17 TYR QE 1 35 ASN H . . 4.550 3.611 3.251 3.951 . 0 0 "[ . 1 . 2]" 1
220 1 17 TYR QE 1 35 ASN HA . . 5.240 4.209 3.752 4.822 . 0 0 "[ . 1 . 2]" 1
221 1 17 TYR QE 1 35 ASN HB2 . . 3.720 2.402 2.124 2.719 . 0 0 "[ . 1 . 2]" 1
222 1 17 TYR QE 1 35 ASN HB3 . . 3.880 3.214 2.448 3.781 . 0 0 "[ . 1 . 2]" 1
223 1 17 TYR QE 1 35 ASN HD21 . . 4.530 4.265 3.598 4.514 . 0 0 "[ . 1 . 2]" 1
224 1 17 TYR QE 1 63 GLU QG . . 4.600 4.269 3.778 4.604 0.004 17 0 "[ . 1 . 2]" 1
225 1 18 GLY H 1 19 PRO HD2 . . 4.880 4.796 4.778 4.808 . 0 0 "[ . 1 . 2]" 1
226 1 18 GLY H 1 19 PRO HD3 . . 4.880 4.674 4.601 4.749 . 0 0 "[ . 1 . 2]" 1
227 1 18 GLY H 1 21 LEU H . . 5.060 4.462 4.173 4.605 . 0 0 "[ . 1 . 2]" 1
228 1 18 GLY H 1 21 LEU HB2 . . 4.990 3.943 3.572 4.252 . 0 0 "[ . 1 . 2]" 1
229 1 18 GLY H 1 21 LEU MD1 . . 3.740 2.617 2.477 2.847 . 0 0 "[ . 1 . 2]" 1
230 1 18 GLY H 1 21 LEU MD2 . . 5.390 5.286 5.172 5.376 . 0 0 "[ . 1 . 2]" 1
231 1 18 GLY H 1 21 LEU HG . . 4.850 4.465 4.301 4.736 . 0 0 "[ . 1 . 2]" 1
232 1 18 GLY QA 1 19 PRO QD . . 2.700 2.024 2.011 2.031 . 0 0 "[ . 1 . 2]" 1
233 1 18 GLY QA 1 19 PRO HG2 . . 4.600 4.066 4.064 4.067 . 0 0 "[ . 1 . 2]" 1
234 1 18 GLY QA 1 19 PRO HG3 . . 4.630 4.247 4.235 4.255 . 0 0 "[ . 1 . 2]" 1
235 1 18 GLY QA 1 20 GLY H . . 3.890 3.043 2.940 3.172 . 0 0 "[ . 1 . 2]" 1
236 1 18 GLY QA 1 21 LEU H . . 4.880 3.718 3.603 3.860 . 0 0 "[ . 1 . 2]" 1
237 1 18 GLY QA 1 21 LEU HG . . 5.090 3.821 3.653 3.986 . 0 0 "[ . 1 . 2]" 1
238 1 18 GLY QA 1 32 PHE HB2 . . 4.220 2.826 2.672 3.003 . 0 0 "[ . 1 . 2]" 1
239 1 18 GLY QA 1 32 PHE HB3 . . 4.210 2.638 2.377 2.959 . 0 0 "[ . 1 . 2]" 1
240 1 18 GLY HA2 1 19 PRO HD2 . . 3.500 2.518 2.442 2.569 . 0 0 "[ . 1 . 2]" 1
241 1 18 GLY HA2 1 19 PRO HD3 . . 3.500 2.352 2.315 2.380 . 0 0 "[ . 1 . 2]" 1
242 1 18 GLY HA3 1 19 PRO HD2 . . 3.500 2.508 2.456 2.585 . 0 0 "[ . 1 . 2]" 1
243 1 18 GLY HA3 1 19 PRO HD3 . . 3.500 3.392 3.344 3.462 . 0 0 "[ . 1 . 2]" 1
244 1 19 PRO HA 1 22 GLU H . . 3.900 3.485 3.323 3.678 . 0 0 "[ . 1 . 2]" 1
245 1 19 PRO HA 1 22 GLU HB2 . . 3.670 2.972 2.728 3.147 . 0 0 "[ . 1 . 2]" 1
246 1 19 PRO HA 1 22 GLU HB3 . . 4.580 4.400 4.222 4.549 . 0 0 "[ . 1 . 2]" 1
247 1 19 PRO HA 1 22 GLU QG . . 4.730 4.456 3.968 4.678 . 0 0 "[ . 1 . 2]" 1
248 1 19 PRO HA 1 23 GLY H . . 4.380 3.872 3.625 4.128 . 0 0 "[ . 1 . 2]" 1
249 1 19 PRO QB 1 20 GLY H . . 3.710 3.456 3.321 3.575 . 0 0 "[ . 1 . 2]" 1
250 1 19 PRO QD 1 20 GLY H . . 3.680 2.685 2.620 2.766 . 0 0 "[ . 1 . 2]" 1
251 1 19 PRO HD2 1 20 GLY H . . 4.290 2.736 2.665 2.826 . 0 0 "[ . 1 . 2]" 1
252 1 19 PRO HD3 1 20 GLY H . . 4.290 3.892 3.852 3.940 . 0 0 "[ . 1 . 2]" 1
253 1 19 PRO HG2 1 20 GLY H . . 3.600 2.788 2.550 3.015 . 0 0 "[ . 1 . 2]" 1
254 1 19 PRO HG2 1 31 GLU H . . 4.470 3.138 2.695 3.756 . 0 0 "[ . 1 . 2]" 1
255 1 19 PRO HG3 1 20 GLY H . . 4.450 4.195 4.016 4.366 . 0 0 "[ . 1 . 2]" 1
256 1 20 GLY H 1 21 LEU H . . 3.600 2.541 2.392 2.664 . 0 0 "[ . 1 . 2]" 1
257 1 20 GLY H 1 21 LEU HG . . 5.090 3.952 3.747 4.185 . 0 0 "[ . 1 . 2]" 1
258 1 20 GLY H 1 22 GLU H . . 5.230 4.112 3.886 4.353 . 0 0 "[ . 1 . 2]" 1
259 1 20 GLY H 1 30 SER HB3 . . 4.360 4.020 3.585 4.286 . 0 0 "[ . 1 . 2]" 1
260 1 20 GLY H 1 31 GLU H . . 4.310 3.854 3.499 4.140 . 0 0 "[ . 1 . 2]" 1
261 1 20 GLY H 1 32 PHE HB2 . . 4.600 4.394 4.211 4.599 . 0 0 "[ . 1 . 2]" 1
262 1 20 GLY H 1 32 PHE HB3 . . 3.940 2.825 2.674 3.069 . 0 0 "[ . 1 . 2]" 1
263 1 20 GLY H 1 32 PHE QD . . 4.210 3.747 3.465 4.193 . 0 0 "[ . 1 . 2]" 1
264 1 20 GLY QA 1 22 GLU H . . 4.770 4.135 3.707 4.413 . 0 0 "[ . 1 . 2]" 1
265 1 20 GLY QA 1 30 SER HB2 . . 3.600 3.110 2.868 3.362 . 0 0 "[ . 1 . 2]" 1
266 1 20 GLY QA 1 31 GLU H . . 3.770 3.470 3.269 3.623 . 0 0 "[ . 1 . 2]" 1
267 1 20 GLY QA 1 32 PHE QD . . 3.870 2.297 2.013 2.731 . 0 0 "[ . 1 . 2]" 1
268 1 20 GLY QA 1 69 TYR QE . . 3.810 2.712 2.279 3.288 . 0 0 "[ . 1 . 2]" 1
269 1 20 GLY QA 1 69 TYR HH . . 4.300 2.415 2.008 3.035 . 0 0 "[ . 1 . 2]" 1
270 1 20 GLY QA 1 79 ILE MD . . 5.030 3.649 3.273 4.000 . 0 0 "[ . 1 . 2]" 1
271 1 20 GLY HA2 1 23 GLY H . . 4.760 3.483 3.261 3.653 . 0 0 "[ . 1 . 2]" 1
272 1 20 GLY HA2 1 30 SER HB2 . . 4.130 3.271 2.992 3.563 . 0 0 "[ . 1 . 2]" 1
273 1 20 GLY HA2 1 30 SER HB3 . . 3.620 2.139 2.005 2.557 . 0 0 "[ . 1 . 2]" 1
274 1 20 GLY HA2 1 31 GLU H . . 4.370 4.191 3.901 4.333 . 0 0 "[ . 1 . 2]" 1
275 1 20 GLY HA2 1 32 PHE QD . . 4.690 3.985 3.711 4.393 . 0 0 "[ . 1 . 2]" 1
276 1 20 GLY HA2 1 69 TYR QE . . 4.390 3.309 2.790 4.084 . 0 0 "[ . 1 . 2]" 1
277 1 20 GLY HA2 1 69 TYR HH . . 4.930 2.493 2.056 3.133 . 0 0 "[ . 1 . 2]" 1
278 1 20 GLY HA3 1 23 GLY H . . 4.760 4.595 4.470 4.730 . 0 0 "[ . 1 . 2]" 1
279 1 20 GLY HA3 1 30 SER HB2 . . 4.130 3.903 3.514 4.121 . 0 0 "[ . 1 . 2]" 1
280 1 20 GLY HA3 1 30 SER HB3 . . 3.620 3.015 2.442 3.310 . 0 0 "[ . 1 . 2]" 1
281 1 20 GLY HA3 1 31 GLU H . . 4.370 3.704 3.510 3.920 . 0 0 "[ . 1 . 2]" 1
282 1 20 GLY HA3 1 32 PHE QD . . 4.690 2.312 2.022 2.758 . 0 0 "[ . 1 . 2]" 1
283 1 20 GLY HA3 1 69 TYR QE . . 4.390 2.891 2.417 3.467 . 0 0 "[ . 1 . 2]" 1
284 1 20 GLY HA3 1 69 TYR HH . . 4.930 3.279 2.797 4.117 . 0 0 "[ . 1 . 2]" 1
285 1 21 LEU H 1 21 LEU HB2 . . 3.260 2.612 2.536 2.692 . 0 0 "[ . 1 . 2]" 1
286 1 21 LEU H 1 21 LEU HB3 . . 3.810 3.605 3.586 3.631 . 0 0 "[ . 1 . 2]" 1
287 1 21 LEU H 1 21 LEU MD1 . . 3.870 3.229 3.090 3.397 . 0 0 "[ . 1 . 2]" 1
288 1 21 LEU H 1 21 LEU MD2 . . 3.970 3.527 3.362 3.687 . 0 0 "[ . 1 . 2]" 1
289 1 21 LEU H 1 21 LEU HG . . 3.220 2.102 1.925 2.292 . 0 0 "[ . 1 . 2]" 1
290 1 21 LEU H 1 22 GLU HA . . 5.300 5.152 5.010 5.248 . 0 0 "[ . 1 . 2]" 1
291 1 21 LEU H 1 23 GLY H . . 4.190 3.684 3.500 3.907 . 0 0 "[ . 1 . 2]" 1
292 1 21 LEU H 1 32 PHE HB2 . . 4.200 3.960 3.662 4.185 . 0 0 "[ . 1 . 2]" 1
293 1 21 LEU H 1 32 PHE HB3 . . 3.950 2.798 2.445 2.997 . 0 0 "[ . 1 . 2]" 1
294 1 21 LEU H 1 32 PHE QD . . 4.500 3.577 3.360 3.847 . 0 0 "[ . 1 . 2]" 1
295 1 21 LEU HA 1 21 LEU MD1 . . 4.130 3.975 3.952 4.004 . 0 0 "[ . 1 . 2]" 1
296 1 21 LEU HA 1 21 LEU MD2 . . 3.180 2.483 2.327 2.610 . 0 0 "[ . 1 . 2]" 1
297 1 21 LEU HA 1 23 GLY H . . 4.970 4.214 4.093 4.441 . 0 0 "[ . 1 . 2]" 1
298 1 21 LEU HA 1 79 ILE MD . . 3.370 1.945 1.811 2.083 . 0 0 "[ . 1 . 2]" 1
299 1 21 LEU HA 1 96 ALA MB . . 3.630 2.888 2.591 3.089 . 0 0 "[ . 1 . 2]" 1
300 1 21 LEU HB2 1 21 LEU MD1 . . 3.360 2.147 1.995 2.237 . 0 0 "[ . 1 . 2]" 1
301 1 21 LEU HB2 1 22 GLU H . . 3.930 2.629 2.360 3.044 . 0 0 "[ . 1 . 2]" 1
302 1 21 LEU HB2 1 22 GLU QG . . 4.730 3.472 3.274 3.635 . 0 0 "[ . 1 . 2]" 1
303 1 21 LEU HB3 1 21 LEU MD1 . . 3.110 2.597 2.510 2.666 . 0 0 "[ . 1 . 2]" 1
304 1 21 LEU HB3 1 21 LEU MD2 . . 3.300 2.139 2.063 2.252 . 0 0 "[ . 1 . 2]" 1
305 1 21 LEU HB3 1 22 GLU H . . 4.110 3.819 3.634 4.095 . 0 0 "[ . 1 . 2]" 1
306 1 21 LEU HB3 1 22 GLU QG . . 4.640 4.478 4.293 4.569 . 0 0 "[ . 1 . 2]" 1
307 1 21 LEU HB3 1 94 PHE HB3 . . 4.600 2.453 2.114 2.795 . 0 0 "[ . 1 . 2]" 1
308 1 21 LEU HB3 1 94 PHE QD . . 4.180 3.286 2.807 3.674 . 0 0 "[ . 1 . 2]" 1
309 1 21 LEU MD1 1 22 GLU H . . 4.650 4.132 3.891 4.447 . 0 0 "[ . 1 . 2]" 1
310 1 21 LEU MD1 1 32 PHE HB2 . . 4.200 2.257 2.051 2.747 . 0 0 "[ . 1 . 2]" 1
311 1 21 LEU MD1 1 32 PHE HB3 . . 4.540 3.122 2.906 3.403 . 0 0 "[ . 1 . 2]" 1
312 1 21 LEU MD1 1 32 PHE QD . . 4.380 3.120 2.715 3.673 . 0 0 "[ . 1 . 2]" 1
313 1 21 LEU MD1 1 33 ILE H . . 4.850 3.936 3.439 4.382 . 0 0 "[ . 1 . 2]" 1
314 1 21 LEU MD1 1 79 ILE MD . . 4.590 4.430 4.236 4.587 . 0 0 "[ . 1 . 2]" 1
315 1 21 LEU MD1 1 79 ILE MG . . 4.950 4.534 4.326 4.795 . 0 0 "[ . 1 . 2]" 1
316 1 21 LEU MD1 1 81 ILE MD . . 4.140 3.413 3.145 3.583 . 0 0 "[ . 1 . 2]" 1
317 1 21 LEU MD1 1 94 PHE HB3 . . 5.230 4.314 4.078 4.542 . 0 0 "[ . 1 . 2]" 1
318 1 21 LEU MD1 1 94 PHE QD . . 4.300 3.871 3.454 4.184 . 0 0 "[ . 1 . 2]" 1
319 1 21 LEU MD1 1 94 PHE QE . . 4.660 3.890 3.395 4.313 . 0 0 "[ . 1 . 2]" 1
320 1 21 LEU MD2 1 32 PHE HB2 . . 4.170 3.212 2.937 3.566 . 0 0 "[ . 1 . 2]" 1
321 1 21 LEU MD2 1 32 PHE HB3 . . 4.570 3.491 3.116 3.791 . 0 0 "[ . 1 . 2]" 1
322 1 21 LEU MD2 1 32 PHE QD . . 4.180 2.742 2.529 3.011 . 0 0 "[ . 1 . 2]" 1
323 1 21 LEU MD2 1 32 PHE QE . . 4.280 3.007 2.829 3.326 . 0 0 "[ . 1 . 2]" 1
324 1 21 LEU MD2 1 32 PHE HZ . . 5.020 3.625 3.399 3.990 . 0 0 "[ . 1 . 2]" 1
325 1 21 LEU MD2 1 79 ILE HB . . 4.340 3.182 2.985 3.450 . 0 0 "[ . 1 . 2]" 1
326 1 21 LEU MD2 1 79 ILE MD . . 3.390 2.258 1.937 2.510 . 0 0 "[ . 1 . 2]" 1
327 1 21 LEU MD2 1 79 ILE MG . . 3.330 2.297 2.117 2.493 . 0 0 "[ . 1 . 2]" 1
328 1 21 LEU MD2 1 81 ILE MD . . 3.460 2.104 1.946 2.340 . 0 0 "[ . 1 . 2]" 1
329 1 21 LEU MD2 1 94 PHE HB2 . . 3.980 2.794 2.445 3.105 . 0 0 "[ . 1 . 2]" 1
330 1 21 LEU MD2 1 94 PHE HB3 . . 4.320 3.049 2.688 3.543 . 0 0 "[ . 1 . 2]" 1
331 1 21 LEU MD2 1 94 PHE QD . . 3.910 3.090 2.732 3.546 . 0 0 "[ . 1 . 2]" 1
332 1 21 LEU MD2 1 94 PHE QE . . 4.800 3.966 3.561 4.301 . 0 0 "[ . 1 . 2]" 1
333 1 21 LEU HG 1 22 GLU H . . 4.270 4.132 3.989 4.271 0.001 12 0 "[ . 1 . 2]" 1
334 1 21 LEU HG 1 32 PHE HA . . 5.500 4.479 4.240 4.872 . 0 0 "[ . 1 . 2]" 1
335 1 21 LEU HG 1 32 PHE HB2 . . 4.050 2.581 2.359 2.974 . 0 0 "[ . 1 . 2]" 1
336 1 21 LEU HG 1 32 PHE HB3 . . 4.130 2.281 2.018 2.699 . 0 0 "[ . 1 . 2]" 1
337 1 21 LEU HG 1 32 PHE QD . . 4.060 3.099 2.932 3.402 . 0 0 "[ . 1 . 2]" 1
338 1 22 GLU H 1 22 GLU HB2 . . 3.860 2.229 2.187 2.296 . 0 0 "[ . 1 . 2]" 1
339 1 22 GLU H 1 22 GLU HB3 . . 3.650 3.513 3.487 3.558 . 0 0 "[ . 1 . 2]" 1
340 1 22 GLU H 1 22 GLU QG . . 3.550 2.957 2.669 3.148 . 0 0 "[ . 1 . 2]" 1
341 1 22 GLU H 1 23 GLY H . . 2.800 2.346 2.149 2.520 . 0 0 "[ . 1 . 2]" 1
342 1 22 GLU H 1 23 GLY QA . . 5.280 4.339 4.172 4.482 . 0 0 "[ . 1 . 2]" 1
343 1 22 GLU H 1 96 ALA MB . . 4.770 4.196 3.841 4.520 . 0 0 "[ . 1 . 2]" 1
344 1 22 GLU HA 1 22 GLU QG . . 3.490 2.429 2.133 2.796 . 0 0 "[ . 1 . 2]" 1
345 1 22 GLU HA 1 96 ALA HA . . 4.310 3.301 3.001 3.591 . 0 0 "[ . 1 . 2]" 1
346 1 22 GLU HB2 1 23 GLY H . . 4.090 3.162 3.004 3.277 . 0 0 "[ . 1 . 2]" 1
347 1 22 GLU HB3 1 23 GLY H . . 3.790 3.716 3.591 3.790 0.000 17 0 "[ . 1 . 2]" 1
348 1 22 GLU QG 1 23 GLY H . . 4.560 4.477 4.359 4.554 . 0 0 "[ . 1 . 2]" 1
349 1 23 GLY H 1 24 GLY QA . . 4.750 4.691 4.645 4.742 . 0 0 "[ . 1 . 2]" 1
350 1 23 GLY H 1 69 TYR HH . . 4.530 4.265 4.031 4.480 . 0 0 "[ . 1 . 2]" 1
351 1 23 GLY H 1 79 ILE MD . . 4.720 4.637 4.418 4.719 . 0 0 "[ . 1 . 2]" 1
352 1 23 GLY H 1 96 ALA HA . . 5.090 3.793 3.511 4.077 . 0 0 "[ . 1 . 2]" 1
353 1 23 GLY H 1 96 ALA MB . . 3.870 3.137 2.797 3.344 . 0 0 "[ . 1 . 2]" 1
354 1 23 GLY QA 1 24 GLY H . . 2.570 2.275 2.195 2.287 . 0 0 "[ . 1 . 2]" 1
355 1 23 GLY QA 1 24 GLY QA . . 3.910 3.535 3.532 3.541 . 0 0 "[ . 1 . 2]" 1
356 1 23 GLY QA 1 96 ALA HA . . 4.110 3.137 2.848 3.365 . 0 0 "[ . 1 . 2]" 1
357 1 23 GLY QA 1 96 ALA MB . . 3.260 2.373 2.134 2.735 . 0 0 "[ . 1 . 2]" 1
358 1 23 GLY QA 1 97 LYS H . . 3.300 2.513 2.171 2.761 . 0 0 "[ . 1 . 2]" 1
359 1 23 GLY QA 1 98 VAL HA . . 3.940 3.476 3.322 3.622 . 0 0 "[ . 1 . 2]" 1
360 1 23 GLY QA 1 98 VAL MG2 . . 3.890 2.785 2.533 3.098 . 0 0 "[ . 1 . 2]" 1
361 1 23 GLY HA2 1 24 GLY H . . 2.960 2.521 2.411 2.923 . 0 0 "[ . 1 . 2]" 1
362 1 23 GLY HA2 1 96 ALA HA . . 4.880 3.631 3.306 4.018 . 0 0 "[ . 1 . 2]" 1
363 1 23 GLY HA2 1 96 ALA MB . . 3.770 2.434 2.189 2.825 . 0 0 "[ . 1 . 2]" 1
364 1 23 GLY HA2 1 97 LYS H . . 3.920 3.629 3.227 3.840 . 0 0 "[ . 1 . 2]" 1
365 1 23 GLY HA3 1 24 GLY H . . 2.960 2.618 2.268 2.736 . 0 0 "[ . 1 . 2]" 1
366 1 23 GLY HA3 1 96 ALA HA . . 4.880 3.435 3.109 3.640 . 0 0 "[ . 1 . 2]" 1
367 1 23 GLY HA3 1 96 ALA MB . . 3.770 3.302 2.896 3.660 . 0 0 "[ . 1 . 2]" 1
368 1 23 GLY HA3 1 97 LYS H . . 3.920 2.564 2.202 2.837 . 0 0 "[ . 1 . 2]" 1
369 1 24 GLY H 1 25 THR H . . 4.490 3.754 3.501 4.044 . 0 0 "[ . 1 . 2]" 1
370 1 24 GLY H 1 25 THR HA . . 4.750 4.510 4.394 4.588 . 0 0 "[ . 1 . 2]" 1
371 1 24 GLY H 1 96 ALA MB . . 4.760 4.459 4.265 4.745 . 0 0 "[ . 1 . 2]" 1
372 1 24 GLY H 1 97 LYS H . . 5.100 4.809 4.359 5.102 0.002 16 0 "[ . 1 . 2]" 1
373 1 24 GLY H 1 98 VAL HA . . 3.070 2.250 2.082 2.344 . 0 0 "[ . 1 . 2]" 1
374 1 24 GLY H 1 98 VAL HB . . 4.970 4.642 4.487 4.857 . 0 0 "[ . 1 . 2]" 1
375 1 24 GLY H 1 98 VAL MG1 . . 4.280 3.302 3.011 3.598 . 0 0 "[ . 1 . 2]" 1
376 1 24 GLY H 1 98 VAL MG2 . . 3.490 2.307 1.978 2.732 . 0 0 "[ . 1 . 2]" 1
377 1 24 GLY H 1 99 THR H . . 3.870 3.782 3.469 3.871 0.001 9 0 "[ . 1 . 2]" 1
378 1 24 GLY H 1 99 THR MG . . 4.820 4.578 4.296 4.819 . 0 0 "[ . 1 . 2]" 1
379 1 24 GLY QA 1 25 THR H . . 2.660 2.113 2.108 2.134 . 0 0 "[ . 1 . 2]" 1
380 1 24 GLY QA 1 25 THR HA . . 4.650 3.975 3.953 4.015 . 0 0 "[ . 1 . 2]" 1
381 1 24 GLY QA 1 30 SER HG . . 4.190 3.464 3.026 4.078 . 0 0 "[ . 1 . 2]" 1
382 1 24 GLY QA 1 98 VAL HA . . 4.040 3.963 3.749 4.042 0.002 10 0 "[ . 1 . 2]" 1
383 1 24 GLY QA 1 98 VAL MG1 . . 4.310 3.930 3.623 4.159 . 0 0 "[ . 1 . 2]" 1
384 1 24 GLY QA 1 98 VAL MG2 . . 4.070 3.814 3.555 4.049 . 0 0 "[ . 1 . 2]" 1
385 1 24 GLY QA 1 99 THR H . . 4.490 4.311 4.083 4.458 . 0 0 "[ . 1 . 2]" 1
386 1 24 GLY QA 1 99 THR MG . . 4.800 4.278 3.846 4.803 0.003 13 0 "[ . 1 . 2]" 1
387 1 25 THR H 1 25 THR HB . . 3.300 2.662 2.561 2.770 . 0 0 "[ . 1 . 2]" 1
388 1 25 THR H 1 25 THR MG . . 3.910 3.821 3.763 3.896 . 0 0 "[ . 1 . 2]" 1
389 1 25 THR H 1 26 THR H . . 4.500 4.455 4.406 4.498 . 0 0 "[ . 1 . 2]" 1
390 1 25 THR H 1 28 VAL H . . 5.010 4.849 4.625 5.011 0.001 13 0 "[ . 1 . 2]" 1
391 1 25 THR H 1 28 VAL HB . . 4.030 2.948 2.752 3.102 . 0 0 "[ . 1 . 2]" 1
392 1 25 THR H 1 28 VAL MG1 . . 4.700 3.481 3.306 3.692 . 0 0 "[ . 1 . 2]" 1
393 1 25 THR H 1 28 VAL MG2 . . 4.500 3.688 3.392 3.984 . 0 0 "[ . 1 . 2]" 1
394 1 25 THR H 1 30 SER HG . . 4.910 3.714 3.370 4.251 . 0 0 "[ . 1 . 2]" 1
395 1 25 THR H 1 71 PRO HG3 . . 4.850 4.245 3.789 4.624 . 0 0 "[ . 1 . 2]" 1
396 1 25 THR H 1 98 VAL MG1 . . 4.710 3.311 2.777 3.749 . 0 0 "[ . 1 . 2]" 1
397 1 25 THR H 1 98 VAL MG2 . . 4.530 4.130 3.705 4.442 . 0 0 "[ . 1 . 2]" 1
398 1 25 THR H 1 99 THR H . . 4.990 4.465 4.233 4.601 . 0 0 "[ . 1 . 2]" 1
399 1 25 THR HA 1 25 THR MG . . 3.350 2.453 2.260 2.519 . 0 0 "[ . 1 . 2]" 1
400 1 25 THR HA 1 26 THR H . . 2.690 2.327 2.265 2.372 . 0 0 "[ . 1 . 2]" 1
401 1 25 THR HA 1 26 THR HA . . 4.740 4.311 4.307 4.315 . 0 0 "[ . 1 . 2]" 1
402 1 25 THR HA 1 28 VAL HB . . 5.290 4.697 4.490 4.886 . 0 0 "[ . 1 . 2]" 1
403 1 25 THR HA 1 98 VAL HA . . 4.020 3.892 3.748 3.992 . 0 0 "[ . 1 . 2]" 1
404 1 25 THR HA 1 98 VAL MG1 . . 3.580 2.470 2.101 2.741 . 0 0 "[ . 1 . 2]" 1
405 1 25 THR HA 1 99 THR H . . 3.300 2.411 2.142 2.568 . 0 0 "[ . 1 . 2]" 1
406 1 25 THR HB 1 26 THR H . . 4.280 3.821 3.666 3.990 . 0 0 "[ . 1 . 2]" 1
407 1 25 THR HB 1 28 VAL H . . 5.190 4.812 4.423 5.138 . 0 0 "[ . 1 . 2]" 1
408 1 25 THR HB 1 28 VAL HB . . 3.450 2.919 2.546 3.229 . 0 0 "[ . 1 . 2]" 1
409 1 25 THR HB 1 28 VAL MG1 . . 3.920 3.305 3.004 3.671 . 0 0 "[ . 1 . 2]" 1
410 1 25 THR HB 1 28 VAL MG2 . . 3.430 2.033 1.889 2.212 . 0 0 "[ . 1 . 2]" 1
411 1 25 THR HB 1 99 THR H . . 5.500 5.346 5.079 5.502 0.002 16 0 "[ . 1 . 2]" 1
412 1 25 THR MG 1 26 THR H . . 3.430 1.919 1.811 2.121 . 0 0 "[ . 1 . 2]" 1
413 1 25 THR MG 1 28 VAL H . . 4.380 4.076 3.802 4.353 . 0 0 "[ . 1 . 2]" 1
414 1 25 THR MG 1 28 VAL HB . . 3.810 3.556 3.187 3.805 . 0 0 "[ . 1 . 2]" 1
415 1 25 THR MG 1 28 VAL MG2 . . 3.150 2.097 1.892 2.417 . 0 0 "[ . 1 . 2]" 1
416 1 26 THR H 1 26 THR HB . . 3.630 3.593 3.558 3.614 . 0 0 "[ . 1 . 2]" 1
417 1 26 THR H 1 26 THR MG . . 2.920 2.509 2.287 2.762 . 0 0 "[ . 1 . 2]" 1
418 1 26 THR H 1 27 GLY H . . 4.750 4.632 4.619 4.643 . 0 0 "[ . 1 . 2]" 1
419 1 26 THR H 1 71 PRO HB2 . . 5.500 5.105 4.606 5.477 . 0 0 "[ . 1 . 2]" 1
420 1 26 THR H 1 71 PRO HG2 . . 4.840 4.611 4.519 4.741 . 0 0 "[ . 1 . 2]" 1
421 1 26 THR H 1 71 PRO HG3 . . 5.500 4.839 4.629 5.019 . 0 0 "[ . 1 . 2]" 1
422 1 26 THR H 1 98 VAL MG1 . . 3.770 2.699 2.456 2.864 . 0 0 "[ . 1 . 2]" 1
423 1 26 THR H 1 99 THR H . . 4.030 3.856 3.663 4.026 . 0 0 "[ . 1 . 2]" 1
424 1 26 THR H 1 100 GLY HA2 . . 4.810 4.440 4.149 4.620 . 0 0 "[ . 1 . 2]" 1
425 1 26 THR H 1 100 GLY HA3 . . 3.660 2.761 2.530 2.933 . 0 0 "[ . 1 . 2]" 1
426 1 26 THR HA 1 26 THR MG . . 3.210 2.230 2.055 2.336 . 0 0 "[ . 1 . 2]" 1
427 1 26 THR HA 1 27 GLY H . . 2.920 2.286 2.235 2.353 . 0 0 "[ . 1 . 2]" 1
428 1 26 THR HA 1 27 GLY HA2 . . 4.720 4.468 4.436 4.505 . 0 0 "[ . 1 . 2]" 1
429 1 26 THR HA 1 27 GLY HA3 . . 4.640 4.528 4.489 4.584 . 0 0 "[ . 1 . 2]" 1
430 1 26 THR HA 1 28 VAL H . . 3.680 3.295 3.158 3.508 . 0 0 "[ . 1 . 2]" 1
431 1 26 THR HA 1 71 PRO HB2 . . 4.170 2.525 2.143 2.838 . 0 0 "[ . 1 . 2]" 1
432 1 26 THR HA 1 71 PRO HB3 . . 4.880 3.789 3.504 4.051 . 0 0 "[ . 1 . 2]" 1
433 1 26 THR HA 1 71 PRO QD . . 4.620 4.016 3.975 4.086 . 0 0 "[ . 1 . 2]" 1
434 1 26 THR HA 1 71 PRO HG2 . . 3.320 2.039 1.999 2.135 . 0 0 "[ . 1 . 2]" 1
435 1 26 THR HA 1 71 PRO HG3 . . 4.440 2.832 2.728 2.953 . 0 0 "[ . 1 . 2]" 1
436 1 26 THR HA 1 98 VAL MG1 . . 4.000 2.325 2.083 2.526 . 0 0 "[ . 1 . 2]" 1
437 1 26 THR HA 1 99 THR H . . 5.500 5.366 5.158 5.499 . 0 0 "[ . 1 . 2]" 1
438 1 26 THR HB 1 27 GLY H . . 3.600 2.725 2.548 2.885 . 0 0 "[ . 1 . 2]" 1
439 1 26 THR HB 1 27 GLY HA2 . . 4.810 4.483 4.342 4.596 . 0 0 "[ . 1 . 2]" 1
440 1 26 THR HB 1 27 GLY HA3 . . 4.800 4.009 3.881 4.068 . 0 0 "[ . 1 . 2]" 1
441 1 26 THR HB 1 71 PRO HB2 . . 4.190 4.064 3.888 4.190 0.000 8 0 "[ . 1 . 2]" 1
442 1 26 THR HB 1 71 PRO HG2 . . 4.910 4.011 3.873 4.160 . 0 0 "[ . 1 . 2]" 1
443 1 26 THR HB 1 103 LEU H . . 4.960 2.848 2.419 3.285 . 0 0 "[ . 1 . 2]" 1
444 1 26 THR HB 1 103 LEU HB2 . . 4.770 2.529 2.076 3.006 . 0 0 "[ . 1 . 2]" 1
445 1 26 THR HB 1 103 LEU QB . . 3.980 2.510 2.066 2.974 . 0 0 "[ . 1 . 2]" 1
446 1 26 THR HB 1 103 LEU HB3 . . 4.770 4.250 3.746 4.738 . 0 0 "[ . 1 . 2]" 1
447 1 26 THR HB 1 103 LEU MD1 . . 3.760 2.713 2.163 3.232 . 0 0 "[ . 1 . 2]" 1
448 1 26 THR HB 1 103 LEU HG . . 4.100 3.857 3.444 4.078 . 0 0 "[ . 1 . 2]" 1
449 1 26 THR HG1 1 26 THR MG . . 3.350 2.412 2.081 3.034 . 0 0 "[ . 1 . 2]" 1
450 1 26 THR HG1 1 100 GLY HA2 . . 4.730 3.955 3.527 4.523 . 0 0 "[ . 1 . 2]" 1
451 1 26 THR HG1 1 101 PRO HD2 . . 4.530 2.829 2.456 3.095 . 0 0 "[ . 1 . 2]" 1
452 1 26 THR HG1 1 101 PRO QD . . 3.820 2.788 2.430 3.032 . 0 0 "[ . 1 . 2]" 1
453 1 26 THR HG1 1 101 PRO HD3 . . 4.530 4.238 3.878 4.498 . 0 0 "[ . 1 . 2]" 1
454 1 26 THR HG1 1 101 PRO HG2 . . 4.690 3.465 3.166 3.801 . 0 0 "[ . 1 . 2]" 1
455 1 26 THR HG1 1 101 PRO HG3 . . 5.100 4.827 4.596 5.100 . 0 0 "[ . 1 . 2]" 1
456 1 26 THR HG1 1 103 LEU MD1 . . 4.580 2.717 2.029 3.722 . 0 0 "[ . 1 . 2]" 1
457 1 26 THR HG1 1 103 LEU HG . . 4.480 3.551 2.941 4.190 . 0 0 "[ . 1 . 2]" 1
458 1 26 THR MG 1 27 GLY H . . 3.670 3.569 3.367 3.662 . 0 0 "[ . 1 . 2]" 1
459 1 26 THR MG 1 71 PRO HB2 . . 4.110 2.758 2.456 3.043 . 0 0 "[ . 1 . 2]" 1
460 1 26 THR MG 1 71 PRO HG2 . . 4.650 3.723 3.511 3.957 . 0 0 "[ . 1 . 2]" 1
461 1 26 THR MG 1 73 ALA H . . 4.100 3.546 3.066 4.091 . 0 0 "[ . 1 . 2]" 1
462 1 26 THR MG 1 73 ALA HA . . 3.370 2.961 2.501 3.349 . 0 0 "[ . 1 . 2]" 1
463 1 26 THR MG 1 74 PRO HA . . 3.470 2.653 2.367 2.996 . 0 0 "[ . 1 . 2]" 1
464 1 26 THR MG 1 74 PRO HB2 . . 4.430 3.975 3.644 4.404 . 0 0 "[ . 1 . 2]" 1
465 1 26 THR MG 1 74 PRO QB . . 3.560 2.574 2.181 3.027 . 0 0 "[ . 1 . 2]" 1
466 1 26 THR MG 1 74 PRO HB3 . . 4.430 2.609 2.198 3.084 . 0 0 "[ . 1 . 2]" 1
467 1 26 THR MG 1 74 PRO HD2 . . 4.140 3.649 3.369 3.859 . 0 0 "[ . 1 . 2]" 1
468 1 26 THR MG 1 74 PRO QD . . 3.330 2.233 1.951 2.463 . 0 0 "[ . 1 . 2]" 1
469 1 26 THR MG 1 74 PRO HD3 . . 4.140 2.253 1.961 2.492 . 0 0 "[ . 1 . 2]" 1
470 1 26 THR MG 1 74 PRO QG . . 4.740 3.380 3.062 3.732 . 0 0 "[ . 1 . 2]" 1
471 1 26 THR MG 1 99 THR H . . 5.280 4.018 3.691 4.453 . 0 0 "[ . 1 . 2]" 1
472 1 26 THR MG 1 100 GLY HA2 . . 4.460 4.245 3.716 4.457 . 0 0 "[ . 1 . 2]" 1
473 1 26 THR MG 1 100 GLY HA3 . . 4.530 3.061 2.470 3.339 . 0 0 "[ . 1 . 2]" 1
474 1 26 THR MG 1 102 ARG HA . . 4.040 3.117 2.045 3.473 . 0 0 "[ . 1 . 2]" 1
475 1 26 THR MG 1 103 LEU H . . 4.560 3.302 2.717 3.840 . 0 0 "[ . 1 . 2]" 1
476 1 27 GLY H 1 28 VAL H . . 3.270 2.704 2.593 2.832 . 0 0 "[ . 1 . 2]" 1
477 1 27 GLY H 1 70 THR MG . . 3.880 3.422 3.311 3.569 . 0 0 "[ . 1 . 2]" 1
478 1 27 GLY H 1 71 PRO HA . . 5.110 4.805 4.515 5.077 . 0 0 "[ . 1 . 2]" 1
479 1 27 GLY H 1 71 PRO HB2 . . 4.110 3.242 3.012 3.437 . 0 0 "[ . 1 . 2]" 1
480 1 27 GLY H 1 71 PRO QD . . 4.340 3.472 3.339 3.612 . 0 0 "[ . 1 . 2]" 1
481 1 27 GLY H 1 71 PRO HG2 . . 4.120 1.998 1.898 2.195 . 0 0 "[ . 1 . 2]" 1
482 1 27 GLY H 1 71 PRO HG3 . . 4.980 3.732 3.624 3.947 . 0 0 "[ . 1 . 2]" 1
483 1 27 GLY H 1 72 MET HA . . 4.220 3.950 3.603 4.221 0.001 10 0 "[ . 1 . 2]" 1
484 1 27 GLY H 1 103 LEU MD1 . . 3.960 3.389 2.804 3.731 . 0 0 "[ . 1 . 2]" 1
485 1 27 GLY HA2 1 70 THR MG . . 3.430 2.600 2.177 2.951 . 0 0 "[ . 1 . 2]" 1
486 1 27 GLY HA2 1 71 PRO HG2 . . 4.030 3.642 3.381 3.865 . 0 0 "[ . 1 . 2]" 1
487 1 27 GLY HA2 1 103 LEU MD1 . . 3.720 3.446 2.985 3.694 . 0 0 "[ . 1 . 2]" 1
488 1 27 GLY HA3 1 70 THR MG . . 4.320 3.981 3.561 4.319 . 0 0 "[ . 1 . 2]" 1
489 1 27 GLY HA3 1 71 PRO HG2 . . 5.030 4.414 4.187 4.581 . 0 0 "[ . 1 . 2]" 1
490 1 27 GLY HA3 1 103 LEU MD1 . . 3.500 2.078 1.812 2.364 . 0 0 "[ . 1 . 2]" 1
491 1 27 GLY HA3 1 103 LEU MD2 . . 4.110 3.777 3.319 4.066 . 0 0 "[ . 1 . 2]" 1
492 1 28 VAL H 1 28 VAL HB . . 3.030 2.613 2.497 2.731 . 0 0 "[ . 1 . 2]" 1
493 1 28 VAL H 1 28 VAL MG1 . . 3.870 3.826 3.761 3.877 0.007 19 0 "[ . 1 . 2]" 1
494 1 28 VAL H 1 28 VAL MG2 . . 2.990 2.902 2.790 2.991 0.001 17 0 "[ . 1 . 2]" 1
495 1 28 VAL H 1 29 SER H . . 4.400 4.219 4.059 4.397 . 0 0 "[ . 1 . 2]" 1
496 1 28 VAL H 1 29 SER HA . . 5.140 4.917 4.836 5.069 . 0 0 "[ . 1 . 2]" 1
497 1 28 VAL H 1 70 THR HA . . 5.150 4.417 4.010 4.820 . 0 0 "[ . 1 . 2]" 1
498 1 28 VAL H 1 70 THR MG . . 3.920 3.335 2.982 3.699 . 0 0 "[ . 1 . 2]" 1
499 1 28 VAL H 1 71 PRO HD2 . . 4.090 2.602 2.294 2.903 . 0 0 "[ . 1 . 2]" 1
500 1 28 VAL H 1 71 PRO HD3 . . 4.090 3.924 3.715 4.078 . 0 0 "[ . 1 . 2]" 1
501 1 28 VAL H 1 71 PRO HG2 . . 4.460 2.303 2.116 2.514 . 0 0 "[ . 1 . 2]" 1
502 1 28 VAL H 1 71 PRO HG3 . . 5.030 3.191 2.949 3.469 . 0 0 "[ . 1 . 2]" 1
503 1 28 VAL HA 1 28 VAL MG1 . . 3.280 2.393 2.308 2.474 . 0 0 "[ . 1 . 2]" 1
504 1 28 VAL HA 1 28 VAL MG2 . . 3.190 2.303 2.172 2.422 . 0 0 "[ . 1 . 2]" 1
505 1 28 VAL HA 1 29 SER H . . 2.600 2.148 2.140 2.183 . 0 0 "[ . 1 . 2]" 1
506 1 28 VAL HB 1 29 SER H . . 4.440 4.339 4.192 4.433 . 0 0 "[ . 1 . 2]" 1
507 1 28 VAL MG1 1 29 SER H . . 3.140 2.799 2.430 3.091 . 0 0 "[ . 1 . 2]" 1
508 1 28 VAL MG2 1 29 SER H . . 4.240 4.054 3.872 4.161 . 0 0 "[ . 1 . 2]" 1
509 1 29 SER H 1 29 SER QB . . 2.930 2.500 2.236 2.656 . 0 0 "[ . 1 . 2]" 1
510 1 29 SER H 1 30 SER H . . 4.490 4.387 4.290 4.494 0.004 9 0 "[ . 1 . 2]" 1
511 1 29 SER H 1 70 THR MG . . 4.380 3.796 3.313 4.045 . 0 0 "[ . 1 . 2]" 1
512 1 29 SER HA 1 30 SER H . . 2.720 2.154 2.138 2.179 . 0 0 "[ . 1 . 2]" 1
513 1 29 SER HA 1 68 THR MG . . 3.920 3.577 3.380 3.858 . 0 0 "[ . 1 . 2]" 1
514 1 29 SER HA 1 69 TYR H . . 4.500 4.443 4.310 4.501 0.001 8 0 "[ . 1 . 2]" 1
515 1 29 SER HA 1 70 THR HA . . 4.080 2.778 2.184 3.252 . 0 0 "[ . 1 . 2]" 1
516 1 29 SER HA 1 70 THR HB . . 5.160 4.709 4.309 4.986 . 0 0 "[ . 1 . 2]" 1
517 1 29 SER HA 1 70 THR MG . . 3.850 3.465 3.122 3.652 . 0 0 "[ . 1 . 2]" 1
518 1 29 SER HA 1 71 PRO QD . . 4.600 3.411 2.968 3.907 . 0 0 "[ . 1 . 2]" 1
519 1 29 SER QB 1 30 SER H . . 3.610 3.497 3.287 3.611 0.001 15 0 "[ . 1 . 2]" 1
520 1 29 SER QB 1 68 THR MG . . 3.340 2.455 2.104 2.665 . 0 0 "[ . 1 . 2]" 1
521 1 29 SER QB 1 69 TYR H . . 4.760 4.595 4.322 4.761 0.001 7 0 "[ . 1 . 2]" 1
522 1 30 SER H 1 30 SER HB2 . . 3.340 2.631 2.370 2.885 . 0 0 "[ . 1 . 2]" 1
523 1 30 SER H 1 30 SER HB3 . . 4.090 3.734 3.618 3.853 . 0 0 "[ . 1 . 2]" 1
524 1 30 SER H 1 30 SER HG . . 4.190 3.541 2.486 4.021 . 0 0 "[ . 1 . 2]" 1
525 1 30 SER H 1 31 GLU H . . 4.740 4.426 4.218 4.580 . 0 0 "[ . 1 . 2]" 1
526 1 30 SER H 1 68 THR MG . . 4.300 3.531 3.101 3.972 . 0 0 "[ . 1 . 2]" 1
527 1 30 SER H 1 69 TYR QD . . 4.650 4.085 3.847 4.341 . 0 0 "[ . 1 . 2]" 1
528 1 30 SER H 1 70 THR H . . 5.190 4.849 4.718 4.949 . 0 0 "[ . 1 . 2]" 1
529 1 30 SER H 1 70 THR HA . . 3.880 3.069 2.837 3.287 . 0 0 "[ . 1 . 2]" 1
530 1 30 SER H 1 70 THR MG . . 4.950 4.603 4.415 4.760 . 0 0 "[ . 1 . 2]" 1
531 1 30 SER H 1 71 PRO HD2 . . 4.360 3.836 3.552 4.228 . 0 0 "[ . 1 . 2]" 1
532 1 30 SER H 1 71 PRO HD3 . . 4.360 3.366 2.883 3.980 . 0 0 "[ . 1 . 2]" 1
533 1 30 SER HA 1 31 GLU H . . 2.880 2.185 2.140 2.418 . 0 0 "[ . 1 . 2]" 1
534 1 30 SER HA 1 31 GLU HA . . 4.760 4.420 4.394 4.534 . 0 0 "[ . 1 . 2]" 1
535 1 30 SER HA 1 31 GLU QB . . 4.880 4.285 3.848 4.465 . 0 0 "[ . 1 . 2]" 1
536 1 30 SER HB2 1 31 GLU H . . 4.200 4.058 3.540 4.202 0.002 17 0 "[ . 1 . 2]" 1
537 1 30 SER HB2 1 69 TYR H . . 4.150 4.055 3.666 4.155 0.005 17 0 "[ . 1 . 2]" 1
538 1 30 SER HB2 1 69 TYR QD . . 3.880 3.715 3.484 3.873 . 0 0 "[ . 1 . 2]" 1
539 1 30 SER HB2 1 69 TYR QE . . 4.200 2.951 2.633 3.166 . 0 0 "[ . 1 . 2]" 1
540 1 30 SER HB2 1 69 TYR HH . . 4.160 3.233 2.798 3.802 . 0 0 "[ . 1 . 2]" 1
541 1 30 SER HB3 1 31 GLU H . . 3.700 3.173 2.419 3.452 . 0 0 "[ . 1 . 2]" 1
542 1 30 SER HB3 1 69 TYR H . . 5.260 5.141 4.804 5.266 0.006 17 0 "[ . 1 . 2]" 1
543 1 30 SER HB3 1 69 TYR QE . . 4.240 3.732 3.216 4.060 . 0 0 "[ . 1 . 2]" 1
544 1 30 SER HB3 1 69 TYR HH . . 4.510 3.373 2.821 4.354 . 0 0 "[ . 1 . 2]" 1
545 1 30 SER HG 1 31 GLU H . . 5.170 4.582 3.959 5.153 . 0 0 "[ . 1 . 2]" 1
546 1 31 GLU H 1 31 GLU QB . . 3.320 3.011 2.629 3.183 . 0 0 "[ . 1 . 2]" 1
547 1 31 GLU H 1 31 GLU QG . . 4.330 2.809 2.125 4.322 . 0 0 "[ . 1 . 2]" 1
548 1 31 GLU H 1 32 PHE H . . 4.560 4.400 4.308 4.430 . 0 0 "[ . 1 . 2]" 1
549 1 31 GLU H 1 68 THR HA . . 5.500 4.527 4.375 4.820 . 0 0 "[ . 1 . 2]" 1
550 1 31 GLU HA 1 31 GLU QG . . 3.870 3.281 2.477 3.521 . 0 0 "[ . 1 . 2]" 1
551 1 31 GLU HA 1 32 PHE H . . 2.700 2.522 2.259 2.651 . 0 0 "[ . 1 . 2]" 1
552 1 31 GLU HA 1 32 PHE QD . . 5.100 3.192 2.612 3.613 . 0 0 "[ . 1 . 2]" 1
553 1 31 GLU HA 1 66 VAL MG2 . . 4.650 4.447 4.143 4.639 . 0 0 "[ . 1 . 2]" 1
554 1 31 GLU HA 1 67 VAL H . . 4.770 4.440 4.203 4.607 . 0 0 "[ . 1 . 2]" 1
555 1 31 GLU HA 1 67 VAL MG1 . . 4.890 4.486 4.099 4.741 . 0 0 "[ . 1 . 2]" 1
556 1 31 GLU HA 1 68 THR HA . . 3.410 2.487 2.349 2.653 . 0 0 "[ . 1 . 2]" 1
557 1 31 GLU HA 1 68 THR MG . . 3.910 3.754 3.495 3.913 0.003 8 0 "[ . 1 . 2]" 1
558 1 31 GLU HA 1 69 TYR H . . 3.930 3.381 3.148 3.598 . 0 0 "[ . 1 . 2]" 1
559 1 31 GLU QB 1 32 PHE H . . 3.620 2.321 1.974 3.453 . 0 0 "[ . 1 . 2]" 1
560 1 31 GLU QB 1 67 VAL HA . . 5.500 4.665 4.361 5.482 . 0 0 "[ . 1 . 2]" 1
561 1 31 GLU QB 1 68 THR HA . . 4.450 2.152 1.944 2.569 . 0 0 "[ . 1 . 2]" 1
562 1 31 GLU QB 1 68 THR MG . . 3.500 2.238 1.968 2.773 . 0 0 "[ . 1 . 2]" 1
563 1 31 GLU QB 1 69 TYR H . . 4.810 3.622 3.345 4.126 . 0 0 "[ . 1 . 2]" 1
564 1 31 GLU QG 1 32 PHE H . . 3.690 3.018 1.894 3.415 . 0 0 "[ . 1 . 2]" 1
565 1 31 GLU QG 1 32 PHE HA . . 5.030 3.535 3.223 3.998 . 0 0 "[ . 1 . 2]" 1
566 1 31 GLU QG 1 33 ILE H . . 5.500 5.116 4.586 5.489 . 0 0 "[ . 1 . 2]" 1
567 1 31 GLU QG 1 66 VAL MG2 . . 3.800 3.151 1.908 3.733 . 0 0 "[ . 1 . 2]" 1
568 1 31 GLU QG 1 67 VAL H . . 5.500 4.710 2.755 5.361 . 0 0 "[ . 1 . 2]" 1
569 1 31 GLU QG 1 68 THR HA . . 4.590 4.059 3.177 4.319 . 0 0 "[ . 1 . 2]" 1
570 1 31 GLU QG 1 68 THR MG . . 3.810 3.534 3.279 3.796 . 0 0 "[ . 1 . 2]" 1
571 1 31 GLU QG 1 69 TYR H . . 5.500 5.315 4.957 5.502 0.002 17 0 "[ . 1 . 2]" 1
572 1 32 PHE H 1 32 PHE QD . . 4.030 3.224 2.954 3.448 . 0 0 "[ . 1 . 2]" 1
573 1 32 PHE H 1 32 PHE QE . . 5.090 4.432 4.221 4.606 . 0 0 "[ . 1 . 2]" 1
574 1 32 PHE H 1 66 VAL HA . . 4.450 4.230 4.089 4.394 . 0 0 "[ . 1 . 2]" 1
575 1 32 PHE H 1 66 VAL MG1 . . 5.320 5.251 5.084 5.321 0.001 7 0 "[ . 1 . 2]" 1
576 1 32 PHE H 1 66 VAL MG2 . . 3.840 2.814 2.613 3.108 . 0 0 "[ . 1 . 2]" 1
577 1 32 PHE H 1 67 VAL H . . 3.390 2.796 2.665 2.915 . 0 0 "[ . 1 . 2]" 1
578 1 32 PHE H 1 67 VAL HB . . 4.450 4.161 3.841 4.451 0.001 7 0 "[ . 1 . 2]" 1
579 1 32 PHE H 1 68 THR HA . . 4.430 4.162 4.011 4.355 . 0 0 "[ . 1 . 2]" 1
580 1 32 PHE HA 1 32 PHE QD . . 4.390 3.716 3.665 3.727 . 0 0 "[ . 1 . 2]" 1
581 1 32 PHE HA 1 33 ILE H . . 3.030 2.300 2.230 2.384 . 0 0 "[ . 1 . 2]" 1
582 1 32 PHE HA 1 33 ILE HB . . 4.820 4.508 4.466 4.568 . 0 0 "[ . 1 . 2]" 1
583 1 32 PHE HA 1 33 ILE HG13 . . 5.130 3.837 3.709 3.958 . 0 0 "[ . 1 . 2]" 1
584 1 32 PHE HB2 1 33 ILE H . . 3.410 2.700 2.479 2.911 . 0 0 "[ . 1 . 2]" 1
585 1 32 PHE HB2 1 34 VAL MG2 . . 5.090 4.202 4.037 4.377 . 0 0 "[ . 1 . 2]" 1
586 1 32 PHE HB3 1 33 ILE H . . 4.030 3.839 3.675 4.015 . 0 0 "[ . 1 . 2]" 1
587 1 32 PHE QD 1 33 ILE H . . 3.850 3.753 3.593 3.853 0.003 16 0 "[ . 1 . 2]" 1
588 1 32 PHE QD 1 34 VAL MG2 . . 3.660 2.342 2.166 2.574 . 0 0 "[ . 1 . 2]" 1
589 1 32 PHE QD 1 67 VAL H . . 5.170 4.224 4.041 4.430 . 0 0 "[ . 1 . 2]" 1
590 1 32 PHE QD 1 67 VAL HB . . 4.830 4.217 3.873 4.470 . 0 0 "[ . 1 . 2]" 1
591 1 32 PHE QD 1 69 TYR QE . . 3.630 3.084 2.686 3.614 . 0 0 "[ . 1 . 2]" 1
592 1 32 PHE QD 1 79 ILE MD . . 4.720 3.521 3.201 3.940 . 0 0 "[ . 1 . 2]" 1
593 1 32 PHE QD 1 81 ILE MD . . 4.450 3.526 3.290 3.701 . 0 0 "[ . 1 . 2]" 1
594 1 32 PHE QE 1 34 VAL MG2 . . 3.290 2.475 2.332 2.748 . 0 0 "[ . 1 . 2]" 1
595 1 32 PHE QE 1 46 VAL MG1 . . 3.970 3.043 2.645 3.408 . 0 0 "[ . 1 . 2]" 1
596 1 32 PHE QE 1 48 ILE MD . . 4.020 3.428 3.045 3.851 . 0 0 "[ . 1 . 2]" 1
597 1 32 PHE QE 1 67 VAL HB . . 4.300 3.253 2.923 3.501 . 0 0 "[ . 1 . 2]" 1
598 1 32 PHE QE 1 67 VAL MG1 . . 3.760 3.497 2.988 3.760 . 0 0 "[ . 1 . 2]" 1
599 1 32 PHE QE 1 67 VAL MG2 . . 3.790 3.424 2.644 3.787 . 0 0 "[ . 1 . 2]" 1
600 1 32 PHE QE 1 69 TYR QD . . 3.830 2.855 2.572 3.427 . 0 0 "[ . 1 . 2]" 1
601 1 32 PHE QE 1 69 TYR QE . . 3.530 2.913 2.429 3.363 . 0 0 "[ . 1 . 2]" 1
602 1 32 PHE QE 1 79 ILE MD . . 3.870 2.918 2.423 3.351 . 0 0 "[ . 1 . 2]" 1
603 1 32 PHE QE 1 79 ILE MG . . 3.720 3.024 2.729 3.271 . 0 0 "[ . 1 . 2]" 1
604 1 32 PHE QE 1 81 ILE MD . . 3.440 2.624 2.130 2.950 . 0 0 "[ . 1 . 2]" 1
605 1 32 PHE HZ 1 46 VAL MG1 . . 3.540 2.139 1.964 2.406 . 0 0 "[ . 1 . 2]" 1
606 1 32 PHE HZ 1 46 VAL MG2 . . 3.940 3.498 3.133 3.885 . 0 0 "[ . 1 . 2]" 1
607 1 32 PHE HZ 1 48 ILE MD . . 4.500 4.337 4.052 4.505 0.005 16 0 "[ . 1 . 2]" 1
608 1 32 PHE HZ 1 67 VAL HB . . 4.600 2.992 2.599 3.329 . 0 0 "[ . 1 . 2]" 1
609 1 32 PHE HZ 1 67 VAL MG1 . . 3.760 3.491 2.974 3.719 . 0 0 "[ . 1 . 2]" 1
610 1 32 PHE HZ 1 67 VAL MG2 . . 4.180 3.496 2.950 3.948 . 0 0 "[ . 1 . 2]" 1
611 1 32 PHE HZ 1 79 ILE MD . . 4.460 4.029 3.406 4.411 . 0 0 "[ . 1 . 2]" 1
612 1 32 PHE HZ 1 79 ILE MG . . 3.350 2.737 2.358 3.066 . 0 0 "[ . 1 . 2]" 1
613 1 32 PHE HZ 1 81 ILE MD . . 3.920 3.674 3.288 3.923 0.003 13 0 "[ . 1 . 2]" 1
614 1 33 ILE H 1 33 ILE HB . . 3.060 2.432 2.388 2.503 . 0 0 "[ . 1 . 2]" 1
615 1 33 ILE H 1 33 ILE MD . . 4.120 4.033 3.846 4.120 0.000 17 0 "[ . 1 . 2]" 1
616 1 33 ILE H 1 33 ILE HG12 . . 4.130 3.955 3.839 4.062 . 0 0 "[ . 1 . 2]" 1
617 1 33 ILE H 1 33 ILE HG13 . . 3.220 2.897 2.661 2.998 . 0 0 "[ . 1 . 2]" 1
618 1 33 ILE H 1 33 ILE MG . . 3.970 3.733 3.705 3.772 . 0 0 "[ . 1 . 2]" 1
619 1 33 ILE H 1 34 VAL H . . 4.630 4.505 4.399 4.559 . 0 0 "[ . 1 . 2]" 1
620 1 33 ILE HA 1 33 ILE MD . . 3.990 3.758 3.707 3.802 . 0 0 "[ . 1 . 2]" 1
621 1 33 ILE HA 1 33 ILE HG12 . . 4.000 2.394 2.313 2.474 . 0 0 "[ . 1 . 2]" 1
622 1 33 ILE HA 1 33 ILE HG13 . . 3.900 2.929 2.815 3.016 . 0 0 "[ . 1 . 2]" 1
623 1 33 ILE HA 1 33 ILE MG . . 3.210 2.463 2.408 2.509 . 0 0 "[ . 1 . 2]" 1
624 1 33 ILE HA 1 34 VAL H . . 2.870 2.202 2.149 2.306 . 0 0 "[ . 1 . 2]" 1
625 1 33 ILE HA 1 34 VAL HA . . 4.870 4.394 4.384 4.422 . 0 0 "[ . 1 . 2]" 1
626 1 33 ILE HA 1 34 VAL HB . . 5.180 4.640 4.528 4.737 . 0 0 "[ . 1 . 2]" 1
627 1 33 ILE HA 1 34 VAL MG2 . . 4.260 3.527 3.377 3.674 . 0 0 "[ . 1 . 2]" 1
628 1 33 ILE HA 1 65 HIS H . . 5.320 4.718 4.386 5.118 . 0 0 "[ . 1 . 2]" 1
629 1 33 ILE HB 1 33 ILE MD . . 3.150 2.386 2.319 2.454 . 0 0 "[ . 1 . 2]" 1
630 1 33 ILE HB 1 34 VAL H . . 4.440 4.123 3.915 4.283 . 0 0 "[ . 1 . 2]" 1
631 1 33 ILE MD 1 33 ILE MG . . 2.890 1.964 1.897 2.051 . 0 0 "[ . 1 . 2]" 1
632 1 33 ILE MD 1 34 VAL H . . 5.020 4.759 4.459 4.963 . 0 0 "[ . 1 . 2]" 1
633 1 33 ILE MD 1 63 GLU QB . . 3.590 2.645 2.264 2.960 . 0 0 "[ . 1 . 2]" 1
634 1 33 ILE MD 1 63 GLU HG2 . . 4.910 3.708 2.600 4.328 . 0 0 "[ . 1 . 2]" 1
635 1 33 ILE MD 1 63 GLU QG . . 4.180 2.668 2.299 3.332 . 0 0 "[ . 1 . 2]" 1
636 1 33 ILE MD 1 63 GLU HG3 . . 4.910 2.860 2.339 4.024 . 0 0 "[ . 1 . 2]" 1
637 1 33 ILE MD 1 64 GLY H . . 5.500 5.347 4.901 5.500 . 0 0 "[ . 1 . 2]" 1
638 1 33 ILE HG12 1 33 ILE MG . . 3.630 2.466 2.376 2.530 . 0 0 "[ . 1 . 2]" 1
639 1 33 ILE HG12 1 34 VAL H . . 4.980 3.988 3.775 4.121 . 0 0 "[ . 1 . 2]" 1
640 1 33 ILE HG13 1 33 ILE MG . . 3.290 3.197 3.189 3.203 . 0 0 "[ . 1 . 2]" 1
641 1 33 ILE HG13 1 34 VAL H . . 5.040 4.895 4.760 4.998 . 0 0 "[ . 1 . 2]" 1
642 1 33 ILE HG13 1 66 VAL HB . . 4.890 4.340 3.853 4.780 . 0 0 "[ . 1 . 2]" 1
643 1 33 ILE MG 1 34 VAL H . . 3.280 2.257 1.911 2.553 . 0 0 "[ . 1 . 2]" 1
644 1 33 ILE MG 1 34 VAL HA . . 4.710 3.535 3.309 3.705 . 0 0 "[ . 1 . 2]" 1
645 1 33 ILE MG 1 35 ASN H . . 4.340 3.316 3.177 3.608 . 0 0 "[ . 1 . 2]" 1
646 1 33 ILE MG 1 35 ASN HA . . 4.150 3.549 3.486 3.644 . 0 0 "[ . 1 . 2]" 1
647 1 33 ILE MG 1 35 ASN HB2 . . 4.010 3.701 3.530 3.957 . 0 0 "[ . 1 . 2]" 1
648 1 33 ILE MG 1 35 ASN HB3 . . 4.740 4.473 4.277 4.727 . 0 0 "[ . 1 . 2]" 1
649 1 33 ILE MG 1 63 GLU HB2 . . 4.080 2.066 1.909 2.286 . 0 0 "[ . 1 . 2]" 1
650 1 33 ILE MG 1 63 GLU QB . . 3.400 1.939 1.800 2.143 . 0 0 "[ . 1 . 2]" 1
651 1 33 ILE MG 1 63 GLU HB3 . . 4.080 2.377 2.051 2.751 . 0 0 "[ . 1 . 2]" 1
652 1 33 ILE MG 1 63 GLU HG2 . . 4.320 3.800 2.295 4.258 . 0 0 "[ . 1 . 2]" 1
653 1 33 ILE MG 1 63 GLU HG3 . . 4.320 3.005 2.172 3.905 . 0 0 "[ . 1 . 2]" 1
654 1 33 ILE MG 1 64 GLY H . . 4.860 4.175 3.986 4.406 . 0 0 "[ . 1 . 2]" 1
655 1 33 ILE MG 1 65 HIS H . . 4.090 3.562 3.168 4.083 . 0 0 "[ . 1 . 2]" 1
656 1 34 VAL H 1 34 VAL HB . . 3.510 2.632 2.560 2.709 . 0 0 "[ . 1 . 2]" 1
657 1 34 VAL H 1 34 VAL MG1 . . 4.070 3.846 3.817 3.884 . 0 0 "[ . 1 . 2]" 1
658 1 34 VAL H 1 34 VAL MG2 . . 3.580 2.655 2.445 2.881 . 0 0 "[ . 1 . 2]" 1
659 1 34 VAL H 1 35 ASN H . . 4.470 4.120 3.965 4.231 . 0 0 "[ . 1 . 2]" 1
660 1 34 VAL H 1 65 HIS H . . 3.640 2.876 2.536 3.292 . 0 0 "[ . 1 . 2]" 1
661 1 34 VAL H 1 65 HIS QB . . 4.180 3.847 3.656 4.087 . 0 0 "[ . 1 . 2]" 1
662 1 34 VAL HA 1 34 VAL MG1 . . 3.350 2.362 2.275 2.451 . 0 0 "[ . 1 . 2]" 1
663 1 34 VAL HA 1 34 VAL MG2 . . 3.540 2.381 2.267 2.458 . 0 0 "[ . 1 . 2]" 1
664 1 34 VAL HA 1 35 ASN H . . 2.880 2.175 2.150 2.194 . 0 0 "[ . 1 . 2]" 1
665 1 34 VAL HA 1 35 ASN HA . . 4.860 4.441 4.412 4.457 . 0 0 "[ . 1 . 2]" 1
666 1 34 VAL HA 1 35 ASN HB2 . . 5.090 4.964 4.676 5.070 . 0 0 "[ . 1 . 2]" 1
667 1 34 VAL HA 1 35 ASN HB3 . . 4.770 4.388 4.313 4.645 . 0 0 "[ . 1 . 2]" 1
668 1 34 VAL HB 1 35 ASN H . . 4.920 4.387 4.281 4.448 . 0 0 "[ . 1 . 2]" 1
669 1 34 VAL HB 1 36 THR MG . . 3.810 3.159 2.947 3.446 . 0 0 "[ . 1 . 2]" 1
670 1 34 VAL HB 1 44 LEU MD2 . . 4.110 3.095 2.523 3.798 . 0 0 "[ . 1 . 2]" 1
671 1 34 VAL HB 1 65 HIS H . . 3.960 2.655 2.467 2.928 . 0 0 "[ . 1 . 2]" 1
672 1 34 VAL HB 1 65 HIS HB2 . . 4.380 2.226 2.017 2.524 . 0 0 "[ . 1 . 2]" 1
673 1 34 VAL HB 1 65 HIS QB . . 3.560 2.209 2.007 2.491 . 0 0 "[ . 1 . 2]" 1
674 1 34 VAL HB 1 65 HIS HB3 . . 4.380 3.726 3.421 3.964 . 0 0 "[ . 1 . 2]" 1
675 1 34 VAL HB 1 65 HIS HD2 . . 4.630 4.052 3.599 4.589 . 0 0 "[ . 1 . 2]" 1
676 1 34 VAL HB 1 66 VAL HA . . 5.500 4.788 4.491 5.049 . 0 0 "[ . 1 . 2]" 1
677 1 34 VAL MG1 1 35 ASN H . . 3.640 3.088 2.846 3.232 . 0 0 "[ . 1 . 2]" 1
678 1 34 VAL MG1 1 44 LEU MD2 . . 3.570 2.829 2.040 3.438 . 0 0 "[ . 1 . 2]" 1
679 1 34 VAL MG1 1 65 HIS H . . 4.410 3.826 3.480 4.056 . 0 0 "[ . 1 . 2]" 1
680 1 34 VAL MG2 1 35 ASN H . . 4.250 4.216 4.120 4.253 0.003 19 0 "[ . 1 . 2]" 1
681 1 34 VAL MG2 1 65 HIS QB . . 4.260 2.971 2.715 3.287 . 0 0 "[ . 1 . 2]" 1
682 1 35 ASN H 1 35 ASN HB2 . . 3.550 2.886 2.556 3.017 . 0 0 "[ . 1 . 2]" 1
683 1 35 ASN H 1 35 ASN HB3 . . 3.340 2.259 2.194 2.530 . 0 0 "[ . 1 . 2]" 1
684 1 35 ASN H 1 35 ASN HD21 . . 5.050 4.809 4.550 4.919 . 0 0 "[ . 1 . 2]" 1
685 1 35 ASN H 1 36 THR H . . 4.590 4.275 4.226 4.416 . 0 0 "[ . 1 . 2]" 1
686 1 35 ASN HA 1 35 ASN HD22 . . 5.160 4.076 3.845 4.582 . 0 0 "[ . 1 . 2]" 1
687 1 35 ASN HA 1 36 THR H . . 2.880 2.186 2.143 2.201 . 0 0 "[ . 1 . 2]" 1
688 1 35 ASN HA 1 36 THR HA . . 4.730 4.407 4.390 4.420 . 0 0 "[ . 1 . 2]" 1
689 1 35 ASN HA 1 37 LEU H . . 3.700 3.265 3.208 3.447 . 0 0 "[ . 1 . 2]" 1
690 1 35 ASN HA 1 63 GLU QB . . 4.570 3.462 3.138 3.792 . 0 0 "[ . 1 . 2]" 1
691 1 35 ASN HA 1 64 GLY HA2 . . 4.940 4.784 4.301 4.941 0.001 7 0 "[ . 1 . 2]" 1
692 1 35 ASN HA 1 64 GLY HA3 . . 4.550 3.350 2.879 3.482 . 0 0 "[ . 1 . 2]" 1
693 1 35 ASN HA 1 65 HIS H . . 4.510 4.417 4.057 4.513 0.003 19 0 "[ . 1 . 2]" 1
694 1 35 ASN HB2 1 35 ASN HD22 . . 3.790 3.516 3.458 3.614 . 0 0 "[ . 1 . 2]" 1
695 1 35 ASN HB2 1 36 THR H . . 4.490 4.347 4.212 4.464 . 0 0 "[ . 1 . 2]" 1
696 1 35 ASN HB2 1 37 LEU MD1 . . 5.500 4.338 4.064 4.521 . 0 0 "[ . 1 . 2]" 1
697 1 35 ASN HB3 1 36 THR H . . 4.880 4.546 4.333 4.589 . 0 0 "[ . 1 . 2]" 1
698 1 35 ASN HD21 1 37 LEU MD1 . . 4.440 2.786 2.363 4.341 . 0 0 "[ . 1 . 2]" 1
699 1 35 ASN HD22 1 37 LEU MD1 . . 4.200 3.230 2.097 3.733 . 0 0 "[ . 1 . 2]" 1
700 1 36 THR H 1 36 THR MG . . 3.670 2.910 2.660 3.151 . 0 0 "[ . 1 . 2]" 1
701 1 36 THR H 1 37 LEU H . . 3.050 2.108 1.912 2.367 . 0 0 "[ . 1 . 2]" 1
702 1 36 THR H 1 37 LEU HA . . 4.860 4.456 4.313 4.547 . 0 0 "[ . 1 . 2]" 1
703 1 36 THR H 1 37 LEU HG . . 4.310 3.103 2.866 3.284 . 0 0 "[ . 1 . 2]" 1
704 1 36 THR H 1 38 ASN H . . 4.770 4.633 4.435 4.766 . 0 0 "[ . 1 . 2]" 1
705 1 36 THR H 1 64 GLY HA2 . . 3.840 3.587 3.242 3.825 . 0 0 "[ . 1 . 2]" 1
706 1 36 THR H 1 64 GLY HA3 . . 3.560 2.533 2.270 2.665 . 0 0 "[ . 1 . 2]" 1
707 1 36 THR H 1 65 HIS H . . 4.110 4.053 3.883 4.111 0.001 16 0 "[ . 1 . 2]" 1
708 1 36 THR HA 1 36 THR MG . . 3.320 2.246 2.144 2.377 . 0 0 "[ . 1 . 2]" 1
709 1 36 THR HA 1 38 ASN H . . 4.490 4.140 3.636 4.455 . 0 0 "[ . 1 . 2]" 1
710 1 36 THR HA 1 39 ALA H . . 3.900 3.351 3.213 3.548 . 0 0 "[ . 1 . 2]" 1
711 1 36 THR HA 1 39 ALA MB . . 3.550 2.854 2.665 3.093 . 0 0 "[ . 1 . 2]" 1
712 1 36 THR HB 1 37 LEU H . . 5.010 4.236 4.083 4.446 . 0 0 "[ . 1 . 2]" 1
713 1 36 THR HB 1 39 ALA H . . 4.610 4.435 4.266 4.577 . 0 0 "[ . 1 . 2]" 1
714 1 36 THR HB 1 39 ALA MB . . 3.890 3.096 2.815 3.349 . 0 0 "[ . 1 . 2]" 1
715 1 36 THR HB 1 65 HIS HD2 . . 5.500 3.951 3.500 4.480 . 0 0 "[ . 1 . 2]" 1
716 1 36 THR HB 1 83 TYR QE . . 4.620 3.322 2.982 3.743 . 0 0 "[ . 1 . 2]" 1
717 1 36 THR MG 1 39 ALA H . . 5.050 4.965 4.820 5.037 . 0 0 "[ . 1 . 2]" 1
718 1 36 THR MG 1 64 GLY HA2 . . 5.230 4.438 4.021 4.778 . 0 0 "[ . 1 . 2]" 1
719 1 36 THR MG 1 64 GLY HA3 . . 4.620 3.617 3.219 4.058 . 0 0 "[ . 1 . 2]" 1
720 1 36 THR MG 1 65 HIS H . . 4.290 3.630 2.939 4.059 . 0 0 "[ . 1 . 2]" 1
721 1 36 THR MG 1 65 HIS HD2 . . 3.440 2.465 1.990 3.251 . 0 0 "[ . 1 . 2]" 1
722 1 36 THR MG 1 83 TYR QE . . 3.480 2.855 2.076 3.403 . 0 0 "[ . 1 . 2]" 1
723 1 37 LEU H 1 37 LEU HB2 . . 3.070 2.625 2.541 2.683 . 0 0 "[ . 1 . 2]" 1
724 1 37 LEU H 1 37 LEU HB3 . . 3.720 3.587 3.577 3.620 . 0 0 "[ . 1 . 2]" 1
725 1 37 LEU H 1 37 LEU MD1 . . 4.040 3.296 3.162 3.465 . 0 0 "[ . 1 . 2]" 1
726 1 37 LEU H 1 37 LEU MD2 . . 3.740 3.375 3.135 3.619 . 0 0 "[ . 1 . 2]" 1
727 1 37 LEU H 1 37 LEU HG . . 2.940 2.016 1.907 2.222 . 0 0 "[ . 1 . 2]" 1
728 1 37 LEU H 1 38 ASN H . . 3.550 2.834 2.372 3.102 . 0 0 "[ . 1 . 2]" 1
729 1 37 LEU H 1 39 ALA H . . 4.530 4.111 3.900 4.326 . 0 0 "[ . 1 . 2]" 1
730 1 37 LEU H 1 64 GLY HA2 . . 4.900 4.423 3.823 4.792 . 0 0 "[ . 1 . 2]" 1
731 1 37 LEU H 1 64 GLY HA3 . . 4.550 4.042 3.589 4.324 . 0 0 "[ . 1 . 2]" 1
732 1 37 LEU HA 1 37 LEU MD1 . . 4.070 3.949 3.920 3.972 . 0 0 "[ . 1 . 2]" 1
733 1 37 LEU HA 1 37 LEU MD2 . . 3.130 2.424 2.271 2.557 . 0 0 "[ . 1 . 2]" 1
734 1 37 LEU HA 1 37 LEU HG . . 3.660 3.008 2.906 3.166 . 0 0 "[ . 1 . 2]" 1
735 1 37 LEU HA 1 39 ALA H . . 4.310 4.101 3.766 4.304 . 0 0 "[ . 1 . 2]" 1
736 1 37 LEU HA 1 40 GLY H . . 3.840 3.543 3.341 3.731 . 0 0 "[ . 1 . 2]" 1
737 1 37 LEU HB2 1 37 LEU MD1 . . 3.290 2.113 1.989 2.297 . 0 0 "[ . 1 . 2]" 1
738 1 37 LEU HB2 1 37 LEU MD2 . . 3.430 3.155 3.124 3.186 . 0 0 "[ . 1 . 2]" 1
739 1 37 LEU HB2 1 38 ASN H . . 3.860 2.358 2.110 2.842 . 0 0 "[ . 1 . 2]" 1
740 1 37 LEU HB3 1 37 LEU MD1 . . 3.360 2.559 2.363 2.669 . 0 0 "[ . 1 . 2]" 1
741 1 37 LEU HB3 1 37 LEU MD2 . . 3.340 2.162 2.087 2.256 . 0 0 "[ . 1 . 2]" 1
742 1 37 LEU HB3 1 38 ASN H . . 4.040 3.542 3.268 3.951 . 0 0 "[ . 1 . 2]" 1
743 1 37 LEU MD1 1 38 ASN H . . 4.520 4.024 3.742 4.371 . 0 0 "[ . 1 . 2]" 1
744 1 37 LEU MD1 1 38 ASN QD . . 4.670 4.073 3.614 4.575 . 0 0 "[ . 1 . 2]" 1
745 1 37 LEU MD1 1 63 GLU HA . . 3.540 2.114 1.982 2.466 . 0 0 "[ . 1 . 2]" 1
746 1 37 LEU MD1 1 63 GLU HB2 . . 4.860 4.508 4.270 4.849 . 0 0 "[ . 1 . 2]" 1
747 1 37 LEU MD1 1 63 GLU QB . . 4.190 3.387 3.068 3.744 . 0 0 "[ . 1 . 2]" 1
748 1 37 LEU MD1 1 63 GLU HB3 . . 4.860 3.503 3.143 3.896 . 0 0 "[ . 1 . 2]" 1
749 1 37 LEU MD1 1 63 GLU QG . . 4.110 3.859 3.363 4.101 . 0 0 "[ . 1 . 2]" 1
750 1 37 LEU MD2 1 63 GLU HA . . 3.500 3.324 3.058 3.491 . 0 0 "[ . 1 . 2]" 1
751 1 37 LEU MD2 1 64 GLY H . . 4.320 3.993 3.603 4.297 . 0 0 "[ . 1 . 2]" 1
752 1 37 LEU MD2 1 64 GLY HA2 . . 5.420 3.387 3.016 3.696 . 0 0 "[ . 1 . 2]" 1
753 1 37 LEU HG 1 38 ASN H . . 4.280 4.154 4.034 4.244 . 0 0 "[ . 1 . 2]" 1
754 1 37 LEU HG 1 63 GLU HA . . 3.770 3.636 3.484 3.769 . 0 0 "[ . 1 . 2]" 1
755 1 37 LEU HG 1 64 GLY H . . 4.790 4.600 4.255 4.780 . 0 0 "[ . 1 . 2]" 1
756 1 38 ASN H 1 38 ASN HB2 . . 3.710 2.349 2.226 2.696 . 0 0 "[ . 1 . 2]" 1
757 1 38 ASN H 1 38 ASN QB . . 3.130 2.316 2.203 2.623 . 0 0 "[ . 1 . 2]" 1
758 1 38 ASN H 1 38 ASN HB3 . . 3.710 3.554 3.521 3.601 . 0 0 "[ . 1 . 2]" 1
759 1 38 ASN H 1 38 ASN HD21 . . 5.010 2.472 1.905 3.440 . 0 0 "[ . 1 . 2]" 1
760 1 38 ASN H 1 38 ASN QD . . 4.240 2.409 1.899 3.201 . 0 0 "[ . 1 . 2]" 1
761 1 38 ASN H 1 38 ASN HD22 . . 5.010 3.747 3.566 3.992 . 0 0 "[ . 1 . 2]" 1
762 1 38 ASN H 1 39 ALA H . . 3.060 2.790 2.517 2.977 . 0 0 "[ . 1 . 2]" 1
763 1 38 ASN H 1 39 ALA MB . . 4.550 4.364 4.153 4.519 . 0 0 "[ . 1 . 2]" 1
764 1 38 ASN H 1 40 GLY H . . 4.880 4.690 4.426 4.833 . 0 0 "[ . 1 . 2]" 1
765 1 38 ASN QB 1 38 ASN QD . . 3.000 2.455 2.065 2.707 . 0 0 "[ . 1 . 2]" 1
766 1 38 ASN QB 1 39 ALA H . . 4.030 2.757 2.580 3.018 . 0 0 "[ . 1 . 2]" 1
767 1 38 ASN QB 1 39 ALA HA . . 4.940 3.888 3.835 3.966 . 0 0 "[ . 1 . 2]" 1
768 1 38 ASN HB2 1 39 ALA H . . 4.660 2.880 2.627 3.198 . 0 0 "[ . 1 . 2]" 1
769 1 38 ASN HB3 1 39 ALA H . . 4.660 3.553 3.325 3.926 . 0 0 "[ . 1 . 2]" 1
770 1 39 ALA H 1 39 ALA MB . . 2.950 2.051 2.024 2.120 . 0 0 "[ . 1 . 2]" 1
771 1 39 ALA H 1 40 GLY H . . 3.220 2.810 2.694 2.948 . 0 0 "[ . 1 . 2]" 1
772 1 39 ALA H 1 40 GLY QA . . 5.040 4.525 4.432 4.613 . 0 0 "[ . 1 . 2]" 1
773 1 39 ALA MB 1 40 GLY H . . 3.600 2.344 2.262 2.520 . 0 0 "[ . 1 . 2]" 1
774 1 39 ALA MB 1 83 TYR QE . . 3.590 2.341 2.021 2.724 . 0 0 "[ . 1 . 2]" 1
775 1 40 GLY H 1 41 SER H . . 4.580 3.419 3.041 3.915 . 0 0 "[ . 1 . 2]" 1
776 1 41 SER H 1 41 SER QB . . 3.790 3.017 2.437 3.309 . 0 0 "[ . 1 . 2]" 1
777 1 41 SER H 1 42 GLY H . . 4.710 4.282 4.084 4.465 . 0 0 "[ . 1 . 2]" 1
778 1 41 SER HA 1 42 GLY H . . 2.810 2.270 2.166 2.436 . 0 0 "[ . 1 . 2]" 1
779 1 41 SER HA 1 42 GLY HA3 . . 5.100 4.338 4.321 4.353 . 0 0 "[ . 1 . 2]" 1
780 1 41 SER QB 1 42 GLY H . . 3.340 2.862 2.339 3.305 . 0 0 "[ . 1 . 2]" 1
781 1 42 GLY H 1 83 TYR QE . . 4.010 3.883 3.488 4.009 . 0 0 "[ . 1 . 2]" 1
782 1 42 GLY HA2 1 43 ALA H . . 3.130 2.567 2.345 2.997 . 0 0 "[ . 1 . 2]" 1
783 1 42 GLY HA2 1 43 ALA HA . . 4.910 4.355 4.305 4.482 . 0 0 "[ . 1 . 2]" 1
784 1 42 GLY HA2 1 43 ALA MB . . 4.420 4.028 3.924 4.099 . 0 0 "[ . 1 . 2]" 1
785 1 42 GLY HA2 1 83 TYR QE . . 5.500 4.504 4.043 5.014 . 0 0 "[ . 1 . 2]" 1
786 1 42 GLY HA3 1 43 ALA H . . 3.380 2.574 2.218 2.808 . 0 0 "[ . 1 . 2]" 1
787 1 42 GLY HA3 1 43 ALA MB . . 4.770 4.381 4.110 4.547 . 0 0 "[ . 1 . 2]" 1
788 1 42 GLY HA3 1 83 TYR QE . . 4.830 3.131 2.487 3.806 . 0 0 "[ . 1 . 2]" 1
789 1 42 GLY HA3 1 84 GLY H . . 4.400 3.943 3.474 4.304 . 0 0 "[ . 1 . 2]" 1
790 1 43 ALA H 1 43 ALA MB . . 3.060 2.200 2.107 2.412 . 0 0 "[ . 1 . 2]" 1
791 1 43 ALA H 1 44 LEU H . . 4.590 4.538 4.261 4.598 0.008 5 0 "[ . 1 . 2]" 1
792 1 43 ALA H 1 84 GLY H . . 3.890 3.185 2.875 3.417 . 0 0 "[ . 1 . 2]" 1
793 1 43 ALA H 1 84 GLY HA2 . . 3.810 3.624 3.434 3.773 . 0 0 "[ . 1 . 2]" 1
794 1 43 ALA HA 1 44 LEU H . . 2.690 2.300 2.143 2.464 . 0 0 "[ . 1 . 2]" 1
795 1 43 ALA HA 1 44 LEU HB2 . . 5.190 4.547 4.432 4.708 . 0 0 "[ . 1 . 2]" 1
796 1 43 ALA HA 1 44 LEU QB . . 4.370 3.958 3.900 4.092 . 0 0 "[ . 1 . 2]" 1
797 1 43 ALA HA 1 44 LEU HB3 . . 5.190 4.355 4.238 4.496 . 0 0 "[ . 1 . 2]" 1
798 1 43 ALA HA 1 83 TYR QE . . 4.620 4.245 3.792 4.622 0.002 15 0 "[ . 1 . 2]" 1
799 1 43 ALA MB 1 44 LEU H . . 3.370 2.735 2.285 3.370 . 0 0 "[ . 1 . 2]" 1
800 1 43 ALA MB 1 45 SER H . . 5.350 5.109 4.882 5.345 . 0 0 "[ . 1 . 2]" 1
801 1 43 ALA MB 1 84 GLY H . . 4.290 3.764 3.486 4.033 . 0 0 "[ . 1 . 2]" 1
802 1 43 ALA MB 1 84 GLY HA2 . . 4.540 4.237 3.928 4.541 0.001 12 0 "[ . 1 . 2]" 1
803 1 43 ALA MB 1 85 GLY H . . 5.500 4.931 4.507 5.220 . 0 0 "[ . 1 . 2]" 1
804 1 44 LEU H 1 44 LEU HB2 . . 3.430 3.219 2.809 3.406 . 0 0 "[ . 1 . 2]" 1
805 1 44 LEU H 1 44 LEU QB . . 2.930 2.448 2.249 2.576 . 0 0 "[ . 1 . 2]" 1
806 1 44 LEU H 1 44 LEU HB3 . . 3.430 2.539 2.362 2.666 . 0 0 "[ . 1 . 2]" 1
807 1 44 LEU H 1 44 LEU MD2 . . 4.410 4.316 4.111 4.410 . 0 0 "[ . 1 . 2]" 1
808 1 44 LEU H 1 44 LEU HG . . 4.420 4.307 4.205 4.410 . 0 0 "[ . 1 . 2]" 1
809 1 44 LEU H 1 83 TYR QE . . 4.730 4.357 3.770 4.726 . 0 0 "[ . 1 . 2]" 1
810 1 44 LEU HA 1 44 LEU MD1 . . 3.420 2.457 2.233 2.694 . 0 0 "[ . 1 . 2]" 1
811 1 44 LEU HA 1 44 LEU MD2 . . 4.590 3.980 3.947 4.007 . 0 0 "[ . 1 . 2]" 1
812 1 44 LEU HA 1 45 SER H . . 2.930 2.218 2.155 2.280 . 0 0 "[ . 1 . 2]" 1
813 1 44 LEU HA 1 83 TYR HA . . 3.840 2.709 2.459 2.890 . 0 0 "[ . 1 . 2]" 1
814 1 44 LEU HA 1 83 TYR QD . . 3.680 2.498 2.217 2.866 . 0 0 "[ . 1 . 2]" 1
815 1 44 LEU HA 1 84 GLY H . . 4.450 4.208 3.792 4.431 . 0 0 "[ . 1 . 2]" 1
816 1 44 LEU QB 1 45 SER H . . 3.900 3.576 3.466 3.730 . 0 0 "[ . 1 . 2]" 1
817 1 44 LEU QB 1 83 TYR QD . . 3.740 2.099 2.000 2.278 . 0 0 "[ . 1 . 2]" 1
818 1 44 LEU QB 1 83 TYR QE . . 3.860 2.672 2.218 3.056 . 0 0 "[ . 1 . 2]" 1
819 1 44 LEU HB2 1 44 LEU MD2 . . 3.490 2.547 2.453 2.683 . 0 0 "[ . 1 . 2]" 1
820 1 44 LEU HB2 1 45 SER H . . 4.500 3.939 3.790 4.125 . 0 0 "[ . 1 . 2]" 1
821 1 44 LEU HB2 1 83 TYR QD . . 4.460 2.110 2.009 2.294 . 0 0 "[ . 1 . 2]" 1
822 1 44 LEU HB2 1 83 TYR QE . . 4.670 2.717 2.246 3.115 . 0 0 "[ . 1 . 2]" 1
823 1 44 LEU HB3 1 44 LEU MD2 . . 3.490 2.137 2.008 2.284 . 0 0 "[ . 1 . 2]" 1
824 1 44 LEU HB3 1 45 SER H . . 4.500 4.102 3.911 4.254 . 0 0 "[ . 1 . 2]" 1
825 1 44 LEU HB3 1 83 TYR QD . . 4.460 3.784 3.664 3.939 . 0 0 "[ . 1 . 2]" 1
826 1 44 LEU HB3 1 83 TYR QE . . 4.670 3.958 3.424 4.431 . 0 0 "[ . 1 . 2]" 1
827 1 44 LEU MD1 1 45 SER H . . 3.260 2.327 2.090 2.552 . 0 0 "[ . 1 . 2]" 1
828 1 44 LEU MD1 1 45 SER QB . . 4.290 4.173 3.903 4.277 . 0 0 "[ . 1 . 2]" 1
829 1 44 LEU MD1 1 82 LYS H . . 3.570 2.969 2.629 3.454 . 0 0 "[ . 1 . 2]" 1
830 1 44 LEU MD1 1 83 TYR HA . . 4.210 3.618 2.999 3.863 . 0 0 "[ . 1 . 2]" 1
831 1 44 LEU MD1 1 83 TYR HB2 . . 4.530 2.831 2.222 3.080 . 0 0 "[ . 1 . 2]" 1
832 1 44 LEU MD1 1 83 TYR QB . . 3.770 2.795 2.207 3.032 . 0 0 "[ . 1 . 2]" 1
833 1 44 LEU MD1 1 83 TYR HB3 . . 4.530 4.332 3.756 4.527 . 0 0 "[ . 1 . 2]" 1
834 1 44 LEU MD1 1 83 TYR QD . . 3.300 2.189 2.001 2.447 . 0 0 "[ . 1 . 2]" 1
835 1 44 LEU MD2 1 45 SER H . . 4.570 4.192 3.937 4.509 . 0 0 "[ . 1 . 2]" 1
836 1 44 LEU MD2 1 46 VAL MG2 . . 3.070 2.262 1.998 2.551 . 0 0 "[ . 1 . 2]" 1
837 1 44 LEU MD2 1 65 HIS HB2 . . 4.030 2.065 1.902 2.408 . 0 0 "[ . 1 . 2]" 1
838 1 44 LEU MD2 1 65 HIS QB . . 3.520 1.911 1.781 2.200 . 0 0 "[ . 1 . 2]" 1
839 1 44 LEU MD2 1 65 HIS HB3 . . 4.030 2.269 2.067 2.563 . 0 0 "[ . 1 . 2]" 1
840 1 44 LEU MD2 1 65 HIS HD2 . . 4.240 3.062 2.139 4.006 . 0 0 "[ . 1 . 2]" 1
841 1 44 LEU HG 1 45 SER H . . 3.650 2.655 2.296 3.093 . 0 0 "[ . 1 . 2]" 1
842 1 44 LEU HG 1 46 VAL H . . 4.530 3.983 3.435 4.386 . 0 0 "[ . 1 . 2]" 1
843 1 44 LEU HG 1 46 VAL MG2 . . 3.300 2.352 2.159 2.649 . 0 0 "[ . 1 . 2]" 1
844 1 44 LEU HG 1 81 ILE MG . . 4.420 3.805 3.165 4.361 . 0 0 "[ . 1 . 2]" 1
845 1 44 LEU HG 1 82 LYS H . . 4.710 4.446 4.104 4.654 . 0 0 "[ . 1 . 2]" 1
846 1 45 SER H 1 45 SER QB . . 3.230 2.527 2.381 2.634 . 0 0 "[ . 1 . 2]" 1
847 1 45 SER H 1 46 VAL H . . 4.390 4.249 4.012 4.390 . 0 0 "[ . 1 . 2]" 1
848 1 45 SER H 1 82 LYS HB2 . . 4.650 3.368 3.162 3.648 . 0 0 "[ . 1 . 2]" 1
849 1 45 SER H 1 82 LYS HB3 . . 4.870 4.683 4.460 4.828 . 0 0 "[ . 1 . 2]" 1
850 1 45 SER H 1 83 TYR HA . . 4.190 3.906 3.553 4.186 . 0 0 "[ . 1 . 2]" 1
851 1 45 SER H 1 83 TYR QD . . 4.410 4.241 3.876 4.402 . 0 0 "[ . 1 . 2]" 1
852 1 45 SER HA 1 46 VAL H . . 2.720 2.150 2.139 2.165 . 0 0 "[ . 1 . 2]" 1
853 1 45 SER HA 1 46 VAL HB . . 4.760 4.647 4.574 4.754 . 0 0 "[ . 1 . 2]" 1
854 1 45 SER HA 1 46 VAL MG2 . . 4.220 3.671 3.396 3.882 . 0 0 "[ . 1 . 2]" 1
855 1 45 SER QB 1 46 VAL H . . 3.750 3.645 3.202 3.753 0.003 15 0 "[ . 1 . 2]" 1
856 1 45 SER QB 1 82 LYS H . . 3.540 2.923 2.539 3.239 . 0 0 "[ . 1 . 2]" 1
857 1 45 SER QB 1 82 LYS HB2 . . 3.770 2.121 1.940 2.239 . 0 0 "[ . 1 . 2]" 1
858 1 45 SER QB 1 82 LYS HB3 . . 3.770 3.699 3.467 3.773 0.003 15 0 "[ . 1 . 2]" 1
859 1 45 SER QB 1 82 LYS QD . . 3.950 3.548 3.214 3.860 . 0 0 "[ . 1 . 2]" 1
860 1 46 VAL H 1 46 VAL HB . . 3.340 2.696 2.536 2.830 . 0 0 "[ . 1 . 2]" 1
861 1 46 VAL H 1 46 VAL MG1 . . 3.950 3.874 3.800 3.931 . 0 0 "[ . 1 . 2]" 1
862 1 46 VAL H 1 46 VAL MG2 . . 3.500 2.782 2.499 2.984 . 0 0 "[ . 1 . 2]" 1
863 1 46 VAL H 1 47 THR H . . 4.540 4.390 4.170 4.482 . 0 0 "[ . 1 . 2]" 1
864 1 46 VAL H 1 47 THR MG . . 4.740 3.881 3.485 4.504 . 0 0 "[ . 1 . 2]" 1
865 1 46 VAL H 1 67 VAL MG2 . . 5.210 5.102 4.748 5.210 . 0 0 "[ . 1 . 2]" 1
866 1 46 VAL HA 1 46 VAL MG1 . . 3.390 2.339 2.239 2.442 . 0 0 "[ . 1 . 2]" 1
867 1 46 VAL HA 1 46 VAL MG2 . . 3.450 2.391 2.286 2.510 . 0 0 "[ . 1 . 2]" 1
868 1 46 VAL HA 1 47 THR H . . 2.730 2.188 2.140 2.243 . 0 0 "[ . 1 . 2]" 1
869 1 46 VAL HA 1 81 ILE HA . . 4.060 2.946 2.771 3.073 . 0 0 "[ . 1 . 2]" 1
870 1 46 VAL HA 1 81 ILE MG . . 4.530 4.107 3.698 4.478 . 0 0 "[ . 1 . 2]" 1
871 1 46 VAL HA 1 82 LYS H . . 4.230 4.136 3.972 4.217 . 0 0 "[ . 1 . 2]" 1
872 1 46 VAL HB 1 47 THR H . . 4.380 4.036 3.814 4.306 . 0 0 "[ . 1 . 2]" 1
873 1 46 VAL HB 1 56 LEU QD . . 3.500 3.342 2.919 3.500 0.000 9 0 "[ . 1 . 2]" 1
874 1 46 VAL HB 1 67 VAL MG1 . . 4.680 3.755 3.516 4.158 . 0 0 "[ . 1 . 2]" 1
875 1 46 VAL HB 1 67 VAL MG2 . . 4.410 2.973 2.516 3.211 . 0 0 "[ . 1 . 2]" 1
876 1 46 VAL MG1 1 47 THR H . . 3.240 2.272 1.937 2.838 . 0 0 "[ . 1 . 2]" 1
877 1 46 VAL MG1 1 47 THR HA . . 4.820 3.388 3.205 3.601 . 0 0 "[ . 1 . 2]" 1
878 1 46 VAL MG1 1 48 ILE HG13 . . 3.660 3.391 3.139 3.678 0.018 5 0 "[ . 1 . 2]" 1
879 1 46 VAL MG1 1 67 VAL HB . . 4.070 3.204 2.927 3.643 . 0 0 "[ . 1 . 2]" 1
880 1 46 VAL MG1 1 67 VAL MG1 . . 3.350 2.622 2.254 2.928 . 0 0 "[ . 1 . 2]" 1
881 1 46 VAL MG1 1 67 VAL MG2 . . 3.580 2.406 2.013 2.701 . 0 0 "[ . 1 . 2]" 1
882 1 46 VAL MG1 1 79 ILE MG . . 3.090 2.768 2.377 3.073 . 0 0 "[ . 1 . 2]" 1
883 1 46 VAL MG1 1 81 ILE HG13 . . 4.150 3.821 3.101 4.112 . 0 0 "[ . 1 . 2]" 1
884 1 46 VAL MG2 1 67 VAL MG2 . . 3.070 2.362 2.028 2.648 . 0 0 "[ . 1 . 2]" 1
885 1 47 THR H 1 47 THR HB . . 4.060 3.815 3.548 3.947 . 0 0 "[ . 1 . 2]" 1
886 1 47 THR H 1 47 THR MG . . 3.840 3.081 2.152 3.620 . 0 0 "[ . 1 . 2]" 1
887 1 47 THR H 1 48 ILE H . . 4.440 4.345 4.194 4.429 . 0 0 "[ . 1 . 2]" 1
888 1 47 THR H 1 48 ILE HG13 . . 5.170 4.166 3.940 4.494 . 0 0 "[ . 1 . 2]" 1
889 1 47 THR H 1 56 LEU QD . . 4.490 4.393 4.131 4.490 . 0 0 "[ . 1 . 2]" 1
890 1 47 THR H 1 79 ILE HA . . 4.780 4.168 3.952 4.393 . 0 0 "[ . 1 . 2]" 1
891 1 47 THR H 1 79 ILE MG . . 4.210 3.429 3.073 3.937 . 0 0 "[ . 1 . 2]" 1
892 1 47 THR H 1 80 ALA H . . 3.660 3.111 2.775 3.461 . 0 0 "[ . 1 . 2]" 1
893 1 47 THR H 1 80 ALA MB . . 3.810 3.434 2.873 3.775 . 0 0 "[ . 1 . 2]" 1
894 1 47 THR H 1 81 ILE HA . . 4.490 4.277 4.039 4.493 0.003 15 0 "[ . 1 . 2]" 1
895 1 47 THR HA 1 47 THR MG . . 3.210 2.437 2.014 3.165 . 0 0 "[ . 1 . 2]" 1
896 1 47 THR HA 1 48 ILE H . . 2.710 2.323 2.187 2.468 . 0 0 "[ . 1 . 2]" 1
897 1 47 THR HA 1 48 ILE HB . . 4.920 4.564 4.369 4.698 . 0 0 "[ . 1 . 2]" 1
898 1 47 THR HA 1 48 ILE HG13 . . 5.110 3.485 3.294 3.738 . 0 0 "[ . 1 . 2]" 1
899 1 47 THR HA 1 56 LEU QD . . 3.980 2.903 2.387 3.323 . 0 0 "[ . 1 . 2]" 1
900 1 47 THR HB 1 48 ILE H . . 3.400 2.928 2.389 3.479 0.079 15 0 "[ . 1 . 2]" 1
901 1 47 THR HB 1 80 ALA H . . 5.060 4.626 4.314 5.063 0.003 15 0 "[ . 1 . 2]" 1
902 1 47 THR HB 1 80 ALA MB . . 4.050 3.914 3.577 4.100 0.050 19 0 "[ . 1 . 2]" 1
903 1 47 THR MG 1 48 ILE H . . 3.660 3.597 3.274 3.682 0.022 13 0 "[ . 1 . 2]" 1
904 1 48 ILE H 1 48 ILE HB . . 3.370 2.735 2.653 2.795 . 0 0 "[ . 1 . 2]" 1
905 1 48 ILE H 1 48 ILE MD . . 4.700 4.022 3.790 4.335 . 0 0 "[ . 1 . 2]" 1
906 1 48 ILE H 1 48 ILE HG12 . . 4.650 4.120 3.650 4.382 . 0 0 "[ . 1 . 2]" 1
907 1 48 ILE H 1 48 ILE HG13 . . 3.920 2.939 2.670 3.328 . 0 0 "[ . 1 . 2]" 1
908 1 48 ILE H 1 48 ILE MG . . 4.080 3.878 3.787 3.913 . 0 0 "[ . 1 . 2]" 1
909 1 48 ILE H 1 49 ASP H . . 4.490 4.406 4.313 4.456 . 0 0 "[ . 1 . 2]" 1
910 1 48 ILE H 1 54 VAL MG2 . . 4.920 4.310 3.959 4.656 . 0 0 "[ . 1 . 2]" 1
911 1 48 ILE H 1 56 LEU QD . . 3.920 3.374 2.977 3.837 . 0 0 "[ . 1 . 2]" 1
912 1 48 ILE HA 1 48 ILE MD . . 4.300 3.860 3.767 3.926 . 0 0 "[ . 1 . 2]" 1
913 1 48 ILE HA 1 48 ILE HG12 . . 4.100 2.621 2.409 2.761 . 0 0 "[ . 1 . 2]" 1
914 1 48 ILE HA 1 48 ILE HG13 . . 4.240 2.924 2.711 3.239 . 0 0 "[ . 1 . 2]" 1
915 1 48 ILE HA 1 48 ILE MG . . 3.400 2.355 2.282 2.473 . 0 0 "[ . 1 . 2]" 1
916 1 48 ILE HA 1 49 ASP H . . 2.900 2.235 2.165 2.318 . 0 0 "[ . 1 . 2]" 1
917 1 48 ILE HA 1 49 ASP HA . . 4.740 4.440 4.405 4.488 . 0 0 "[ . 1 . 2]" 1
918 1 48 ILE HA 1 49 ASP HB2 . . 4.640 4.137 4.063 4.203 . 0 0 "[ . 1 . 2]" 1
919 1 48 ILE HA 1 49 ASP HB3 . . 5.210 4.885 4.810 4.940 . 0 0 "[ . 1 . 2]" 1
920 1 48 ILE HA 1 79 ILE HA . . 4.530 2.626 2.395 2.789 . 0 0 "[ . 1 . 2]" 1
921 1 48 ILE HA 1 79 ILE HG13 . . 5.070 4.044 3.577 4.381 . 0 0 "[ . 1 . 2]" 1
922 1 48 ILE HA 1 80 ALA H . . 3.890 3.586 3.336 3.847 . 0 0 "[ . 1 . 2]" 1
923 1 48 ILE HB 1 48 ILE MD . . 3.370 2.355 2.240 2.539 . 0 0 "[ . 1 . 2]" 1
924 1 48 ILE HB 1 49 ASP H . . 4.240 3.924 3.701 4.167 . 0 0 "[ . 1 . 2]" 1
925 1 48 ILE HB 1 49 ASP HA . . 5.000 4.630 4.509 4.897 . 0 0 "[ . 1 . 2]" 1
926 1 48 ILE HB 1 54 VAL H . . 4.920 4.475 4.037 4.779 . 0 0 "[ . 1 . 2]" 1
927 1 48 ILE HB 1 54 VAL HB . . 5.380 4.885 4.327 5.364 . 0 0 "[ . 1 . 2]" 1
928 1 48 ILE HB 1 54 VAL MG2 . . 3.360 2.257 1.904 2.510 . 0 0 "[ . 1 . 2]" 1
929 1 48 ILE HB 1 56 LEU QD . . 4.130 3.436 3.057 3.971 . 0 0 "[ . 1 . 2]" 1
930 1 48 ILE HB 1 77 TYR HB3 . . 5.500 4.701 4.490 4.858 . 0 0 "[ . 1 . 2]" 1
931 1 48 ILE MD 1 48 ILE MG . . 2.840 2.044 1.915 2.328 . 0 0 "[ . 1 . 2]" 1
932 1 48 ILE MD 1 54 VAL HB . . 4.810 3.519 2.882 3.795 . 0 0 "[ . 1 . 2]" 1
933 1 48 ILE MD 1 54 VAL MG1 . . 3.830 3.562 3.167 3.827 . 0 0 "[ . 1 . 2]" 1
934 1 48 ILE MD 1 54 VAL MG2 . . 3.370 1.903 1.728 2.156 . 0 0 "[ . 1 . 2]" 1
935 1 48 ILE MD 1 56 LEU QB . . 4.350 2.316 1.990 2.936 . 0 0 "[ . 1 . 2]" 1
936 1 48 ILE MD 1 56 LEU QD . . 3.220 2.523 2.087 3.206 . 0 0 "[ . 1 . 2]" 1
937 1 48 ILE MD 1 69 TYR HB2 . . 4.120 2.899 2.385 3.287 . 0 0 "[ . 1 . 2]" 1
938 1 48 ILE MD 1 69 TYR HB3 . . 3.940 2.644 2.215 3.057 . 0 0 "[ . 1 . 2]" 1
939 1 48 ILE MD 1 69 TYR QD . . 3.810 2.577 2.208 3.131 . 0 0 "[ . 1 . 2]" 1
940 1 48 ILE MD 1 69 TYR QE . . 4.390 3.407 3.006 3.886 . 0 0 "[ . 1 . 2]" 1
941 1 48 ILE MD 1 77 TYR HB3 . . 4.770 4.120 3.696 4.316 . 0 0 "[ . 1 . 2]" 1
942 1 48 ILE MD 1 77 TYR QD . . 4.810 4.365 4.086 4.573 . 0 0 "[ . 1 . 2]" 1
943 1 48 ILE MD 1 79 ILE MD . . 3.780 3.600 3.332 3.783 0.003 15 0 "[ . 1 . 2]" 1
944 1 48 ILE MD 1 79 ILE HG12 . . 4.330 3.208 2.664 3.449 . 0 0 "[ . 1 . 2]" 1
945 1 48 ILE MD 1 79 ILE HG13 . . 4.520 4.334 3.788 4.526 0.006 16 0 "[ . 1 . 2]" 1
946 1 48 ILE HG12 1 48 ILE MG . . 3.710 2.312 2.146 2.464 . 0 0 "[ . 1 . 2]" 1
947 1 48 ILE HG12 1 49 ASP H . . 4.760 4.246 3.934 4.441 . 0 0 "[ . 1 . 2]" 1
948 1 48 ILE HG12 1 79 ILE HA . . 4.400 3.179 2.774 3.516 . 0 0 "[ . 1 . 2]" 1
949 1 48 ILE HG12 1 79 ILE HG12 . . 3.920 2.103 2.001 2.344 . 0 0 "[ . 1 . 2]" 1
950 1 48 ILE HG12 1 79 ILE HG13 . . 4.260 3.334 2.844 3.583 . 0 0 "[ . 1 . 2]" 1
951 1 48 ILE HG13 1 48 ILE MG . . 3.700 3.187 3.161 3.199 . 0 0 "[ . 1 . 2]" 1
952 1 48 ILE HG13 1 49 ASP H . . 5.130 4.882 4.698 5.118 . 0 0 "[ . 1 . 2]" 1
953 1 48 ILE HG13 1 79 ILE HA . . 4.710 3.980 3.672 4.500 . 0 0 "[ . 1 . 2]" 1
954 1 48 ILE HG13 1 79 ILE HG12 . . 4.120 3.589 3.181 4.024 . 0 0 "[ . 1 . 2]" 1
955 1 48 ILE HG13 1 79 ILE MG . . 4.540 3.791 3.453 4.123 . 0 0 "[ . 1 . 2]" 1
956 1 48 ILE MG 1 49 ASP H . . 3.510 2.070 1.870 2.411 . 0 0 "[ . 1 . 2]" 1
957 1 48 ILE MG 1 49 ASP HA . . 4.640 3.438 3.133 3.621 . 0 0 "[ . 1 . 2]" 1
958 1 48 ILE MG 1 53 LYS HA . . 5.450 5.080 4.356 5.447 . 0 0 "[ . 1 . 2]" 1
959 1 48 ILE MG 1 54 VAL H . . 4.820 4.275 3.444 4.744 . 0 0 "[ . 1 . 2]" 1
960 1 48 ILE MG 1 54 VAL HB . . 4.370 4.052 3.754 4.300 . 0 0 "[ . 1 . 2]" 1
961 1 48 ILE MG 1 54 VAL MG2 . . 2.980 1.934 1.807 2.091 . 0 0 "[ . 1 . 2]" 1
962 1 48 ILE MG 1 69 TYR QD . . 4.680 4.321 3.996 4.627 . 0 0 "[ . 1 . 2]" 1
963 1 48 ILE MG 1 77 TYR H . . 5.050 4.921 4.747 5.040 . 0 0 "[ . 1 . 2]" 1
964 1 48 ILE MG 1 77 TYR HB2 . . 3.900 3.231 3.035 3.460 . 0 0 "[ . 1 . 2]" 1
965 1 48 ILE MG 1 77 TYR HB3 . . 3.640 1.945 1.809 2.091 . 0 0 "[ . 1 . 2]" 1
966 1 48 ILE MG 1 77 TYR QD . . 3.290 2.103 1.914 2.293 . 0 0 "[ . 1 . 2]" 1
967 1 48 ILE MG 1 77 TYR QE . . 3.950 3.756 3.468 3.921 . 0 0 "[ . 1 . 2]" 1
968 1 48 ILE MG 1 78 LEU H . . 4.150 3.639 3.408 3.933 . 0 0 "[ . 1 . 2]" 1
969 1 49 ASP H 1 49 ASP HB2 . . 3.510 2.964 2.817 3.129 . 0 0 "[ . 1 . 2]" 1
970 1 49 ASP H 1 49 ASP HB3 . . 3.810 3.054 2.960 3.145 . 0 0 "[ . 1 . 2]" 1
971 1 49 ASP H 1 50 GLY H . . 4.550 4.041 3.885 4.235 . 0 0 "[ . 1 . 2]" 1
972 1 49 ASP H 1 78 LEU H . . 3.680 2.794 2.557 3.061 . 0 0 "[ . 1 . 2]" 1
973 1 49 ASP H 1 78 LEU HA . . 4.750 4.514 4.390 4.656 . 0 0 "[ . 1 . 2]" 1
974 1 49 ASP H 1 78 LEU HB2 . . 4.480 4.341 4.125 4.481 0.001 16 0 "[ . 1 . 2]" 1
975 1 49 ASP H 1 78 LEU HB3 . . 4.480 3.344 3.129 3.566 . 0 0 "[ . 1 . 2]" 1
976 1 49 ASP H 1 78 LEU MD1 . . 5.170 4.413 4.156 4.790 . 0 0 "[ . 1 . 2]" 1
977 1 49 ASP H 1 79 ILE HA . . 4.280 4.055 3.755 4.251 . 0 0 "[ . 1 . 2]" 1
978 1 49 ASP HA 1 50 GLY H . . 2.760 2.153 2.143 2.191 . 0 0 "[ . 1 . 2]" 1
979 1 49 ASP HA 1 50 GLY QA . . 4.910 3.919 3.907 3.942 . 0 0 "[ . 1 . 2]" 1
980 1 49 ASP HA 1 78 LEU H . . 4.740 4.583 4.424 4.727 . 0 0 "[ . 1 . 2]" 1
981 1 49 ASP HB2 1 50 GLY H . . 4.660 4.531 4.447 4.615 . 0 0 "[ . 1 . 2]" 1
982 1 49 ASP HB2 1 78 LEU H . . 4.510 4.324 4.062 4.486 . 0 0 "[ . 1 . 2]" 1
983 1 49 ASP HB2 1 78 LEU HB2 . . 4.640 4.544 4.295 4.640 . 3 0 "[ . 1 . 2]" 1
984 1 49 ASP HB2 1 78 LEU QB . . 3.900 3.155 2.816 3.406 . 0 0 "[ . 1 . 2]" 1
985 1 49 ASP HB2 1 78 LEU HB3 . . 4.640 3.220 2.852 3.506 . 0 0 "[ . 1 . 2]" 1
986 1 49 ASP HB2 1 78 LEU MD1 . . 4.860 4.417 3.801 4.860 0.000 8 0 "[ . 1 . 2]" 1
987 1 49 ASP HB3 1 50 GLY H . . 4.240 4.142 4.030 4.252 0.012 5 0 "[ . 1 . 2]" 1
988 1 49 ASP HB3 1 78 LEU H . . 4.560 3.138 2.766 3.321 . 0 0 "[ . 1 . 2]" 1
989 1 49 ASP HB3 1 78 LEU HB2 . . 4.270 3.251 2.959 3.454 . 0 0 "[ . 1 . 2]" 1
990 1 49 ASP HB3 1 78 LEU QB . . 3.750 2.451 2.093 2.806 . 0 0 "[ . 1 . 2]" 1
991 1 49 ASP HB3 1 78 LEU HB3 . . 4.270 2.541 2.133 2.970 . 0 0 "[ . 1 . 2]" 1
992 1 49 ASP HB3 1 78 LEU MD1 . . 4.850 4.391 3.935 4.782 . 0 0 "[ . 1 . 2]" 1
993 1 49 ASP HB3 1 78 LEU MD2 . . 5.500 4.941 4.672 5.218 . 0 0 "[ . 1 . 2]" 1
994 1 50 GLY H 1 51 PRO HD2 . . 4.590 4.508 4.395 4.587 . 0 0 "[ . 1 . 2]" 1
995 1 50 GLY H 1 51 PRO HD3 . . 5.290 5.077 5.056 5.094 . 0 0 "[ . 1 . 2]" 1
996 1 50 GLY H 1 52 SER H . . 4.200 3.970 3.762 4.198 . 0 0 "[ . 1 . 2]" 1
997 1 50 GLY H 1 77 TYR HA . . 4.870 4.390 4.105 4.609 . 0 0 "[ . 1 . 2]" 1
998 1 50 GLY H 1 77 TYR QD . . 4.740 3.363 3.173 3.507 . 0 0 "[ . 1 . 2]" 1
999 1 50 GLY H 1 77 TYR QE . . 5.270 4.017 3.693 4.146 . 0 0 "[ . 1 . 2]" 1
1000 1 50 GLY H 1 78 LEU H . . 5.220 4.816 4.606 4.938 . 0 0 "[ . 1 . 2]" 1
1001 1 50 GLY QA 1 51 PRO HD2 . . 3.170 2.065 2.007 2.118 . 0 0 "[ . 1 . 2]" 1
1002 1 50 GLY QA 1 51 PRO HG2 . . 4.450 4.013 3.998 4.027 . 0 0 "[ . 1 . 2]" 1
1003 1 50 GLY QA 1 51 PRO HG3 . . 4.330 4.271 4.260 4.277 . 0 0 "[ . 1 . 2]" 1
1004 1 50 GLY QA 1 52 SER H . . 3.790 3.036 2.959 3.111 . 0 0 "[ . 1 . 2]" 1
1005 1 50 GLY QA 1 77 TYR QD . . 4.040 2.444 2.268 2.609 . 0 0 "[ . 1 . 2]" 1
1006 1 50 GLY QA 1 77 TYR QE . . 4.210 2.808 2.598 3.101 . 0 0 "[ . 1 . 2]" 1
1007 1 50 GLY HA2 1 51 PRO HD2 . . 3.660 2.975 2.878 3.082 . 0 0 "[ . 1 . 2]" 1
1008 1 50 GLY HA2 1 51 PRO HD3 . . 3.510 2.688 2.601 2.791 . 0 0 "[ . 1 . 2]" 1
1009 1 50 GLY HA2 1 51 PRO HG2 . . 5.140 4.998 4.913 5.093 . 0 0 "[ . 1 . 2]" 1
1010 1 50 GLY HA2 1 51 PRO HG3 . . 5.100 4.916 4.828 5.019 . 0 0 "[ . 1 . 2]" 1
1011 1 50 GLY HA2 1 52 SER H . . 4.330 4.221 4.101 4.331 0.001 9 0 "[ . 1 . 2]" 1
1012 1 50 GLY HA2 1 77 TYR HA . . 4.150 2.816 2.625 3.045 . 0 0 "[ . 1 . 2]" 1
1013 1 50 GLY HA2 1 77 TYR QD . . 4.720 3.767 3.632 3.919 . 0 0 "[ . 1 . 2]" 1
1014 1 50 GLY HA2 1 77 TYR QE . . 4.940 4.472 4.288 4.776 . 0 0 "[ . 1 . 2]" 1
1015 1 50 GLY HA2 1 78 LEU H . . 4.640 3.792 3.549 3.969 . 0 0 "[ . 1 . 2]" 1
1016 1 50 GLY HA3 1 51 PRO HD2 . . 3.660 2.107 2.033 2.180 . 0 0 "[ . 1 . 2]" 1
1017 1 50 GLY HA3 1 51 PRO HD3 . . 3.510 2.950 2.842 3.047 . 0 0 "[ . 1 . 2]" 1
1018 1 50 GLY HA3 1 51 PRO HG2 . . 5.140 4.228 4.179 4.278 . 0 0 "[ . 1 . 2]" 1
1019 1 50 GLY HA3 1 51 PRO HG3 . . 5.100 4.693 4.606 4.774 . 0 0 "[ . 1 . 2]" 1
1020 1 50 GLY HA3 1 52 SER H . . 4.330 3.112 3.035 3.189 . 0 0 "[ . 1 . 2]" 1
1021 1 50 GLY HA3 1 77 TYR HA . . 4.150 3.010 2.762 3.174 . 0 0 "[ . 1 . 2]" 1
1022 1 50 GLY HA3 1 77 TYR QD . . 4.720 2.476 2.289 2.651 . 0 0 "[ . 1 . 2]" 1
1023 1 50 GLY HA3 1 77 TYR QE . . 4.940 2.838 2.620 3.142 . 0 0 "[ . 1 . 2]" 1
1024 1 50 GLY HA3 1 78 LEU H . . 4.640 4.516 4.295 4.638 . 0 0 "[ . 1 . 2]" 1
1025 1 51 PRO HA 1 73 ALA MB . . 5.500 5.204 4.922 5.334 . 0 0 "[ . 1 . 2]" 1
1026 1 51 PRO HB2 1 52 SER H . . 3.890 3.728 3.613 3.876 . 0 0 "[ . 1 . 2]" 1
1027 1 51 PRO HB2 1 73 ALA MB . . 3.660 3.179 2.892 3.296 . 0 0 "[ . 1 . 2]" 1
1028 1 51 PRO HB3 1 52 SER H . . 4.600 4.369 4.304 4.453 . 0 0 "[ . 1 . 2]" 1
1029 1 51 PRO HB3 1 73 ALA MB . . 4.430 4.358 4.089 4.433 0.003 19 0 "[ . 1 . 2]" 1
1030 1 51 PRO HD2 1 52 SER H . . 3.610 2.792 2.714 2.918 . 0 0 "[ . 1 . 2]" 1
1031 1 51 PRO HD2 1 76 ASN H . . 4.810 4.362 4.042 4.543 . 0 0 "[ . 1 . 2]" 1
1032 1 51 PRO HD2 1 77 TYR HA . . 4.810 4.204 3.982 4.357 . 0 0 "[ . 1 . 2]" 1
1033 1 51 PRO HD2 1 77 TYR QD . . 4.590 3.663 3.494 3.841 . 0 0 "[ . 1 . 2]" 1
1034 1 51 PRO HD2 1 77 TYR QE . . 4.100 3.036 2.844 3.227 . 0 0 "[ . 1 . 2]" 1
1035 1 51 PRO HD2 1 77 TYR HH . . 5.050 3.279 2.695 4.193 . 0 0 "[ . 1 . 2]" 1
1036 1 51 PRO HD3 1 52 SER H . . 4.290 3.919 3.878 3.985 . 0 0 "[ . 1 . 2]" 1
1037 1 51 PRO HD3 1 76 ASN H . . 4.430 3.222 2.748 3.481 . 0 0 "[ . 1 . 2]" 1
1038 1 51 PRO HD3 1 77 TYR HA . . 4.830 4.349 4.199 4.521 . 0 0 "[ . 1 . 2]" 1
1039 1 51 PRO HD3 1 77 TYR QD . . 5.090 4.593 4.350 4.767 . 0 0 "[ . 1 . 2]" 1
1040 1 51 PRO HD3 1 77 TYR QE . . 4.820 4.361 3.988 4.610 . 0 0 "[ . 1 . 2]" 1
1041 1 51 PRO HG2 1 52 SER H . . 3.840 2.933 2.751 3.181 . 0 0 "[ . 1 . 2]" 1
1042 1 51 PRO HG2 1 73 ALA MB . . 3.660 2.539 2.360 2.747 . 0 0 "[ . 1 . 2]" 1
1043 1 51 PRO HG2 1 75 GLY HA2 . . 5.500 5.366 5.129 5.504 0.004 15 0 "[ . 1 . 2]" 1
1044 1 51 PRO HG2 1 75 GLY HA3 . . 4.280 3.723 3.522 3.865 . 0 0 "[ . 1 . 2]" 1
1045 1 51 PRO HG2 1 76 ASN H . . 5.500 5.336 4.882 5.503 0.003 19 0 "[ . 1 . 2]" 1
1046 1 51 PRO HG2 1 77 TYR QE . . 4.560 3.844 3.555 4.057 . 0 0 "[ . 1 . 2]" 1
1047 1 51 PRO HG2 1 77 TYR HH . . 4.500 2.957 2.061 4.077 . 0 0 "[ . 1 . 2]" 1
1048 1 51 PRO HG3 1 73 ALA MB . . 3.670 3.447 3.210 3.558 . 0 0 "[ . 1 . 2]" 1
1049 1 51 PRO HG3 1 75 GLY HA2 . . 4.380 3.899 3.607 4.125 . 0 0 "[ . 1 . 2]" 1
1050 1 51 PRO HG3 1 75 GLY HA3 . . 3.970 2.312 2.100 2.547 . 0 0 "[ . 1 . 2]" 1
1051 1 51 PRO HG3 1 76 ASN H . . 4.310 3.935 3.447 4.138 . 0 0 "[ . 1 . 2]" 1
1052 1 51 PRO HG3 1 77 TYR QE . . 4.930 4.431 3.887 4.698 . 0 0 "[ . 1 . 2]" 1
1053 1 52 SER H 1 52 SER QB . . 3.380 2.875 2.617 3.285 . 0 0 "[ . 1 . 2]" 1
1054 1 52 SER H 1 53 LYS HA . . 4.950 4.745 4.580 4.891 . 0 0 "[ . 1 . 2]" 1
1055 1 52 SER H 1 73 ALA MB . . 4.370 4.083 3.872 4.370 . 0 0 "[ . 1 . 2]" 1
1056 1 52 SER H 1 77 TYR QD . . 4.720 4.519 4.232 4.719 . 0 0 "[ . 1 . 2]" 1
1057 1 52 SER H 1 77 TYR QE . . 3.240 2.898 2.625 3.114 . 0 0 "[ . 1 . 2]" 1
1058 1 52 SER H 1 77 TYR HH . . 4.540 3.613 2.728 4.535 . 0 0 "[ . 1 . 2]" 1
1059 1 52 SER QB 1 53 LYS H . . 4.160 3.347 2.858 3.853 . 0 0 "[ . 1 . 2]" 1
1060 1 52 SER QB 1 72 MET HB2 . . 4.720 2.403 1.935 4.028 . 0 0 "[ . 1 . 2]" 1
1061 1 52 SER QB 1 72 MET QB . . 3.860 2.325 1.905 3.486 . 0 0 "[ . 1 . 2]" 1
1062 1 52 SER QB 1 72 MET HB3 . . 4.720 3.316 2.673 4.021 . 0 0 "[ . 1 . 2]" 1
1063 1 52 SER QB 1 73 ALA H . . 3.970 3.559 2.798 3.963 . 0 0 "[ . 1 . 2]" 1
1064 1 52 SER QB 1 73 ALA MB . . 3.260 2.411 2.000 2.739 . 0 0 "[ . 1 . 2]" 1
1065 1 53 LYS H 1 53 LYS QB . . 3.920 2.271 2.119 2.436 . 0 0 "[ . 1 . 2]" 1
1066 1 53 LYS H 1 53 LYS HG2 . . 5.050 3.984 2.767 4.629 . 0 0 "[ . 1 . 2]" 1
1067 1 53 LYS H 1 53 LYS HG3 . . 5.050 3.547 2.207 4.465 . 0 0 "[ . 1 . 2]" 1
1068 1 53 LYS HA 1 53 LYS QD . . 4.250 3.564 2.152 4.332 0.082 11 0 "[ . 1 . 2]" 1
1069 1 53 LYS HA 1 53 LYS HG2 . . 4.230 3.092 2.274 3.980 . 0 0 "[ . 1 . 2]" 1
1070 1 53 LYS HA 1 53 LYS QG . . 3.710 2.471 2.167 3.435 . 0 0 "[ . 1 . 2]" 1
1071 1 53 LYS HA 1 53 LYS HG3 . . 4.230 2.778 2.188 4.225 . 0 0 "[ . 1 . 2]" 1
1072 1 53 LYS HA 1 54 VAL H . . 2.640 2.212 2.141 2.283 . 0 0 "[ . 1 . 2]" 1
1073 1 53 LYS HA 1 54 VAL MG2 . . 3.930 3.665 3.461 3.916 . 0 0 "[ . 1 . 2]" 1
1074 1 53 LYS QB 1 54 VAL H . . 3.840 3.219 2.756 3.753 . 0 0 "[ . 1 . 2]" 1
1075 1 53 LYS QG 1 54 VAL H . . 4.190 3.233 2.116 4.166 . 0 0 "[ . 1 . 2]" 1
1076 1 54 VAL H 1 54 VAL HB . . 3.900 3.777 3.685 3.853 . 0 0 "[ . 1 . 2]" 1
1077 1 54 VAL H 1 54 VAL MG1 . . 3.580 2.854 2.343 3.218 . 0 0 "[ . 1 . 2]" 1
1078 1 54 VAL H 1 54 VAL MG2 . . 3.210 2.023 1.909 2.173 . 0 0 "[ . 1 . 2]" 1
1079 1 54 VAL H 1 55 GLN H . . 5.020 4.383 4.118 4.554 . 0 0 "[ . 1 . 2]" 1
1080 1 54 VAL HA 1 54 VAL MG1 . . 3.370 2.345 2.216 2.487 . 0 0 "[ . 1 . 2]" 1
1081 1 54 VAL HA 1 54 VAL MG2 . . 3.560 3.194 3.168 3.202 . 0 0 "[ . 1 . 2]" 1
1082 1 54 VAL HA 1 55 GLN H . . 2.900 2.198 2.141 2.315 . 0 0 "[ . 1 . 2]" 1
1083 1 54 VAL HA 1 55 GLN HB2 . . 4.410 4.265 4.213 4.315 . 0 0 "[ . 1 . 2]" 1
1084 1 54 VAL HA 1 70 THR H . . 4.710 4.445 4.232 4.711 0.001 7 0 "[ . 1 . 2]" 1
1085 1 54 VAL HA 1 70 THR HB . . 5.500 5.197 4.900 5.453 . 0 0 "[ . 1 . 2]" 1
1086 1 54 VAL HA 1 72 MET QG . . 5.320 3.428 2.943 4.335 . 0 0 "[ . 1 . 2]" 1
1087 1 54 VAL HB 1 55 GLN H . . 4.140 3.072 2.602 3.555 . 0 0 "[ . 1 . 2]" 1
1088 1 54 VAL HB 1 69 TYR HA . . 5.450 4.630 4.441 4.760 . 0 0 "[ . 1 . 2]" 1
1089 1 54 VAL HB 1 69 TYR HB2 . . 4.200 2.763 2.525 2.940 . 0 0 "[ . 1 . 2]" 1
1090 1 54 VAL HB 1 69 TYR HB3 . . 4.650 4.412 4.115 4.642 . 0 0 "[ . 1 . 2]" 1
1091 1 54 VAL HB 1 69 TYR QD . . 4.120 2.943 2.538 3.317 . 0 0 "[ . 1 . 2]" 1
1092 1 54 VAL HB 1 69 TYR QE . . 5.240 4.717 4.295 5.058 . 0 0 "[ . 1 . 2]" 1
1093 1 54 VAL HB 1 70 THR H . . 3.780 3.180 2.649 3.474 . 0 0 "[ . 1 . 2]" 1
1094 1 54 VAL MG1 1 55 GLN H . . 4.110 3.868 3.626 4.099 . 0 0 "[ . 1 . 2]" 1
1095 1 54 VAL MG1 1 69 TYR HB2 . . 4.330 4.091 3.761 4.314 . 0 0 "[ . 1 . 2]" 1
1096 1 54 VAL MG1 1 69 TYR QD . . 3.490 3.274 2.934 3.467 . 0 0 "[ . 1 . 2]" 1
1097 1 54 VAL MG1 1 69 TYR QE . . 4.410 3.806 3.488 4.089 . 0 0 "[ . 1 . 2]" 1
1098 1 54 VAL MG1 1 70 THR H . . 4.400 4.255 3.784 4.400 . 0 0 "[ . 1 . 2]" 1
1099 1 54 VAL MG1 1 71 PRO HA . . 3.540 2.289 2.062 2.602 . 0 0 "[ . 1 . 2]" 1
1100 1 54 VAL MG1 1 72 MET H . . 4.150 2.971 2.531 3.386 . 0 0 "[ . 1 . 2]" 1
1101 1 54 VAL MG1 1 77 TYR HB2 . . 4.820 4.795 4.704 4.823 0.003 5 0 "[ . 1 . 2]" 1
1102 1 54 VAL MG1 1 77 TYR QD . . 4.200 2.764 2.396 3.066 . 0 0 "[ . 1 . 2]" 1
1103 1 54 VAL MG1 1 77 TYR QE . . 3.650 2.015 1.903 2.220 . 0 0 "[ . 1 . 2]" 1
1104 1 54 VAL MG2 1 55 GLN H . . 4.430 3.879 3.423 4.120 . 0 0 "[ . 1 . 2]" 1
1105 1 54 VAL MG2 1 56 LEU H . . 4.490 3.832 3.151 4.258 . 0 0 "[ . 1 . 2]" 1
1106 1 54 VAL MG2 1 56 LEU QB . . 3.820 3.082 2.811 3.527 . 0 0 "[ . 1 . 2]" 1
1107 1 54 VAL MG2 1 69 TYR HB2 . . 3.980 2.917 2.419 3.262 . 0 0 "[ . 1 . 2]" 1
1108 1 54 VAL MG2 1 69 TYR HB3 . . 4.070 3.791 3.408 4.066 . 0 0 "[ . 1 . 2]" 1
1109 1 54 VAL MG2 1 69 TYR QD . . 4.020 3.599 3.259 3.989 . 0 0 "[ . 1 . 2]" 1
1110 1 54 VAL MG2 1 77 TYR QD . . 4.250 3.164 2.498 3.560 . 0 0 "[ . 1 . 2]" 1
1111 1 54 VAL MG2 1 77 TYR QE . . 4.110 3.651 2.866 3.990 . 0 0 "[ . 1 . 2]" 1
1112 1 55 GLN H 1 55 GLN HB2 . . 4.040 2.432 2.225 2.653 . 0 0 "[ . 1 . 2]" 1
1113 1 55 GLN H 1 55 GLN HB3 . . 3.090 2.770 2.700 2.869 . 0 0 "[ . 1 . 2]" 1
1114 1 55 GLN H 1 55 GLN QG . . 4.130 4.002 3.871 4.118 . 0 0 "[ . 1 . 2]" 1
1115 1 55 GLN H 1 56 LEU H . . 4.550 4.224 3.985 4.435 . 0 0 "[ . 1 . 2]" 1
1116 1 55 GLN H 1 70 THR HB . . 4.820 4.036 3.749 4.525 . 0 0 "[ . 1 . 2]" 1
1117 1 55 GLN HA 1 55 GLN QG . . 3.690 2.380 2.183 2.839 . 0 0 "[ . 1 . 2]" 1
1118 1 55 GLN HA 1 56 LEU H . . 2.600 2.190 2.143 2.278 . 0 0 "[ . 1 . 2]" 1
1119 1 55 GLN HA 1 56 LEU QB . . 4.730 4.421 4.253 4.593 . 0 0 "[ . 1 . 2]" 1
1120 1 55 GLN HB2 1 56 LEU H . . 4.580 4.579 4.512 4.633 0.053 11 0 "[ . 1 . 2]" 1
1121 1 55 GLN HB2 1 70 THR HB . . 5.120 4.844 4.455 5.119 . 0 0 "[ . 1 . 2]" 1
1122 1 55 GLN HB3 1 56 LEU H . . 4.370 4.280 4.121 4.387 0.017 10 0 "[ . 1 . 2]" 1
1123 1 55 GLN HB3 1 69 TYR HA . . 5.500 4.505 4.281 4.773 . 0 0 "[ . 1 . 2]" 1
1124 1 55 GLN HB3 1 70 THR HB . . 4.510 3.952 3.445 4.208 . 0 0 "[ . 1 . 2]" 1
1125 1 55 GLN QG 1 56 LEU H . . 3.960 3.502 3.196 3.840 . 0 0 "[ . 1 . 2]" 1
1126 1 56 LEU H 1 56 LEU QB . . 3.100 2.607 2.420 2.893 . 0 0 "[ . 1 . 2]" 1
1127 1 56 LEU H 1 56 LEU QD . . 3.930 2.795 1.858 3.245 . 0 0 "[ . 1 . 2]" 1
1128 1 56 LEU H 1 56 LEU HG . . 3.420 2.482 1.920 3.338 . 0 0 "[ . 1 . 2]" 1
1129 1 56 LEU H 1 57 ASP H . . 4.810 4.562 4.502 4.598 . 0 0 "[ . 1 . 2]" 1
1130 1 56 LEU HA 1 56 LEU QD . . 3.770 3.314 3.149 3.426 . 0 0 "[ . 1 . 2]" 1
1131 1 56 LEU HA 1 57 ASP H . . 2.900 2.306 2.223 2.379 . 0 0 "[ . 1 . 2]" 1
1132 1 56 LEU HA 1 57 ASP QB . . 5.010 3.914 3.856 4.076 . 0 0 "[ . 1 . 2]" 1
1133 1 56 LEU HA 1 67 VAL MG1 . . 4.930 3.554 3.303 3.835 . 0 0 "[ . 1 . 2]" 1
1134 1 56 LEU HA 1 68 THR H . . 5.140 4.517 4.223 4.687 . 0 0 "[ . 1 . 2]" 1
1135 1 56 LEU HA 1 69 TYR HA . . 3.830 2.265 2.046 2.416 . 0 0 "[ . 1 . 2]" 1
1136 1 56 LEU HA 1 69 TYR HB2 . . 4.600 3.005 2.802 3.257 . 0 0 "[ . 1 . 2]" 1
1137 1 56 LEU HA 1 69 TYR HB3 . . 4.660 2.601 2.352 2.907 . 0 0 "[ . 1 . 2]" 1
1138 1 56 LEU HA 1 70 THR H . . 4.420 4.092 3.882 4.249 . 0 0 "[ . 1 . 2]" 1
1139 1 56 LEU QB 1 57 ASP H . . 3.590 2.684 2.463 2.946 . 0 0 "[ . 1 . 2]" 1
1140 1 56 LEU QB 1 67 VAL MG1 . . 3.870 2.218 2.017 2.439 . 0 0 "[ . 1 . 2]" 1
1141 1 56 LEU QB 1 69 TYR HA . . 4.720 3.728 3.471 3.885 . 0 0 "[ . 1 . 2]" 1
1142 1 56 LEU QB 1 69 TYR HB2 . . 4.300 3.090 2.886 3.228 . 0 0 "[ . 1 . 2]" 1
1143 1 56 LEU QB 1 69 TYR HB3 . . 4.310 2.524 2.343 2.645 . 0 0 "[ . 1 . 2]" 1
1144 1 56 LEU QD 1 57 ASP H . . 3.900 3.023 2.379 3.829 . 0 0 "[ . 1 . 2]" 1
1145 1 56 LEU QD 1 58 CYS H . . 4.720 3.289 2.726 4.269 . 0 0 "[ . 1 . 2]" 1
1146 1 56 LEU QD 1 58 CYS QB . . 3.810 3.275 2.831 3.797 . 0 0 "[ . 1 . 2]" 1
1147 1 56 LEU QD 1 67 VAL MG1 . . 3.220 2.153 1.822 2.589 . 0 0 "[ . 1 . 2]" 1
1148 1 56 LEU QD 1 69 TYR HA . . 4.940 4.860 4.706 4.948 0.008 8 0 "[ . 1 . 2]" 1
1149 1 56 LEU QD 1 69 TYR HB2 . . 4.630 4.352 4.119 4.524 . 0 0 "[ . 1 . 2]" 1
1150 1 56 LEU QD 1 69 TYR HB3 . . 4.050 3.874 3.699 3.981 . 0 0 "[ . 1 . 2]" 1
1151 1 56 LEU QD 1 69 TYR QD . . 4.770 4.643 4.414 4.772 0.002 10 0 "[ . 1 . 2]" 1
1152 1 57 ASP H 1 57 ASP HB2 . . 3.590 2.882 2.465 3.038 . 0 0 "[ . 1 . 2]" 1
1153 1 57 ASP H 1 57 ASP HB3 . . 3.590 3.112 2.917 3.620 0.030 4 0 "[ . 1 . 2]" 1
1154 1 57 ASP H 1 58 CYS H . . 4.290 4.119 3.894 4.243 . 0 0 "[ . 1 . 2]" 1
1155 1 57 ASP H 1 67 VAL HA . . 4.520 4.108 3.906 4.279 . 0 0 "[ . 1 . 2]" 1
1156 1 57 ASP H 1 67 VAL MG1 . . 4.220 2.467 2.319 2.747 . 0 0 "[ . 1 . 2]" 1
1157 1 57 ASP H 1 68 THR H . . 3.520 2.633 2.395 2.867 . 0 0 "[ . 1 . 2]" 1
1158 1 57 ASP H 1 68 THR HB . . 4.020 3.757 3.531 3.915 . 0 0 "[ . 1 . 2]" 1
1159 1 57 ASP H 1 68 THR MG . . 4.990 4.616 4.314 4.756 . 0 0 "[ . 1 . 2]" 1
1160 1 57 ASP H 1 69 TYR HA . . 4.270 3.719 3.453 3.840 . 0 0 "[ . 1 . 2]" 1
1161 1 57 ASP H 1 69 TYR HB3 . . 4.760 3.946 3.800 4.145 . 0 0 "[ . 1 . 2]" 1
1162 1 57 ASP HA 1 58 CYS H . . 2.750 2.146 2.139 2.159 . 0 0 "[ . 1 . 2]" 1
1163 1 57 ASP HA 1 68 THR H . . 5.130 4.600 4.360 4.794 . 0 0 "[ . 1 . 2]" 1
1164 1 57 ASP QB 1 58 CYS H . . 4.060 3.759 3.546 3.896 . 0 0 "[ . 1 . 2]" 1
1165 1 57 ASP QB 1 68 THR MG . . 4.290 4.057 3.646 4.241 . 0 0 "[ . 1 . 2]" 1
1166 1 57 ASP HB2 1 68 THR H . . 4.390 4.212 3.294 4.392 0.002 11 0 "[ . 1 . 2]" 1
1167 1 57 ASP HB2 1 68 THR HB . . 4.120 3.681 2.436 3.998 . 0 0 "[ . 1 . 2]" 1
1168 1 57 ASP HB2 1 68 THR MG . . 4.920 4.688 3.758 4.921 0.001 17 0 "[ . 1 . 2]" 1
1169 1 57 ASP HB3 1 68 THR H . . 4.390 3.363 3.045 4.181 . 0 0 "[ . 1 . 2]" 1
1170 1 57 ASP HB3 1 68 THR HB . . 4.120 3.100 2.773 3.907 . 0 0 "[ . 1 . 2]" 1
1171 1 57 ASP HB3 1 68 THR MG . . 4.920 4.532 4.318 4.926 0.006 8 0 "[ . 1 . 2]" 1
1172 1 58 CYS H 1 58 CYS HB2 . . 3.820 2.954 2.303 3.657 . 0 0 "[ . 1 . 2]" 1
1173 1 58 CYS H 1 58 CYS QB . . 3.150 2.422 2.210 2.673 . 0 0 "[ . 1 . 2]" 1
1174 1 58 CYS H 1 58 CYS HB3 . . 3.820 2.729 2.402 3.582 . 0 0 "[ . 1 . 2]" 1
1175 1 58 CYS H 1 59 ARG H . . 5.050 4.532 4.438 4.611 . 0 0 "[ . 1 . 2]" 1
1176 1 58 CYS HA 1 59 ARG H . . 2.740 2.172 2.140 2.243 . 0 0 "[ . 1 . 2]" 1
1177 1 58 CYS HA 1 59 ARG QB . . 5.340 4.114 3.996 4.522 . 0 0 "[ . 1 . 2]" 1
1178 1 58 CYS HA 1 67 VAL HA . . 3.620 2.533 2.007 2.751 . 0 0 "[ . 1 . 2]" 1
1179 1 58 CYS HA 1 67 VAL MG1 . . 4.570 3.145 2.733 3.524 . 0 0 "[ . 1 . 2]" 1
1180 1 58 CYS HA 1 67 VAL MG2 . . 3.940 2.250 2.005 2.666 . 0 0 "[ . 1 . 2]" 1
1181 1 58 CYS HA 1 68 THR H . . 4.090 3.885 3.415 4.072 . 0 0 "[ . 1 . 2]" 1
1182 1 58 CYS QB 1 59 ARG H . . 3.730 3.408 2.816 3.732 0.002 3 0 "[ . 1 . 2]" 1
1183 1 58 CYS QB 1 67 VAL MG1 . . 4.260 3.718 2.849 4.251 . 0 0 "[ . 1 . 2]" 1
1184 1 58 CYS QB 1 67 VAL MG2 . . 3.740 2.943 2.231 3.295 . 0 0 "[ . 1 . 2]" 1
1185 1 58 CYS HB2 1 59 ARG H . . 4.490 3.845 3.029 4.446 . 0 0 "[ . 1 . 2]" 1
1186 1 58 CYS HB2 1 67 VAL MG2 . . 4.290 3.230 2.538 4.197 . 0 0 "[ . 1 . 2]" 1
1187 1 58 CYS HB3 1 59 ARG H . . 4.490 4.021 2.874 4.305 . 0 0 "[ . 1 . 2]" 1
1188 1 58 CYS HB3 1 67 VAL MG2 . . 4.290 3.671 2.474 4.291 0.001 8 0 "[ . 1 . 2]" 1
1189 1 59 ARG H 1 59 ARG HB2 . . 3.830 2.913 2.518 3.757 . 0 0 "[ . 1 . 2]" 1
1190 1 59 ARG H 1 59 ARG QB . . 3.360 2.588 2.421 3.145 . 0 0 "[ . 1 . 2]" 1
1191 1 59 ARG H 1 59 ARG HB3 . . 3.830 3.399 2.473 3.818 . 0 0 "[ . 1 . 2]" 1
1192 1 59 ARG H 1 59 ARG HG2 . . 4.580 3.931 1.937 4.579 . 0 0 "[ . 1 . 2]" 1
1193 1 59 ARG H 1 59 ARG QG . . 3.760 3.475 1.924 3.747 . 0 0 "[ . 1 . 2]" 1
1194 1 59 ARG H 1 59 ARG HG3 . . 4.580 4.098 3.290 4.613 0.033 10 0 "[ . 1 . 2]" 1
1195 1 59 ARG H 1 60 GLU H . . 4.540 4.419 4.367 4.478 . 0 0 "[ . 1 . 2]" 1
1196 1 59 ARG H 1 66 VAL H . . 3.530 3.454 3.350 3.527 . 0 0 "[ . 1 . 2]" 1
1197 1 59 ARG H 1 66 VAL MG1 . . 4.000 2.648 1.982 3.020 . 0 0 "[ . 1 . 2]" 1
1198 1 59 ARG H 1 66 VAL MG2 . . 5.020 4.600 4.213 4.928 . 0 0 "[ . 1 . 2]" 1
1199 1 59 ARG H 1 67 VAL HA . . 4.020 3.191 2.973 3.517 . 0 0 "[ . 1 . 2]" 1
1200 1 59 ARG H 1 67 VAL MG2 . . 4.220 3.242 2.823 3.694 . 0 0 "[ . 1 . 2]" 1
1201 1 59 ARG H 1 68 THR H . . 5.500 4.753 4.353 5.169 . 0 0 "[ . 1 . 2]" 1
1202 1 59 ARG HA 1 59 ARG HD2 . . 4.890 4.237 2.522 4.835 . 0 0 "[ . 1 . 2]" 1
1203 1 59 ARG HA 1 59 ARG HD3 . . 4.890 3.929 2.237 4.896 0.006 13 0 "[ . 1 . 2]" 1
1204 1 59 ARG HA 1 60 GLU H . . 2.820 2.523 2.384 2.652 . 0 0 "[ . 1 . 2]" 1
1205 1 59 ARG HA 1 60 GLU QB . . 4.860 4.328 4.112 4.498 . 0 0 "[ . 1 . 2]" 1
1206 1 59 ARG QB 1 60 GLU H . . 3.230 2.381 1.926 3.252 0.022 10 0 "[ . 1 . 2]" 1
1207 1 59 ARG QB 1 66 VAL MG1 . . 3.070 2.042 1.809 3.120 0.050 11 0 "[ . 1 . 2]" 1
1208 1 59 ARG HB2 1 59 ARG HD2 . . 3.950 2.965 2.361 3.683 . 0 0 "[ . 1 . 2]" 1
1209 1 59 ARG HB2 1 59 ARG HD3 . . 3.950 3.304 2.601 3.941 . 0 0 "[ . 1 . 2]" 1
1210 1 59 ARG HB2 1 60 GLU H . . 3.900 3.462 2.205 3.820 . 0 0 "[ . 1 . 2]" 1
1211 1 59 ARG HB2 1 66 VAL MG1 . . 3.850 2.444 1.858 3.605 . 0 0 "[ . 1 . 2]" 1
1212 1 59 ARG HB3 1 59 ARG HD2 . . 3.950 2.817 2.099 3.616 . 0 0 "[ . 1 . 2]" 1
1213 1 59 ARG HB3 1 59 ARG HD3 . . 3.950 2.597 2.141 3.428 . 0 0 "[ . 1 . 2]" 1
1214 1 59 ARG HB3 1 60 GLU H . . 3.900 2.627 1.936 3.932 0.032 10 0 "[ . 1 . 2]" 1
1215 1 59 ARG HB3 1 66 VAL MG1 . . 3.850 2.524 2.135 3.749 . 0 0 "[ . 1 . 2]" 1
1216 1 59 ARG QD 1 60 GLU H . . 4.840 3.589 2.556 4.654 . 0 0 "[ . 1 . 2]" 1
1217 1 59 ARG QD 1 66 VAL MG1 . . 4.190 3.304 2.329 4.108 . 0 0 "[ . 1 . 2]" 1
1218 1 59 ARG HD2 1 60 GLU H . . 5.500 4.281 2.831 5.312 . 0 0 "[ . 1 . 2]" 1
1219 1 59 ARG HD2 1 66 VAL MG1 . . 4.950 3.896 3.053 4.943 . 0 0 "[ . 1 . 2]" 1
1220 1 59 ARG HD3 1 60 GLU H . . 5.500 4.085 2.603 5.493 . 0 0 "[ . 1 . 2]" 1
1221 1 59 ARG HD3 1 66 VAL MG1 . . 4.950 3.805 2.357 4.950 . 0 0 "[ . 1 . 2]" 1
1222 1 59 ARG QG 1 60 GLU H . . 4.060 3.145 1.856 3.965 . 0 0 "[ . 1 . 2]" 1
1223 1 59 ARG QG 1 66 VAL MG1 . . 4.080 3.068 1.627 3.853 . 0 0 "[ . 1 . 2]" 1
1224 1 59 ARG HG2 1 60 GLU H . . 4.890 3.551 2.670 4.559 . 0 0 "[ . 1 . 2]" 1
1225 1 59 ARG HG3 1 60 GLU H . . 4.890 3.829 1.887 4.648 . 0 0 "[ . 1 . 2]" 1
1226 1 60 GLU H 1 60 GLU QB . . 2.780 2.498 2.231 2.782 0.002 4 0 "[ . 1 . 2]" 1
1227 1 60 GLU H 1 60 GLU QG . . 3.300 2.651 1.950 3.218 . 0 0 "[ . 1 . 2]" 1
1228 1 60 GLU H 1 61 CYS H . . 4.700 4.485 4.329 4.599 . 0 0 "[ . 1 . 2]" 1
1229 1 60 GLU H 1 66 VAL MG1 . . 4.370 3.567 3.186 4.025 . 0 0 "[ . 1 . 2]" 1
1230 1 60 GLU HA 1 60 GLU QG . . 3.620 2.748 2.199 3.443 . 0 0 "[ . 1 . 2]" 1
1231 1 60 GLU HA 1 61 CYS H . . 2.800 2.200 2.145 2.280 . 0 0 "[ . 1 . 2]" 1
1232 1 60 GLU HA 1 65 HIS HA . . 3.550 3.436 3.348 3.534 . 0 0 "[ . 1 . 2]" 1
1233 1 60 GLU HA 1 66 VAL H . . 4.210 3.638 3.505 3.805 . 0 0 "[ . 1 . 2]" 1
1234 1 60 GLU QB 1 61 CYS H . . 3.300 3.007 2.755 3.259 . 0 0 "[ . 1 . 2]" 1
1235 1 60 GLU QB 1 61 CYS HA . . 5.220 4.216 3.925 4.486 . 0 0 "[ . 1 . 2]" 1
1236 1 60 GLU QG 1 61 CYS H . . 4.000 3.898 3.731 4.001 0.001 13 0 "[ . 1 . 2]" 1
1237 1 61 CYS H 1 61 CYS QB . . 3.630 3.010 2.431 3.235 . 0 0 "[ . 1 . 2]" 1
1238 1 61 CYS H 1 62 PRO QD . . 5.020 4.333 4.290 4.364 . 0 0 "[ . 1 . 2]" 1
1239 1 61 CYS H 1 63 GLU H . . 4.660 4.378 4.224 4.537 . 0 0 "[ . 1 . 2]" 1
1240 1 61 CYS H 1 64 GLY H . . 3.880 3.736 3.573 3.880 . 0 0 "[ . 1 . 2]" 1
1241 1 61 CYS H 1 65 HIS HA . . 3.490 3.298 2.985 3.491 0.001 7 0 "[ . 1 . 2]" 1
1242 1 61 CYS H 1 66 VAL H . . 4.370 3.985 3.593 4.361 . 0 0 "[ . 1 . 2]" 1
1243 1 61 CYS H 1 66 VAL MG1 . . 4.460 3.796 3.145 4.428 . 0 0 "[ . 1 . 2]" 1
1244 1 61 CYS HA 1 62 PRO HD2 . . 3.780 2.405 2.348 2.527 . 0 0 "[ . 1 . 2]" 1
1245 1 61 CYS HA 1 62 PRO QD . . 3.210 2.092 2.059 2.166 . 0 0 "[ . 1 . 2]" 1
1246 1 61 CYS HA 1 62 PRO HD3 . . 3.780 2.301 2.279 2.355 . 0 0 "[ . 1 . 2]" 1
1247 1 61 CYS HA 1 62 PRO HG2 . . 5.060 4.516 4.468 4.617 . 0 0 "[ . 1 . 2]" 1
1248 1 61 CYS HA 1 62 PRO HG3 . . 5.080 4.474 4.440 4.552 . 0 0 "[ . 1 . 2]" 1
1249 1 61 CYS QB 1 62 PRO QD . . 3.030 2.012 1.962 2.108 . 0 0 "[ . 1 . 2]" 1
1250 1 61 CYS QB 1 63 GLU H . . 4.200 2.477 2.179 2.822 . 0 0 "[ . 1 . 2]" 1
1251 1 61 CYS QB 1 63 GLU QB . . 4.310 3.216 2.875 3.598 . 0 0 "[ . 1 . 2]" 1
1252 1 61 CYS QB 1 64 GLY H . . 4.370 3.506 2.887 3.962 . 0 0 "[ . 1 . 2]" 1
1253 1 61 CYS QB 1 66 VAL H . . 5.010 3.931 3.508 4.354 . 0 0 "[ . 1 . 2]" 1
1254 1 61 CYS QB 1 66 VAL HB . . 4.040 2.387 2.233 2.593 . 0 0 "[ . 1 . 2]" 1
1255 1 61 CYS QB 1 66 VAL MG1 . . 3.390 2.394 1.970 2.819 . 0 0 "[ . 1 . 2]" 1
1256 1 61 CYS QB 1 66 VAL MG2 . . 3.870 3.545 3.387 3.823 . 0 0 "[ . 1 . 2]" 1
1257 1 61 CYS HB2 1 62 PRO HD2 . . 4.790 2.285 2.004 3.592 . 0 0 "[ . 1 . 2]" 1
1258 1 61 CYS HB2 1 62 PRO HD3 . . 4.790 3.670 3.428 4.680 . 0 0 "[ . 1 . 2]" 1
1259 1 61 CYS HB2 1 63 GLU H . . 4.940 2.669 2.377 3.371 . 0 0 "[ . 1 . 2]" 1
1260 1 61 CYS HB2 1 66 VAL MG1 . . 4.030 3.727 2.673 4.036 0.006 11 0 "[ . 1 . 2]" 1
1261 1 61 CYS HB2 1 66 VAL MG2 . . 4.610 4.446 3.904 4.608 . 0 0 "[ . 1 . 2]" 1
1262 1 61 CYS HB3 1 62 PRO HD2 . . 4.790 3.080 1.999 3.527 . 0 0 "[ . 1 . 2]" 1
1263 1 61 CYS HB3 1 62 PRO HD3 . . 4.790 4.134 3.445 4.480 . 0 0 "[ . 1 . 2]" 1
1264 1 61 CYS HB3 1 63 GLU H . . 4.940 3.785 2.207 4.090 . 0 0 "[ . 1 . 2]" 1
1265 1 61 CYS HB3 1 66 VAL MG1 . . 4.030 2.595 1.979 4.033 0.003 7 0 "[ . 1 . 2]" 1
1266 1 61 CYS HB3 1 66 VAL MG2 . . 4.610 3.800 3.525 4.611 0.001 18 0 "[ . 1 . 2]" 1
1267 1 62 PRO HA 1 64 GLY H . . 4.220 3.946 3.789 4.115 . 0 0 "[ . 1 . 2]" 1
1268 1 62 PRO QB 1 63 GLU H . . 3.710 3.676 3.577 3.714 0.004 2 0 "[ . 1 . 2]" 1
1269 1 62 PRO HB2 1 63 GLU H . . 4.550 3.909 3.785 3.956 . 0 0 "[ . 1 . 2]" 1
1270 1 62 PRO HB3 1 63 GLU H . . 4.550 4.473 4.403 4.500 . 0 0 "[ . 1 . 2]" 1
1271 1 62 PRO QD 1 63 GLU H . . 3.910 2.886 2.769 2.936 . 0 0 "[ . 1 . 2]" 1
1272 1 62 PRO HD2 1 63 GLU H . . 4.580 2.960 2.829 3.015 . 0 0 "[ . 1 . 2]" 1
1273 1 62 PRO HD3 1 63 GLU H . . 4.580 4.008 3.939 4.038 . 0 0 "[ . 1 . 2]" 1
1274 1 62 PRO HG2 1 64 GLY H . . 5.500 5.248 5.105 5.337 . 0 0 "[ . 1 . 2]" 1
1275 1 63 GLU H 1 63 GLU HB2 . . 3.740 2.456 2.340 2.586 . 0 0 "[ . 1 . 2]" 1
1276 1 63 GLU H 1 63 GLU QB . . 3.120 2.421 2.310 2.542 . 0 0 "[ . 1 . 2]" 1
1277 1 63 GLU H 1 63 GLU HB3 . . 3.740 3.660 3.567 3.742 0.002 11 0 "[ . 1 . 2]" 1
1278 1 63 GLU H 1 63 GLU HG2 . . 4.300 3.253 2.783 4.214 . 0 0 "[ . 1 . 2]" 1
1279 1 63 GLU H 1 63 GLU QG . . 3.590 3.023 2.701 3.590 0.000 18 0 "[ . 1 . 2]" 1
1280 1 63 GLU H 1 63 GLU HG3 . . 4.300 3.867 2.839 4.208 . 0 0 "[ . 1 . 2]" 1
1281 1 63 GLU H 1 64 GLY H . . 3.180 2.067 1.991 2.173 . 0 0 "[ . 1 . 2]" 1
1282 1 63 GLU HA 1 63 GLU HG2 . . 3.900 2.753 2.344 3.636 . 0 0 "[ . 1 . 2]" 1
1283 1 63 GLU HA 1 63 GLU QG . . 3.360 2.570 2.263 2.849 . 0 0 "[ . 1 . 2]" 1
1284 1 63 GLU HA 1 63 GLU HG3 . . 3.900 3.534 2.330 3.804 . 0 0 "[ . 1 . 2]" 1
1285 1 63 GLU QB 1 64 GLY H . . 3.670 3.248 3.061 3.508 . 0 0 "[ . 1 . 2]" 1
1286 1 63 GLU HB2 1 64 GLY H . . 4.330 3.410 3.181 3.754 . 0 0 "[ . 1 . 2]" 1
1287 1 63 GLU HB3 1 64 GLY H . . 4.330 4.094 3.905 4.317 . 0 0 "[ . 1 . 2]" 1
1288 1 63 GLU QG 1 64 GLY H . . 4.770 4.450 4.258 4.725 . 0 0 "[ . 1 . 2]" 1
1289 1 63 GLU HG2 1 64 GLY H . . 5.500 4.809 4.527 5.500 . 0 0 "[ . 1 . 2]" 1
1290 1 63 GLU HG3 1 64 GLY H . . 5.500 5.337 4.677 5.500 0.000 2 0 "[ . 1 . 2]" 1
1291 1 64 GLY H 1 65 HIS H . . 4.080 3.854 3.382 4.062 . 0 0 "[ . 1 . 2]" 1
1292 1 64 GLY H 1 65 HIS HA . . 5.010 4.615 4.374 4.803 . 0 0 "[ . 1 . 2]" 1
1293 1 64 GLY HA2 1 65 HIS H . . 3.500 3.410 3.294 3.535 0.035 13 0 "[ . 1 . 2]" 1
1294 1 64 GLY HA3 1 65 HIS H . . 2.980 2.195 2.139 2.364 . 0 0 "[ . 1 . 2]" 1
1295 1 65 HIS H 1 65 HIS HB2 . . 3.980 2.664 2.439 2.850 . 0 0 "[ . 1 . 2]" 1
1296 1 65 HIS H 1 65 HIS QB . . 3.350 2.613 2.405 2.781 . 0 0 "[ . 1 . 2]" 1
1297 1 65 HIS H 1 65 HIS HB3 . . 3.980 3.785 3.659 3.877 . 0 0 "[ . 1 . 2]" 1
1298 1 65 HIS H 1 65 HIS HD2 . . 3.980 3.453 2.659 3.892 . 0 0 "[ . 1 . 2]" 1
1299 1 65 HIS H 1 66 VAL H . . 4.610 4.366 4.175 4.455 . 0 0 "[ . 1 . 2]" 1
1300 1 65 HIS H 1 66 VAL HA . . 5.500 4.852 4.640 5.060 . 0 0 "[ . 1 . 2]" 1
1301 1 65 HIS HA 1 66 VAL H . . 2.950 2.194 2.162 2.243 . 0 0 "[ . 1 . 2]" 1
1302 1 65 HIS HA 1 66 VAL HB . . 4.470 4.371 4.281 4.467 . 0 0 "[ . 1 . 2]" 1
1303 1 65 HIS HA 1 66 VAL MG1 . . 4.260 3.930 3.827 4.088 . 0 0 "[ . 1 . 2]" 1
1304 1 65 HIS QB 1 66 VAL H . . 3.570 2.994 2.809 3.148 . 0 0 "[ . 1 . 2]" 1
1305 1 65 HIS HB2 1 66 VAL H . . 4.270 4.124 3.922 4.264 . 0 0 "[ . 1 . 2]" 1
1306 1 65 HIS HB2 1 67 VAL MG2 . . 4.740 4.672 4.568 4.741 0.001 16 0 "[ . 1 . 2]" 1
1307 1 65 HIS HB3 1 66 VAL H . . 4.270 3.075 2.871 3.242 . 0 0 "[ . 1 . 2]" 1
1308 1 65 HIS HB3 1 67 VAL MG2 . . 4.740 3.740 3.555 4.083 . 0 0 "[ . 1 . 2]" 1
1309 1 66 VAL H 1 66 VAL HB . . 3.680 3.043 2.888 3.141 . 0 0 "[ . 1 . 2]" 1
1310 1 66 VAL H 1 66 VAL MG1 . . 3.290 2.239 2.109 2.327 . 0 0 "[ . 1 . 2]" 1
1311 1 66 VAL H 1 66 VAL MG2 . . 4.210 3.929 3.894 3.964 . 0 0 "[ . 1 . 2]" 1
1312 1 66 VAL H 1 67 VAL H . . 4.840 4.426 4.365 4.479 . 0 0 "[ . 1 . 2]" 1
1313 1 66 VAL H 1 67 VAL MG2 . . 4.840 3.869 3.647 4.098 . 0 0 "[ . 1 . 2]" 1
1314 1 66 VAL HA 1 66 VAL MG1 . . 3.470 3.186 3.176 3.196 . 0 0 "[ . 1 . 2]" 1
1315 1 66 VAL HA 1 66 VAL MG2 . . 3.390 2.172 2.112 2.243 . 0 0 "[ . 1 . 2]" 1
1316 1 66 VAL HA 1 67 VAL H . . 2.810 2.235 2.189 2.279 . 0 0 "[ . 1 . 2]" 1
1317 1 66 VAL HA 1 67 VAL HB . . 4.800 4.514 4.385 4.638 . 0 0 "[ . 1 . 2]" 1
1318 1 66 VAL HA 1 67 VAL MG2 . . 3.730 3.562 3.425 3.722 . 0 0 "[ . 1 . 2]" 1
1319 1 66 VAL HB 1 67 VAL H . . 4.230 4.090 3.978 4.217 . 0 0 "[ . 1 . 2]" 1
1320 1 66 VAL MG1 1 67 VAL H . . 4.030 3.626 3.453 3.763 . 0 0 "[ . 1 . 2]" 1
1321 1 66 VAL MG1 1 67 VAL HA . . 4.030 3.672 3.520 3.778 . 0 0 "[ . 1 . 2]" 1
1322 1 66 VAL MG2 1 67 VAL H . . 3.280 2.052 1.886 2.214 . 0 0 "[ . 1 . 2]" 1
1323 1 67 VAL H 1 67 VAL HB . . 3.350 2.790 2.719 2.877 . 0 0 "[ . 1 . 2]" 1
1324 1 67 VAL H 1 67 VAL MG1 . . 4.490 3.899 3.830 3.952 . 0 0 "[ . 1 . 2]" 1
1325 1 67 VAL H 1 67 VAL MG2 . . 3.290 2.996 2.840 3.156 . 0 0 "[ . 1 . 2]" 1
1326 1 67 VAL H 1 68 THR H . . 4.410 4.288 4.145 4.404 . 0 0 "[ . 1 . 2]" 1
1327 1 67 VAL H 1 68 THR HA . . 4.940 4.740 4.664 4.811 . 0 0 "[ . 1 . 2]" 1
1328 1 67 VAL HA 1 67 VAL MG1 . . 3.490 2.329 2.233 2.440 . 0 0 "[ . 1 . 2]" 1
1329 1 67 VAL HA 1 67 VAL MG2 . . 3.420 2.338 2.212 2.435 . 0 0 "[ . 1 . 2]" 1
1330 1 67 VAL HA 1 68 THR H . . 2.830 2.176 2.139 2.267 . 0 0 "[ . 1 . 2]" 1
1331 1 67 VAL HA 1 68 THR HA . . 4.920 4.398 4.387 4.431 . 0 0 "[ . 1 . 2]" 1
1332 1 67 VAL HB 1 68 THR H . . 4.520 4.108 3.942 4.337 . 0 0 "[ . 1 . 2]" 1
1333 1 67 VAL MG1 1 68 THR H . . 3.210 2.294 1.937 2.598 . 0 0 "[ . 1 . 2]" 1
1334 1 67 VAL MG1 1 68 THR HA . . 4.500 3.716 3.384 3.915 . 0 0 "[ . 1 . 2]" 1
1335 1 67 VAL MG1 1 69 TYR HB3 . . 4.360 3.275 2.991 3.431 . 0 0 "[ . 1 . 2]" 1
1336 1 67 VAL MG1 1 69 TYR QD . . 3.700 3.342 2.949 3.647 . 0 0 "[ . 1 . 2]" 1
1337 1 68 THR H 1 68 THR HB . . 3.550 2.731 2.544 2.910 . 0 0 "[ . 1 . 2]" 1
1338 1 68 THR H 1 68 THR MG . . 3.980 3.886 3.812 3.952 . 0 0 "[ . 1 . 2]" 1
1339 1 68 THR H 1 69 TYR H . . 4.620 4.395 4.140 4.485 . 0 0 "[ . 1 . 2]" 1
1340 1 68 THR HA 1 68 THR MG . . 3.310 2.293 2.166 2.425 . 0 0 "[ . 1 . 2]" 1
1341 1 68 THR HA 1 69 TYR H . . 2.780 2.169 2.143 2.205 . 0 0 "[ . 1 . 2]" 1
1342 1 68 THR HA 1 69 TYR QD . . 4.480 4.012 3.562 4.304 . 0 0 "[ . 1 . 2]" 1
1343 1 68 THR HB 1 69 TYR H . . 4.200 4.035 3.876 4.192 . 0 0 "[ . 1 . 2]" 1
1344 1 68 THR MG 1 69 TYR H . . 3.440 2.405 2.061 2.774 . 0 0 "[ . 1 . 2]" 1
1345 1 68 THR MG 1 69 TYR HA . . 4.400 3.683 3.451 3.997 . 0 0 "[ . 1 . 2]" 1
1346 1 69 TYR H 1 69 TYR HB2 . . 4.100 3.895 3.835 3.942 . 0 0 "[ . 1 . 2]" 1
1347 1 69 TYR H 1 69 TYR HB3 . . 3.850 3.094 2.951 3.187 . 0 0 "[ . 1 . 2]" 1
1348 1 69 TYR H 1 69 TYR QD . . 3.550 3.067 2.689 3.246 . 0 0 "[ . 1 . 2]" 1
1349 1 69 TYR H 1 69 TYR QE . . 4.850 4.506 4.334 4.607 . 0 0 "[ . 1 . 2]" 1
1350 1 69 TYR H 1 70 THR H . . 4.510 4.432 4.408 4.470 . 0 0 "[ . 1 . 2]" 1
1351 1 69 TYR HA 1 69 TYR QD . . 4.310 3.680 3.642 3.729 . 0 0 "[ . 1 . 2]" 1
1352 1 69 TYR HA 1 70 THR H . . 2.920 2.409 2.363 2.444 . 0 0 "[ . 1 . 2]" 1
1353 1 69 TYR HA 1 70 THR HB . . 4.670 4.583 4.492 4.664 . 0 0 "[ . 1 . 2]" 1
1354 1 69 TYR HB2 1 70 THR H . . 3.550 2.500 2.433 2.584 . 0 0 "[ . 1 . 2]" 1
1355 1 69 TYR HB3 1 70 THR H . . 3.940 3.884 3.842 3.936 . 0 0 "[ . 1 . 2]" 1
1356 1 69 TYR QD 1 70 THR H . . 4.200 2.744 2.539 2.960 . 0 0 "[ . 1 . 2]" 1
1357 1 69 TYR QD 1 71 PRO HA . . 4.370 3.652 3.537 3.811 . 0 0 "[ . 1 . 2]" 1
1358 1 69 TYR QD 1 71 PRO HB2 . . 5.500 5.507 5.465 5.521 0.021 20 0 "[ . 1 . 2]" 1
1359 1 69 TYR QD 1 71 PRO HB3 . . 4.540 4.191 4.106 4.240 . 0 0 "[ . 1 . 2]" 1
1360 1 69 TYR QD 1 71 PRO HD2 . . 4.670 4.170 3.959 4.498 . 0 0 "[ . 1 . 2]" 1
1361 1 69 TYR QD 1 71 PRO QD . . 3.790 2.875 2.647 3.139 . 0 0 "[ . 1 . 2]" 1
1362 1 69 TYR QD 1 71 PRO HD3 . . 4.670 2.931 2.686 3.204 . 0 0 "[ . 1 . 2]" 1
1363 1 69 TYR QD 1 71 PRO HG3 . . 5.200 4.883 4.700 5.030 . 0 0 "[ . 1 . 2]" 1
1364 1 69 TYR QE 1 69 TYR HH . . 3.160 2.255 2.194 2.443 . 0 0 "[ . 1 . 2]" 1
1365 1 69 TYR QE 1 71 PRO HA . . 4.860 3.742 3.377 4.181 . 0 0 "[ . 1 . 2]" 1
1366 1 69 TYR QE 1 71 PRO HB2 . . 4.770 4.555 4.298 4.770 . 0 0 "[ . 1 . 2]" 1
1367 1 69 TYR QE 1 71 PRO HB3 . . 4.030 2.871 2.618 3.133 . 0 0 "[ . 1 . 2]" 1
1368 1 69 TYR QE 1 71 PRO QD . . 3.770 2.548 2.235 2.877 . 0 0 "[ . 1 . 2]" 1
1369 1 69 TYR QE 1 71 PRO HG2 . . 5.500 4.802 4.613 5.062 . 0 0 "[ . 1 . 2]" 1
1370 1 69 TYR QE 1 71 PRO HG3 . . 3.850 3.571 3.312 3.798 . 0 0 "[ . 1 . 2]" 1
1371 1 69 TYR QE 1 79 ILE MD . . 3.680 2.714 2.215 3.212 . 0 0 "[ . 1 . 2]" 1
1372 1 69 TYR QE 1 96 ALA MB . . 4.650 3.963 3.677 4.149 . 0 0 "[ . 1 . 2]" 1
1373 1 69 TYR HH 1 79 ILE MD . . 3.600 3.087 2.392 3.566 . 0 0 "[ . 1 . 2]" 1
1374 1 69 TYR HH 1 96 ALA MB . . 3.350 2.968 2.559 3.264 . 0 0 "[ . 1 . 2]" 1
1375 1 70 THR H 1 70 THR HB . . 3.230 2.729 2.654 2.821 . 0 0 "[ . 1 . 2]" 1
1376 1 70 THR H 1 70 THR MG . . 3.950 3.887 3.843 3.923 . 0 0 "[ . 1 . 2]" 1
1377 1 70 THR H 1 71 PRO HD2 . . 5.230 4.726 4.683 4.755 . 0 0 "[ . 1 . 2]" 1
1378 1 70 THR H 1 71 PRO QD . . 4.460 4.071 4.004 4.121 . 0 0 "[ . 1 . 2]" 1
1379 1 70 THR H 1 71 PRO HD3 . . 5.230 4.444 4.348 4.517 . 0 0 "[ . 1 . 2]" 1
1380 1 70 THR HA 1 70 THR MG . . 3.270 2.361 2.278 2.448 . 0 0 "[ . 1 . 2]" 1
1381 1 70 THR HA 1 71 PRO HD2 . . 3.620 1.988 1.969 2.001 . 0 0 "[ . 1 . 2]" 1
1382 1 70 THR HA 1 71 PRO HD3 . . 3.620 2.317 2.306 2.337 . 0 0 "[ . 1 . 2]" 1
1383 1 70 THR HA 1 71 PRO HG3 . . 4.740 4.318 4.317 4.319 . 0 0 "[ . 1 . 2]" 1
1384 1 70 THR MG 1 71 PRO HB2 . . 5.000 4.666 4.596 4.745 . 0 0 "[ . 1 . 2]" 1
1385 1 70 THR MG 1 71 PRO HD2 . . 3.870 2.157 1.995 2.365 . 0 0 "[ . 1 . 2]" 1
1386 1 70 THR MG 1 71 PRO QD . . 3.390 2.138 1.982 2.336 . 0 0 "[ . 1 . 2]" 1
1387 1 70 THR MG 1 71 PRO HD3 . . 3.870 3.517 3.424 3.627 . 0 0 "[ . 1 . 2]" 1
1388 1 70 THR MG 1 71 PRO HG2 . . 3.560 3.379 3.305 3.475 . 0 0 "[ . 1 . 2]" 1
1389 1 70 THR MG 1 71 PRO HG3 . . 5.270 4.378 4.293 4.478 . 0 0 "[ . 1 . 2]" 1
1390 1 71 PRO HA 1 72 MET H . . 2.880 2.229 2.152 2.282 . 0 0 "[ . 1 . 2]" 1
1391 1 71 PRO HA 1 72 MET HA . . 4.960 4.407 4.384 4.430 . 0 0 "[ . 1 . 2]" 1
1392 1 71 PRO HA 1 72 MET QG . . 4.480 3.844 3.148 4.452 . 0 0 "[ . 1 . 2]" 1
1393 1 71 PRO HA 1 73 ALA H . . 3.830 3.742 3.536 3.843 0.013 7 0 "[ . 1 . 2]" 1
1394 1 71 PRO HA 1 77 TYR QE . . 4.800 3.900 3.682 4.173 . 0 0 "[ . 1 . 2]" 1
1395 1 71 PRO HB2 1 72 MET H . . 4.210 3.149 2.946 3.622 . 0 0 "[ . 1 . 2]" 1
1396 1 71 PRO HB2 1 73 ALA H . . 3.830 3.318 3.042 3.506 . 0 0 "[ . 1 . 2]" 1
1397 1 71 PRO HB2 1 77 TYR QE . . 4.410 3.825 3.364 4.403 . 0 0 "[ . 1 . 2]" 1
1398 1 71 PRO HB2 1 77 TYR HH . . 4.880 4.316 3.224 4.877 . 0 0 "[ . 1 . 2]" 1
1399 1 71 PRO HB2 1 98 VAL MG1 . . 3.590 2.500 2.109 2.779 . 0 0 "[ . 1 . 2]" 1
1400 1 71 PRO HB2 1 98 VAL MG2 . . 3.870 3.340 2.933 3.676 . 0 0 "[ . 1 . 2]" 1
1401 1 71 PRO HB3 1 72 MET H . . 4.250 3.758 3.635 4.061 . 0 0 "[ . 1 . 2]" 1
1402 1 71 PRO HB3 1 73 ALA H . . 4.540 4.363 4.155 4.540 . 15 0 "[ . 1 . 2]" 1
1403 1 71 PRO HB3 1 77 TYR QE . . 4.570 3.496 3.102 4.110 . 0 0 "[ . 1 . 2]" 1
1404 1 71 PRO HB3 1 98 VAL MG1 . . 3.840 2.824 2.304 3.136 . 0 0 "[ . 1 . 2]" 1
1405 1 71 PRO HB3 1 98 VAL MG2 . . 4.030 2.347 1.977 2.686 . 0 0 "[ . 1 . 2]" 1
1406 1 71 PRO HG2 1 72 MET HA . . 5.500 4.986 4.883 5.151 . 0 0 "[ . 1 . 2]" 1
1407 1 71 PRO HG2 1 73 ALA H . . 5.500 5.317 5.047 5.505 0.005 7 0 "[ . 1 . 2]" 1
1408 1 71 PRO HG2 1 98 VAL MG1 . . 3.340 3.140 2.894 3.340 0.000 3 0 "[ . 1 . 2]" 1
1409 1 71 PRO HG2 1 98 VAL MG2 . . 4.370 4.166 3.833 4.362 . 0 0 "[ . 1 . 2]" 1
1410 1 71 PRO HG3 1 98 VAL MG1 . . 3.630 2.455 2.251 2.721 . 0 0 "[ . 1 . 2]" 1
1411 1 71 PRO HG3 1 98 VAL MG2 . . 3.910 2.887 2.608 3.101 . 0 0 "[ . 1 . 2]" 1
1412 1 72 MET H 1 72 MET HB2 . . 3.980 2.616 2.323 3.642 . 0 0 "[ . 1 . 2]" 1
1413 1 72 MET H 1 72 MET QB . . 3.360 2.511 2.295 2.814 . 0 0 "[ . 1 . 2]" 1
1414 1 72 MET H 1 72 MET HB3 . . 3.980 3.631 2.459 3.826 . 0 0 "[ . 1 . 2]" 1
1415 1 72 MET H 1 72 MET HG2 . . 4.250 3.611 2.395 4.251 0.001 17 0 "[ . 1 . 2]" 1
1416 1 72 MET H 1 72 MET QG . . 3.590 2.930 2.371 3.477 . 0 0 "[ . 1 . 2]" 1
1417 1 72 MET H 1 72 MET HG3 . . 4.250 3.341 2.419 3.979 . 0 0 "[ . 1 . 2]" 1
1418 1 72 MET H 1 73 ALA H . . 3.060 1.934 1.806 2.207 . 0 0 "[ . 1 . 2]" 1
1419 1 72 MET H 1 73 ALA MB . . 4.330 3.996 3.785 4.240 . 0 0 "[ . 1 . 2]" 1
1420 1 72 MET H 1 77 TYR QE . . 5.500 3.848 3.603 4.137 . 0 0 "[ . 1 . 2]" 1
1421 1 72 MET H 1 77 TYR HH . . 4.470 2.885 1.975 3.620 . 0 0 "[ . 1 . 2]" 1
1422 1 72 MET QB 1 72 MET ME . . 2.790 2.164 1.940 2.670 . 0 0 "[ . 1 . 2]" 1
1423 1 72 MET QB 1 73 ALA H . . 3.850 3.085 2.823 3.594 . 0 0 "[ . 1 . 2]" 1
1424 1 72 MET QB 1 73 ALA MB . . 3.850 3.360 3.213 3.935 0.085 10 0 "[ . 1 . 2]" 1
1425 1 72 MET HB2 1 72 MET ME . . 3.530 2.828 2.033 3.543 0.013 9 0 "[ . 1 . 2]" 1
1426 1 72 MET HB2 1 73 ALA H . . 4.410 3.242 2.936 4.262 . 0 0 "[ . 1 . 2]" 1
1427 1 72 MET HB2 1 73 ALA MB . . 4.610 3.678 3.419 4.260 . 0 0 "[ . 1 . 2]" 1
1428 1 72 MET HB3 1 72 MET ME . . 3.530 2.431 1.967 3.405 . 0 0 "[ . 1 . 2]" 1
1429 1 72 MET HB3 1 73 ALA H . . 4.410 3.965 3.641 4.377 . 0 0 "[ . 1 . 2]" 1
1430 1 72 MET HB3 1 73 ALA MB . . 4.610 3.968 3.643 4.626 0.016 10 0 "[ . 1 . 2]" 1
1431 1 72 MET ME 1 72 MET HG2 . . 3.820 2.935 2.148 3.395 . 0 0 "[ . 1 . 2]" 1
1432 1 72 MET ME 1 72 MET QG . . 3.200 2.377 2.121 2.560 . 0 0 "[ . 1 . 2]" 1
1433 1 72 MET ME 1 72 MET HG3 . . 3.820 2.868 2.187 3.400 . 0 0 "[ . 1 . 2]" 1
1434 1 72 MET ME 1 73 ALA H . . 5.500 5.198 4.534 5.520 0.020 7 0 "[ . 1 . 2]" 1
1435 1 72 MET QG 1 73 ALA H . . 4.940 4.153 2.359 4.540 . 0 0 "[ . 1 . 2]" 1
1436 1 73 ALA H 1 73 ALA MB . . 3.190 2.668 2.560 2.834 . 0 0 "[ . 1 . 2]" 1
1437 1 73 ALA H 1 74 PRO HD2 . . 5.000 4.798 4.765 4.816 . 0 0 "[ . 1 . 2]" 1
1438 1 73 ALA H 1 74 PRO QD . . 4.370 4.247 4.167 4.315 . 0 0 "[ . 1 . 2]" 1
1439 1 73 ALA H 1 74 PRO HD3 . . 5.000 4.739 4.600 4.876 . 0 0 "[ . 1 . 2]" 1
1440 1 73 ALA H 1 77 TYR QE . . 4.040 3.766 3.546 3.989 . 0 0 "[ . 1 . 2]" 1
1441 1 73 ALA H 1 77 TYR HH . . 2.990 2.356 1.905 2.930 . 0 0 "[ . 1 . 2]" 1
1442 1 73 ALA H 1 102 ARG HA . . 4.950 4.842 4.251 4.952 0.002 13 0 "[ . 1 . 2]" 1
1443 1 73 ALA HA 1 74 PRO HD2 . . 3.520 2.288 2.235 2.370 . 0 0 "[ . 1 . 2]" 1
1444 1 73 ALA HA 1 74 PRO HD3 . . 3.520 2.267 2.256 2.288 . 0 0 "[ . 1 . 2]" 1
1445 1 73 ALA HA 1 74 PRO QG . . 4.550 3.934 3.903 3.983 . 0 0 "[ . 1 . 2]" 1
1446 1 73 ALA HA 1 102 ARG HA . . 3.330 2.243 2.014 2.399 . 0 0 "[ . 1 . 2]" 1
1447 1 73 ALA HA 1 102 ARG HB2 . . 4.740 4.089 2.435 4.741 0.001 5 0 "[ . 1 . 2]" 1
1448 1 73 ALA HA 1 102 ARG QB . . 4.080 3.592 2.018 3.921 . 0 0 "[ . 1 . 2]" 1
1449 1 73 ALA HA 1 102 ARG HB3 . . 4.740 4.229 2.154 4.728 . 0 0 "[ . 1 . 2]" 1
1450 1 73 ALA HA 1 102 ARG QG . . 3.980 2.488 2.149 3.982 0.002 8 0 "[ . 1 . 2]" 1
1451 1 73 ALA HA 1 103 LEU H . . 3.520 3.371 2.947 3.519 . 0 0 "[ . 1 . 2]" 1
1452 1 73 ALA MB 1 74 PRO HD2 . . 3.720 2.328 2.129 2.511 . 0 0 "[ . 1 . 2]" 1
1453 1 73 ALA MB 1 74 PRO QD . . 3.080 2.291 2.107 2.459 . 0 0 "[ . 1 . 2]" 1
1454 1 73 ALA MB 1 74 PRO HD3 . . 3.720 3.430 3.341 3.517 . 0 0 "[ . 1 . 2]" 1
1455 1 73 ALA MB 1 77 TYR QE . . 4.390 4.289 4.086 4.393 0.003 10 0 "[ . 1 . 2]" 1
1456 1 73 ALA MB 1 77 TYR HH . . 3.640 3.023 2.499 3.541 . 0 0 "[ . 1 . 2]" 1
1457 1 73 ALA MB 1 102 ARG HA . . 4.120 3.476 3.161 3.686 . 0 0 "[ . 1 . 2]" 1
1458 1 73 ALA MB 1 102 ARG QB . . 3.930 3.450 2.273 3.746 . 0 0 "[ . 1 . 2]" 1
1459 1 73 ALA MB 1 102 ARG QD . . 4.040 3.022 2.110 4.022 . 0 0 "[ . 1 . 2]" 1
1460 1 74 PRO HA 1 75 GLY H . . 2.980 2.167 2.155 2.188 . 0 0 "[ . 1 . 2]" 1
1461 1 74 PRO HA 1 75 GLY HA2 . . 4.700 4.382 4.360 4.422 . 0 0 "[ . 1 . 2]" 1
1462 1 74 PRO HA 1 77 TYR QE . . 4.450 3.863 3.532 4.116 . 0 0 "[ . 1 . 2]" 1
1463 1 74 PRO HA 1 98 VAL H . . 4.580 4.406 3.956 4.583 0.003 19 0 "[ . 1 . 2]" 1
1464 1 74 PRO HA 1 98 VAL HB . . 3.660 2.942 2.430 3.191 . 0 0 "[ . 1 . 2]" 1
1465 1 74 PRO HA 1 98 VAL MG1 . . 3.250 2.980 2.448 3.231 . 0 0 "[ . 1 . 2]" 1
1466 1 74 PRO HA 1 98 VAL MG2 . . 4.750 4.486 4.030 4.696 . 0 0 "[ . 1 . 2]" 1
1467 1 74 PRO HA 1 99 THR HA . . 5.250 3.883 3.470 4.248 . 0 0 "[ . 1 . 2]" 1
1468 1 74 PRO QB 1 75 GLY H . . 3.660 3.496 3.305 3.616 . 0 0 "[ . 1 . 2]" 1
1469 1 74 PRO QB 1 99 THR HA . . 3.670 2.941 2.543 3.285 . 0 0 "[ . 1 . 2]" 1
1470 1 74 PRO QB 1 100 GLY H . . 4.090 3.106 2.539 3.511 . 0 0 "[ . 1 . 2]" 1
1471 1 74 PRO HB2 1 75 GLY H . . 4.270 3.759 3.525 3.906 . 0 0 "[ . 1 . 2]" 1
1472 1 74 PRO HB2 1 99 THR HA . . 4.510 3.614 3.177 3.974 . 0 0 "[ . 1 . 2]" 1
1473 1 74 PRO HB3 1 75 GLY H . . 4.270 4.161 3.997 4.267 . 0 0 "[ . 1 . 2]" 1
1474 1 74 PRO HB3 1 99 THR HA . . 4.510 3.117 2.676 3.503 . 0 0 "[ . 1 . 2]" 1
1475 1 74 PRO QD 1 102 ARG H . . 4.190 3.144 2.165 3.595 . 0 0 "[ . 1 . 2]" 1
1476 1 74 PRO QD 1 102 ARG HA . . 3.600 2.152 1.924 2.518 . 0 0 "[ . 1 . 2]" 1
1477 1 74 PRO QD 1 102 ARG QB . . 3.810 3.005 1.888 3.676 . 0 0 "[ . 1 . 2]" 1
1478 1 74 PRO QD 1 102 ARG QG . . 4.170 2.400 1.782 3.694 . 0 0 "[ . 1 . 2]" 1
1479 1 74 PRO QD 1 103 LEU H . . 4.730 3.710 3.378 4.209 . 0 0 "[ . 1 . 2]" 1
1480 1 74 PRO HD2 1 102 ARG H . . 5.030 3.913 3.134 4.344 . 0 0 "[ . 1 . 2]" 1
1481 1 74 PRO HD2 1 102 ARG HA . . 4.160 2.948 2.491 3.357 . 0 0 "[ . 1 . 2]" 1
1482 1 74 PRO HD2 1 102 ARG HB2 . . 4.960 3.553 2.314 4.713 . 0 0 "[ . 1 . 2]" 1
1483 1 74 PRO HD2 1 102 ARG HB3 . . 4.960 4.304 2.001 4.891 . 0 0 "[ . 1 . 2]" 1
1484 1 74 PRO HD2 1 102 ARG QG . . 4.960 2.503 1.808 4.013 . 0 0 "[ . 1 . 2]" 1
1485 1 74 PRO HD3 1 102 ARG H . . 5.030 3.319 2.207 3.835 . 0 0 "[ . 1 . 2]" 1
1486 1 74 PRO HD3 1 102 ARG HA . . 4.160 2.217 2.002 2.648 . 0 0 "[ . 1 . 2]" 1
1487 1 74 PRO HD3 1 102 ARG HB2 . . 4.960 3.860 3.125 4.616 . 0 0 "[ . 1 . 2]" 1
1488 1 74 PRO HD3 1 102 ARG HB3 . . 4.960 4.481 2.375 4.950 . 0 0 "[ . 1 . 2]" 1
1489 1 74 PRO HD3 1 102 ARG QG . . 4.960 3.197 2.434 4.376 . 0 0 "[ . 1 . 2]" 1
1490 1 74 PRO QG 1 102 ARG HA . . 5.340 3.879 3.597 4.235 . 0 0 "[ . 1 . 2]" 1
1491 1 75 GLY H 1 76 ASN H . . 4.370 4.327 4.195 4.373 0.003 8 0 "[ . 1 . 2]" 1
1492 1 75 GLY H 1 77 TYR QD . . 4.660 4.073 3.885 4.411 . 0 0 "[ . 1 . 2]" 1
1493 1 75 GLY H 1 77 TYR QE . . 4.140 2.998 2.605 3.441 . 0 0 "[ . 1 . 2]" 1
1494 1 75 GLY H 1 97 LYS HA . . 4.710 4.551 4.209 4.706 . 0 0 "[ . 1 . 2]" 1
1495 1 75 GLY H 1 98 VAL H . . 3.520 2.999 2.555 3.165 . 0 0 "[ . 1 . 2]" 1
1496 1 75 GLY H 1 98 VAL HB . . 3.190 2.614 2.298 2.860 . 0 0 "[ . 1 . 2]" 1
1497 1 75 GLY H 1 98 VAL MG1 . . 4.130 3.824 3.378 4.099 . 0 0 "[ . 1 . 2]" 1
1498 1 75 GLY H 1 98 VAL MG2 . . 4.200 3.961 3.469 4.200 . 0 0 "[ . 1 . 2]" 1
1499 1 75 GLY HA2 1 76 ASN H . . 3.150 2.780 2.655 2.980 . 0 0 "[ . 1 . 2]" 1
1500 1 75 GLY HA2 1 76 ASN HA . . 5.250 4.408 4.375 4.469 . 0 0 "[ . 1 . 2]" 1
1501 1 75 GLY HA3 1 76 ASN H . . 2.960 2.370 2.228 2.474 . 0 0 "[ . 1 . 2]" 1
1502 1 75 GLY HA3 1 77 TYR QE . . 5.230 4.142 3.473 4.377 . 0 0 "[ . 1 . 2]" 1
1503 1 76 ASN H 1 76 ASN QB . . 3.060 2.718 2.389 2.962 . 0 0 "[ . 1 . 2]" 1
1504 1 76 ASN H 1 76 ASN HD21 . . 5.080 3.224 2.198 4.836 . 0 0 "[ . 1 . 2]" 1
1505 1 76 ASN H 1 76 ASN QD . . 4.340 3.032 2.156 4.301 . 0 0 "[ . 1 . 2]" 1
1506 1 76 ASN H 1 76 ASN HD22 . . 5.080 3.864 2.976 5.079 . 0 0 "[ . 1 . 2]" 1
1507 1 76 ASN H 1 77 TYR H . . 4.330 4.182 4.014 4.337 0.007 12 0 "[ . 1 . 2]" 1
1508 1 76 ASN HA 1 77 TYR H . . 2.810 2.167 2.140 2.217 . 0 0 "[ . 1 . 2]" 1
1509 1 76 ASN HA 1 77 TYR HA . . 4.490 4.419 4.390 4.464 . 0 0 "[ . 1 . 2]" 1
1510 1 76 ASN HA 1 77 TYR QD . . 4.340 3.658 3.133 3.974 . 0 0 "[ . 1 . 2]" 1
1511 1 76 ASN HA 1 96 ALA H . . 4.680 4.275 3.929 4.571 . 0 0 "[ . 1 . 2]" 1
1512 1 76 ASN HA 1 97 LYS HA . . 3.650 2.429 2.180 2.724 . 0 0 "[ . 1 . 2]" 1
1513 1 76 ASN HA 1 98 VAL H . . 4.100 3.543 3.351 3.786 . 0 0 "[ . 1 . 2]" 1
1514 1 76 ASN QB 1 77 TYR H . . 3.690 3.547 3.365 3.694 0.004 12 0 "[ . 1 . 2]" 1
1515 1 76 ASN QB 1 95 LYS QG . . 4.070 2.636 2.094 3.552 . 0 0 "[ . 1 . 2]" 1
1516 1 76 ASN QB 1 96 ALA H . . 5.030 4.221 3.825 5.005 . 0 0 "[ . 1 . 2]" 1
1517 1 76 ASN HB2 1 77 TYR H . . 4.420 4.117 3.671 4.400 . 0 0 "[ . 1 . 2]" 1
1518 1 76 ASN HB3 1 77 TYR H . . 4.420 3.983 3.518 4.421 0.001 12 0 "[ . 1 . 2]" 1
1519 1 77 TYR H 1 77 TYR HB2 . . 3.450 2.426 2.391 2.546 . 0 0 "[ . 1 . 2]" 1
1520 1 77 TYR H 1 77 TYR QD . . 3.400 2.358 2.107 2.520 . 0 0 "[ . 1 . 2]" 1
1521 1 77 TYR H 1 77 TYR QE . . 4.930 4.500 4.222 4.674 . 0 0 "[ . 1 . 2]" 1
1522 1 77 TYR H 1 78 LEU H . . 4.590 4.387 4.273 4.504 . 0 0 "[ . 1 . 2]" 1
1523 1 77 TYR H 1 96 ALA H . . 3.640 3.378 3.101 3.610 . 0 0 "[ . 1 . 2]" 1
1524 1 77 TYR H 1 96 ALA MB . . 4.000 3.093 2.854 3.320 . 0 0 "[ . 1 . 2]" 1
1525 1 77 TYR H 1 97 LYS HA . . 3.770 3.579 3.432 3.739 . 0 0 "[ . 1 . 2]" 1
1526 1 77 TYR HA 1 77 TYR QD . . 4.180 3.032 2.907 3.176 . 0 0 "[ . 1 . 2]" 1
1527 1 77 TYR HA 1 77 TYR QE . . 4.940 4.657 4.607 4.741 . 0 0 "[ . 1 . 2]" 1
1528 1 77 TYR HA 1 78 LEU H . . 2.780 2.145 2.138 2.177 . 0 0 "[ . 1 . 2]" 1
1529 1 77 TYR HA 1 78 LEU HB2 . . 5.090 4.334 4.213 4.434 . 0 0 "[ . 1 . 2]" 1
1530 1 77 TYR HA 1 78 LEU QB . . 4.320 4.045 3.988 4.081 . 0 0 "[ . 1 . 2]" 1
1531 1 77 TYR HA 1 78 LEU HB3 . . 5.090 4.848 4.760 4.934 . 0 0 "[ . 1 . 2]" 1
1532 1 77 TYR HB2 1 78 LEU H . . 4.480 4.352 4.172 4.428 . 0 0 "[ . 1 . 2]" 1
1533 1 77 TYR HB2 1 79 ILE HG13 . . 4.910 3.889 3.563 4.156 . 0 0 "[ . 1 . 2]" 1
1534 1 77 TYR HB2 1 96 ALA H . . 4.420 3.962 3.656 4.152 . 0 0 "[ . 1 . 2]" 1
1535 1 77 TYR HB2 1 96 ALA MB . . 3.450 2.410 2.136 2.674 . 0 0 "[ . 1 . 2]" 1
1536 1 77 TYR HB3 1 78 LEU H . . 3.710 3.517 3.128 3.706 . 0 0 "[ . 1 . 2]" 1
1537 1 77 TYR HB3 1 79 ILE HG13 . . 5.500 3.727 3.517 3.936 . 0 0 "[ . 1 . 2]" 1
1538 1 77 TYR HB3 1 96 ALA H . . 5.500 4.966 4.736 5.207 . 0 0 "[ . 1 . 2]" 1
1539 1 77 TYR HB3 1 96 ALA MB . . 3.950 3.712 3.432 3.946 . 0 0 "[ . 1 . 2]" 1
1540 1 77 TYR QD 1 77 TYR HH . . 4.600 4.288 4.242 4.351 . 0 0 "[ . 1 . 2]" 1
1541 1 77 TYR QD 1 78 LEU H . . 4.530 4.381 4.141 4.528 . 0 0 "[ . 1 . 2]" 1
1542 1 77 TYR QD 1 96 ALA H . . 5.500 5.182 4.912 5.455 . 0 0 "[ . 1 . 2]" 1
1543 1 77 TYR QD 1 96 ALA MB . . 4.380 3.587 3.250 3.817 . 0 0 "[ . 1 . 2]" 1
1544 1 77 TYR QD 1 98 VAL H . . 4.110 3.424 3.127 3.716 . 0 0 "[ . 1 . 2]" 1
1545 1 77 TYR QD 1 98 VAL HB . . 4.060 3.521 3.222 3.868 . 0 0 "[ . 1 . 2]" 1
1546 1 77 TYR QD 1 98 VAL MG2 . . 3.570 2.497 2.213 3.177 . 0 0 "[ . 1 . 2]" 1
1547 1 77 TYR QE 1 77 TYR HH . . 3.250 2.374 2.195 2.630 . 0 0 "[ . 1 . 2]" 1
1548 1 77 TYR QE 1 98 VAL H . . 4.300 4.034 3.516 4.260 . 0 0 "[ . 1 . 2]" 1
1549 1 77 TYR QE 1 98 VAL HB . . 3.360 2.684 2.377 2.910 . 0 0 "[ . 1 . 2]" 1
1550 1 77 TYR QE 1 98 VAL MG1 . . 3.980 3.682 3.446 3.945 . 0 0 "[ . 1 . 2]" 1
1551 1 77 TYR QE 1 98 VAL MG2 . . 3.580 2.903 2.348 3.502 . 0 0 "[ . 1 . 2]" 1
1552 1 78 LEU H 1 78 LEU HB2 . . 3.410 2.378 2.284 2.464 . 0 0 "[ . 1 . 2]" 1
1553 1 78 LEU H 1 78 LEU QB . . 2.980 2.235 2.184 2.281 . 0 0 "[ . 1 . 2]" 1
1554 1 78 LEU H 1 78 LEU HB3 . . 3.410 2.722 2.633 2.793 . 0 0 "[ . 1 . 2]" 1
1555 1 78 LEU H 1 78 LEU MD1 . . 4.430 4.187 4.108 4.254 . 0 0 "[ . 1 . 2]" 1
1556 1 78 LEU H 1 78 LEU MD2 . . 4.510 3.888 3.745 4.043 . 0 0 "[ . 1 . 2]" 1
1557 1 78 LEU H 1 78 LEU HG . . 4.720 4.626 4.586 4.675 . 0 0 "[ . 1 . 2]" 1
1558 1 78 LEU H 1 79 ILE H . . 4.570 4.393 4.263 4.460 . 0 0 "[ . 1 . 2]" 1
1559 1 78 LEU HA 1 78 LEU MD1 . . 3.720 2.566 2.329 2.918 . 0 0 "[ . 1 . 2]" 1
1560 1 78 LEU HA 1 78 LEU MD2 . . 3.560 2.122 1.972 2.354 . 0 0 "[ . 1 . 2]" 1
1561 1 78 LEU HA 1 79 ILE H . . 2.830 2.147 2.139 2.180 . 0 0 "[ . 1 . 2]" 1
1562 1 78 LEU HA 1 79 ILE HB . . 4.810 4.609 4.526 4.673 . 0 0 "[ . 1 . 2]" 1
1563 1 78 LEU HA 1 79 ILE HG13 . . 4.990 3.947 3.799 4.175 . 0 0 "[ . 1 . 2]" 1
1564 1 78 LEU HA 1 95 LYS HA . . 3.930 2.865 2.480 3.236 . 0 0 "[ . 1 . 2]" 1
1565 1 78 LEU HA 1 96 ALA H . . 4.020 3.540 3.108 3.867 . 0 0 "[ . 1 . 2]" 1
1566 1 78 LEU QB 1 78 LEU MD2 . . 3.030 2.231 2.104 2.328 . 0 0 "[ . 1 . 2]" 1
1567 1 78 LEU QB 1 79 ILE H . . 3.920 3.842 3.781 3.921 0.001 14 0 "[ . 1 . 2]" 1
1568 1 78 LEU HB2 1 78 LEU MD1 . . 3.380 3.184 3.169 3.194 . 0 0 "[ . 1 . 2]" 1
1569 1 78 LEU HB2 1 78 LEU MD2 . . 3.630 2.279 2.136 2.393 . 0 0 "[ . 1 . 2]" 1
1570 1 78 LEU HB2 1 79 ILE H . . 4.630 4.485 4.424 4.568 . 0 0 "[ . 1 . 2]" 1
1571 1 78 LEU HB3 1 78 LEU MD1 . . 3.380 2.349 2.172 2.514 . 0 0 "[ . 1 . 2]" 1
1572 1 78 LEU HB3 1 78 LEU MD2 . . 3.630 3.181 3.154 3.195 . 0 0 "[ . 1 . 2]" 1
1573 1 78 LEU HB3 1 79 ILE H . . 4.630 4.179 4.083 4.277 . 0 0 "[ . 1 . 2]" 1
1574 1 78 LEU MD1 1 79 ILE H . . 4.160 2.448 2.179 3.170 . 0 0 "[ . 1 . 2]" 1
1575 1 78 LEU MD1 1 80 ALA H . . 4.210 3.189 2.912 3.516 . 0 0 "[ . 1 . 2]" 1
1576 1 78 LEU MD1 1 93 PRO HB2 . . 4.160 1.962 1.832 2.186 . 0 0 "[ . 1 . 2]" 1
1577 1 78 LEU MD1 1 93 PRO QB . . 3.610 1.847 1.757 1.950 . 0 0 "[ . 1 . 2]" 1
1578 1 78 LEU MD1 1 93 PRO HB3 . . 4.160 2.270 2.108 2.350 . 0 0 "[ . 1 . 2]" 1
1579 1 78 LEU MD1 1 93 PRO HD3 . . 4.710 4.600 4.423 4.710 . 0 0 "[ . 1 . 2]" 1
1580 1 78 LEU MD1 1 93 PRO QG . . 3.540 2.892 2.600 3.150 . 0 0 "[ . 1 . 2]" 1
1581 1 78 LEU MD1 1 95 LYS QE . . 4.850 4.626 4.237 4.836 . 0 0 "[ . 1 . 2]" 1
1582 1 78 LEU MD2 1 79 ILE H . . 4.420 3.248 2.718 3.607 . 0 0 "[ . 1 . 2]" 1
1583 1 78 LEU MD2 1 93 PRO HB2 . . 4.270 2.639 2.261 2.934 . 0 0 "[ . 1 . 2]" 1
1584 1 78 LEU MD2 1 93 PRO QB . . 3.520 2.590 2.237 2.869 . 0 0 "[ . 1 . 2]" 1
1585 1 78 LEU MD2 1 93 PRO HB3 . . 4.270 3.799 3.428 4.055 . 0 0 "[ . 1 . 2]" 1
1586 1 78 LEU MD2 1 93 PRO HD3 . . 5.440 5.324 5.090 5.446 0.006 17 0 "[ . 1 . 2]" 1
1587 1 78 LEU MD2 1 93 PRO QG . . 3.640 2.941 2.731 3.084 . 0 0 "[ . 1 . 2]" 1
1588 1 78 LEU MD2 1 95 LYS H . . 4.630 4.301 3.587 4.634 0.004 4 0 "[ . 1 . 2]" 1
1589 1 78 LEU MD2 1 95 LYS HA . . 3.800 2.928 2.276 3.265 . 0 0 "[ . 1 . 2]" 1
1590 1 78 LEU MD2 1 95 LYS QD . . 4.270 3.310 1.807 4.224 . 0 0 "[ . 1 . 2]" 1
1591 1 78 LEU MD2 1 95 LYS QE . . 4.060 2.414 1.964 2.772 . 0 0 "[ . 1 . 2]" 1
1592 1 78 LEU MD2 1 96 ALA H . . 4.790 4.357 3.791 4.720 . 0 0 "[ . 1 . 2]" 1
1593 1 79 ILE H 1 79 ILE HB . . 3.450 2.501 2.408 2.566 . 0 0 "[ . 1 . 2]" 1
1594 1 79 ILE H 1 79 ILE MD . . 4.240 3.628 3.451 3.951 . 0 0 "[ . 1 . 2]" 1
1595 1 79 ILE H 1 79 ILE HG12 . . 4.190 3.942 3.773 4.115 . 0 0 "[ . 1 . 2]" 1
1596 1 79 ILE H 1 79 ILE HG13 . . 3.590 2.632 2.525 2.793 . 0 0 "[ . 1 . 2]" 1
1597 1 79 ILE H 1 79 ILE MG . . 3.810 3.787 3.735 3.818 0.008 11 0 "[ . 1 . 2]" 1
1598 1 79 ILE H 1 80 ALA H . . 4.830 4.244 4.138 4.366 . 0 0 "[ . 1 . 2]" 1
1599 1 79 ILE H 1 94 PHE H . . 3.750 3.350 3.163 3.711 . 0 0 "[ . 1 . 2]" 1
1600 1 79 ILE H 1 94 PHE HB2 . . 4.270 3.838 3.631 3.969 . 0 0 "[ . 1 . 2]" 1
1601 1 79 ILE H 1 94 PHE HB3 . . 4.860 4.608 4.392 4.772 . 0 0 "[ . 1 . 2]" 1
1602 1 79 ILE H 1 94 PHE QD . . 5.500 5.399 5.157 5.503 0.003 9 0 "[ . 1 . 2]" 1
1603 1 79 ILE H 1 95 LYS H . . 5.080 4.897 4.682 5.008 . 0 0 "[ . 1 . 2]" 1
1604 1 79 ILE H 1 95 LYS HA . . 4.470 3.388 3.126 3.564 . 0 0 "[ . 1 . 2]" 1
1605 1 79 ILE H 1 96 ALA H . . 4.990 3.910 3.630 4.134 . 0 0 "[ . 1 . 2]" 1
1606 1 79 ILE HA 1 79 ILE MD . . 4.200 3.857 3.794 3.894 . 0 0 "[ . 1 . 2]" 1
1607 1 79 ILE HA 1 79 ILE HG12 . . 4.200 2.651 2.461 2.761 . 0 0 "[ . 1 . 2]" 1
1608 1 79 ILE HA 1 79 ILE HG13 . . 4.230 2.813 2.588 2.991 . 0 0 "[ . 1 . 2]" 1
1609 1 79 ILE HA 1 79 ILE MG . . 3.300 2.412 2.351 2.470 . 0 0 "[ . 1 . 2]" 1
1610 1 79 ILE HA 1 80 ALA H . . 2.930 2.164 2.139 2.186 . 0 0 "[ . 1 . 2]" 1
1611 1 79 ILE HA 1 80 ALA MB . . 4.390 4.021 3.948 4.096 . 0 0 "[ . 1 . 2]" 1
1612 1 79 ILE HB 1 79 ILE MD . . 3.390 2.323 2.118 2.466 . 0 0 "[ . 1 . 2]" 1
1613 1 79 ILE HB 1 80 ALA H . . 5.000 4.402 4.296 4.455 . 0 0 "[ . 1 . 2]" 1
1614 1 79 ILE HB 1 94 PHE H . . 3.760 3.372 3.051 3.667 . 0 0 "[ . 1 . 2]" 1
1615 1 79 ILE HB 1 94 PHE HA . . 5.270 4.767 4.463 5.194 . 0 0 "[ . 1 . 2]" 1
1616 1 79 ILE HB 1 94 PHE HB2 . . 3.650 2.287 2.093 2.641 . 0 0 "[ . 1 . 2]" 1
1617 1 79 ILE HB 1 94 PHE HB3 . . 3.910 3.388 2.962 3.820 . 0 0 "[ . 1 . 2]" 1
1618 1 79 ILE HB 1 94 PHE QD . . 4.140 3.974 3.786 4.140 . 0 0 "[ . 1 . 2]" 1
1619 1 79 ILE MD 1 81 ILE HG13 . . 5.290 5.137 4.899 5.296 0.006 9 0 "[ . 1 . 2]" 1
1620 1 79 ILE MD 1 94 PHE HB2 . . 3.870 3.491 3.213 3.829 . 0 0 "[ . 1 . 2]" 1
1621 1 79 ILE MD 1 94 PHE HB3 . . 4.390 3.609 3.205 4.165 . 0 0 "[ . 1 . 2]" 1
1622 1 79 ILE MD 1 96 ALA H . . 4.150 3.897 3.219 4.102 . 0 0 "[ . 1 . 2]" 1
1623 1 79 ILE MD 1 96 ALA HA . . 5.500 4.113 3.755 4.409 . 0 0 "[ . 1 . 2]" 1
1624 1 79 ILE MD 1 96 ALA MB . . 2.960 1.982 1.735 2.245 . 0 0 "[ . 1 . 2]" 1
1625 1 79 ILE HG13 1 79 ILE MG . . 3.330 3.174 3.150 3.197 . 0 0 "[ . 1 . 2]" 1
1626 1 79 ILE HG13 1 96 ALA H . . 4.730 4.080 3.519 4.623 . 0 0 "[ . 1 . 2]" 1
1627 1 79 ILE HG13 1 96 ALA MB . . 4.130 2.997 2.563 3.335 . 0 0 "[ . 1 . 2]" 1
1628 1 79 ILE MG 1 80 ALA H . . 3.520 2.997 2.717 3.208 . 0 0 "[ . 1 . 2]" 1
1629 1 79 ILE MG 1 80 ALA HA . . 4.600 3.920 3.747 4.047 . 0 0 "[ . 1 . 2]" 1
1630 1 79 ILE MG 1 81 ILE H . . 5.080 4.190 3.674 4.657 . 0 0 "[ . 1 . 2]" 1
1631 1 79 ILE MG 1 81 ILE MD . . 3.160 2.289 1.988 2.635 . 0 0 "[ . 1 . 2]" 1
1632 1 79 ILE MG 1 81 ILE HG12 . . 4.000 3.049 2.878 3.297 . 0 0 "[ . 1 . 2]" 1
1633 1 79 ILE MG 1 81 ILE HG13 . . 3.420 2.266 1.955 2.667 . 0 0 "[ . 1 . 2]" 1
1634 1 79 ILE MG 1 94 PHE H . . 4.570 3.964 3.663 4.295 . 0 0 "[ . 1 . 2]" 1
1635 1 79 ILE MG 1 94 PHE HB2 . . 4.210 3.010 2.523 3.470 . 0 0 "[ . 1 . 2]" 1
1636 1 79 ILE MG 1 94 PHE HB3 . . 4.790 4.202 3.698 4.700 . 0 0 "[ . 1 . 2]" 1
1637 1 79 ILE MG 1 94 PHE QD . . 4.060 3.411 2.921 3.803 . 0 0 "[ . 1 . 2]" 1
1638 1 80 ALA H 1 80 ALA MB . . 3.170 2.234 2.117 2.313 . 0 0 "[ . 1 . 2]" 1
1639 1 80 ALA H 1 81 ILE H . . 5.260 4.451 4.271 4.581 . 0 0 "[ . 1 . 2]" 1
1640 1 80 ALA H 1 81 ILE HG13 . . 5.040 4.318 4.198 4.449 . 0 0 "[ . 1 . 2]" 1
1641 1 80 ALA HA 1 81 ILE H . . 3.140 2.161 2.141 2.239 . 0 0 "[ . 1 . 2]" 1
1642 1 80 ALA HA 1 81 ILE HB . . 4.780 4.621 4.522 4.699 . 0 0 "[ . 1 . 2]" 1
1643 1 80 ALA HA 1 81 ILE HG13 . . 4.800 3.737 3.489 4.129 . 0 0 "[ . 1 . 2]" 1
1644 1 80 ALA HA 1 88 HIS HD1 . . 4.300 3.243 2.567 3.615 . 0 0 "[ . 1 . 2]" 1
1645 1 80 ALA HA 1 88 HIS HE1 . . 4.580 3.067 2.621 3.701 . 0 0 "[ . 1 . 2]" 1
1646 1 80 ALA HA 1 93 PRO HA . . 3.750 2.979 2.631 3.272 . 0 0 "[ . 1 . 2]" 1
1647 1 80 ALA HA 1 93 PRO HB2 . . 4.720 3.903 3.530 4.226 . 0 0 "[ . 1 . 2]" 1
1648 1 80 ALA HA 1 93 PRO QB . . 4.120 2.920 2.533 3.235 . 0 0 "[ . 1 . 2]" 1
1649 1 80 ALA HA 1 93 PRO HB3 . . 4.720 3.016 2.596 3.358 . 0 0 "[ . 1 . 2]" 1
1650 1 80 ALA HA 1 94 PHE H . . 4.370 3.585 3.272 3.853 . 0 0 "[ . 1 . 2]" 1
1651 1 80 ALA MB 1 81 ILE H . . 3.790 3.156 2.824 3.379 . 0 0 "[ . 1 . 2]" 1
1652 1 80 ALA MB 1 81 ILE HG13 . . 5.160 4.500 4.311 4.735 . 0 0 "[ . 1 . 2]" 1
1653 1 80 ALA MB 1 82 LYS QE . . 3.730 3.378 3.060 3.700 . 0 0 "[ . 1 . 2]" 1
1654 1 80 ALA MB 1 82 LYS HG3 . . 4.620 3.643 3.436 3.747 . 0 0 "[ . 1 . 2]" 1
1655 1 80 ALA MB 1 88 HIS HD1 . . 4.400 3.572 3.129 4.093 . 0 0 "[ . 1 . 2]" 1
1656 1 80 ALA MB 1 88 HIS HE1 . . 3.280 2.177 1.903 2.683 . 0 0 "[ . 1 . 2]" 1
1657 1 80 ALA MB 1 93 PRO HA . . 4.480 4.248 3.796 4.481 0.001 16 0 "[ . 1 . 2]" 1
1658 1 80 ALA MB 1 93 PRO QB . . 3.580 3.298 2.914 3.580 . 0 0 "[ . 1 . 2]" 1
1659 1 80 ALA MB 1 94 PHE H . . 5.030 4.817 4.509 5.043 0.013 15 0 "[ . 1 . 2]" 1
1660 1 81 ILE H 1 81 ILE HB . . 3.900 2.720 2.531 2.916 . 0 0 "[ . 1 . 2]" 1
1661 1 81 ILE H 1 81 ILE MD . . 4.660 3.953 3.639 4.319 . 0 0 "[ . 1 . 2]" 1
1662 1 81 ILE H 1 81 ILE HG12 . . 4.770 4.115 3.912 4.287 . 0 0 "[ . 1 . 2]" 1
1663 1 81 ILE H 1 81 ILE HG13 . . 3.830 2.887 2.670 3.089 . 0 0 "[ . 1 . 2]" 1
1664 1 81 ILE H 1 81 ILE MG . . 4.360 3.875 3.771 3.948 . 0 0 "[ . 1 . 2]" 1
1665 1 81 ILE H 1 82 LYS H . . 4.820 4.215 3.885 4.496 . 0 0 "[ . 1 . 2]" 1
1666 1 81 ILE H 1 88 HIS HD1 . . 3.620 3.111 2.166 3.531 . 0 0 "[ . 1 . 2]" 1
1667 1 81 ILE H 1 88 HIS HE1 . . 5.000 4.144 3.663 4.656 . 0 0 "[ . 1 . 2]" 1
1668 1 81 ILE H 1 92 SER HB2 . . 4.310 3.817 2.631 4.103 . 0 0 "[ . 1 . 2]" 1
1669 1 81 ILE H 1 92 SER HB3 . . 4.310 2.802 2.444 3.136 . 0 0 "[ . 1 . 2]" 1
1670 1 81 ILE H 1 93 PRO HA . . 4.340 3.288 3.042 3.555 . 0 0 "[ . 1 . 2]" 1
1671 1 81 ILE HA 1 81 ILE MD . . 4.520 3.873 3.833 3.908 . 0 0 "[ . 1 . 2]" 1
1672 1 81 ILE HA 1 81 ILE HG12 . . 4.240 2.657 2.539 2.761 . 0 0 "[ . 1 . 2]" 1
1673 1 81 ILE HA 1 81 ILE MG . . 3.400 2.378 2.282 2.499 . 0 0 "[ . 1 . 2]" 1
1674 1 81 ILE HA 1 82 LYS H . . 2.850 2.149 2.138 2.199 . 0 0 "[ . 1 . 2]" 1
1675 1 81 ILE HB 1 81 ILE MD . . 3.290 2.294 2.191 2.459 . 0 0 "[ . 1 . 2]" 1
1676 1 81 ILE HB 1 82 LYS H . . 4.540 4.246 4.040 4.383 . 0 0 "[ . 1 . 2]" 1
1677 1 81 ILE HB 1 89 ILE H . . 4.580 4.307 3.778 4.563 . 0 0 "[ . 1 . 2]" 1
1678 1 81 ILE HB 1 89 ILE MD . . 3.360 2.979 2.642 3.292 . 0 0 "[ . 1 . 2]" 1
1679 1 81 ILE HB 1 89 ILE QG . . 3.500 2.697 2.427 2.844 . 0 0 "[ . 1 . 2]" 1
1680 1 81 ILE HB 1 92 SER HB2 . . 4.860 3.744 3.394 4.038 . 0 0 "[ . 1 . 2]" 1
1681 1 81 ILE HB 1 92 SER QB . . 4.120 3.308 2.381 3.621 . 0 0 "[ . 1 . 2]" 1
1682 1 81 ILE HB 1 92 SER HB3 . . 4.860 3.719 2.431 4.157 . 0 0 "[ . 1 . 2]" 1
1683 1 81 ILE HB 1 94 PHE QE . . 4.260 3.185 2.749 3.562 . 0 0 "[ . 1 . 2]" 1
1684 1 81 ILE MD 1 81 ILE MG . . 2.790 2.172 1.950 2.361 . 0 0 "[ . 1 . 2]" 1
1685 1 81 ILE MD 1 89 ILE QG . . 4.030 3.902 3.657 4.013 . 0 0 "[ . 1 . 2]" 1
1686 1 81 ILE MD 1 92 SER QB . . 4.560 4.278 3.251 4.537 . 0 0 "[ . 1 . 2]" 1
1687 1 81 ILE MD 1 94 PHE QD . . 3.790 2.140 1.899 2.449 . 0 0 "[ . 1 . 2]" 1
1688 1 81 ILE MD 1 94 PHE QE . . 3.500 2.615 2.132 2.934 . 0 0 "[ . 1 . 2]" 1
1689 1 81 ILE MD 1 94 PHE HZ . . 4.700 4.408 4.064 4.672 . 0 0 "[ . 1 . 2]" 1
1690 1 81 ILE HG12 1 81 ILE MG . . 3.090 2.252 2.109 2.374 . 0 0 "[ . 1 . 2]" 1
1691 1 81 ILE HG13 1 81 ILE MG . . 3.390 3.182 3.157 3.199 . 0 0 "[ . 1 . 2]" 1
1692 1 81 ILE HG13 1 92 SER QB . . 5.090 4.567 3.464 5.035 . 0 0 "[ . 1 . 2]" 1
1693 1 81 ILE MG 1 82 LYS H . . 3.750 2.695 2.328 3.078 . 0 0 "[ . 1 . 2]" 1
1694 1 81 ILE MG 1 83 TYR HB2 . . 5.230 3.842 3.678 3.956 . 0 0 "[ . 1 . 2]" 1
1695 1 81 ILE MG 1 83 TYR QB . . 4.490 3.729 3.561 3.834 . 0 0 "[ . 1 . 2]" 1
1696 1 81 ILE MG 1 83 TYR HB3 . . 5.230 5.043 4.751 5.218 . 0 0 "[ . 1 . 2]" 1
1697 1 81 ILE MG 1 89 ILE HB . . 4.780 4.558 4.200 4.779 . 0 0 "[ . 1 . 2]" 1
1698 1 81 ILE MG 1 89 ILE QG . . 3.670 2.611 2.018 2.925 . 0 0 "[ . 1 . 2]" 1
1699 1 81 ILE MG 1 94 PHE QE . . 4.850 3.847 3.270 4.157 . 0 0 "[ . 1 . 2]" 1
1700 1 82 LYS H 1 82 LYS HB2 . . 3.930 2.675 2.582 2.775 . 0 0 "[ . 1 . 2]" 1
1701 1 82 LYS H 1 82 LYS HB3 . . 4.010 3.787 3.738 3.841 . 0 0 "[ . 1 . 2]" 1
1702 1 82 LYS H 1 82 LYS QD . . 4.830 4.553 4.424 4.700 . 0 0 "[ . 1 . 2]" 1
1703 1 82 LYS H 1 82 LYS HG2 . . 4.370 3.703 3.412 4.104 . 0 0 "[ . 1 . 2]" 1
1704 1 82 LYS H 1 82 LYS HG3 . . 3.820 3.016 2.865 3.269 . 0 0 "[ . 1 . 2]" 1
1705 1 82 LYS H 1 83 TYR H . . 4.680 4.476 4.438 4.508 . 0 0 "[ . 1 . 2]" 1
1706 1 82 LYS HA 1 82 LYS HG2 . . 4.230 2.476 2.393 2.564 . 0 0 "[ . 1 . 2]" 1
1707 1 82 LYS HA 1 83 TYR H . . 2.910 2.400 2.311 2.513 . 0 0 "[ . 1 . 2]" 1
1708 1 82 LYS HA 1 88 HIS HA . . 4.080 2.944 2.574 3.302 . 0 0 "[ . 1 . 2]" 1
1709 1 82 LYS HA 1 89 ILE H . . 3.860 2.920 2.641 3.268 . 0 0 "[ . 1 . 2]" 1
1710 1 82 LYS HA 1 89 ILE MG . . 4.040 2.281 1.985 2.564 . 0 0 "[ . 1 . 2]" 1
1711 1 82 LYS HB2 1 82 LYS QD . . 3.910 2.549 2.375 2.680 . 0 0 "[ . 1 . 2]" 1
1712 1 82 LYS HB2 1 83 TYR H . . 3.660 3.574 3.272 3.664 0.004 13 0 "[ . 1 . 2]" 1
1713 1 82 LYS HB3 1 82 LYS QD . . 3.890 2.286 2.197 2.401 . 0 0 "[ . 1 . 2]" 1
1714 1 82 LYS HB3 1 83 TYR H . . 4.020 2.456 2.203 2.701 . 0 0 "[ . 1 . 2]" 1
1715 1 82 LYS HB3 1 87 GLN H . . 4.800 4.592 4.167 4.801 0.001 5 0 "[ . 1 . 2]" 1
1716 1 82 LYS QD 1 83 TYR H . . 4.560 4.313 4.083 4.543 . 0 0 "[ . 1 . 2]" 1
1717 1 82 LYS QD 1 85 GLY H . . 5.500 5.196 4.582 5.463 . 0 0 "[ . 1 . 2]" 1
1718 1 82 LYS QD 1 86 PRO HA . . 3.560 2.880 2.397 3.563 0.003 15 0 "[ . 1 . 2]" 1
1719 1 82 LYS QD 1 87 GLN H . . 4.320 3.703 3.309 4.231 . 0 0 "[ . 1 . 2]" 1
1720 1 82 LYS QD 1 87 GLN HA . . 4.620 3.377 2.909 3.876 . 0 0 "[ . 1 . 2]" 1
1721 1 82 LYS QD 1 89 ILE H . . 5.370 5.271 4.935 5.377 0.007 17 0 "[ . 1 . 2]" 1
1722 1 82 LYS QE 1 82 LYS HG2 . . 3.630 2.689 2.434 3.228 . 0 0 "[ . 1 . 2]" 1
1723 1 82 LYS QE 1 82 LYS HG3 . . 3.580 2.317 2.095 2.665 . 0 0 "[ . 1 . 2]" 1
1724 1 82 LYS QE 1 88 HIS HD2 . . 4.780 3.165 2.354 4.748 . 0 0 "[ . 1 . 2]" 1
1725 1 82 LYS QE 1 88 HIS HE1 . . 4.580 3.962 3.317 4.543 . 0 0 "[ . 1 . 2]" 1
1726 1 82 LYS HE2 1 82 LYS HG2 . . 4.160 3.152 2.705 3.843 . 0 0 "[ . 1 . 2]" 1
1727 1 82 LYS HE2 1 82 LYS HG3 . . 4.190 2.987 2.114 3.713 . 0 0 "[ . 1 . 2]" 1
1728 1 82 LYS HE3 1 82 LYS HG2 . . 4.160 3.186 2.472 3.960 . 0 0 "[ . 1 . 2]" 1
1729 1 82 LYS HE3 1 82 LYS HG3 . . 4.190 2.653 2.137 3.534 . 0 0 "[ . 1 . 2]" 1
1730 1 82 LYS HG2 1 83 TYR H . . 4.450 4.194 3.896 4.445 . 0 0 "[ . 1 . 2]" 1
1731 1 82 LYS HG2 1 88 HIS H . . 4.760 4.310 3.856 4.740 . 0 0 "[ . 1 . 2]" 1
1732 1 82 LYS HG2 1 88 HIS HA . . 4.070 2.192 1.998 2.583 . 0 0 "[ . 1 . 2]" 1
1733 1 82 LYS HG2 1 89 ILE H . . 4.490 3.778 3.501 4.143 . 0 0 "[ . 1 . 2]" 1
1734 1 82 LYS HG3 1 83 TYR H . . 5.320 4.984 4.761 5.158 . 0 0 "[ . 1 . 2]" 1
1735 1 82 LYS HG3 1 88 HIS HA . . 4.480 3.852 3.379 4.238 . 0 0 "[ . 1 . 2]" 1
1736 1 83 TYR H 1 83 TYR HB2 . . 4.150 3.280 3.212 3.387 . 0 0 "[ . 1 . 2]" 1
1737 1 83 TYR H 1 83 TYR QB . . 3.390 2.852 2.693 2.934 . 0 0 "[ . 1 . 2]" 1
1738 1 83 TYR H 1 83 TYR HB3 . . 4.150 3.137 2.891 3.277 . 0 0 "[ . 1 . 2]" 1
1739 1 83 TYR H 1 83 TYR QD . . 4.790 4.532 4.449 4.570 . 0 0 "[ . 1 . 2]" 1
1740 1 83 TYR H 1 84 GLY H . . 4.700 4.130 3.649 4.282 . 0 0 "[ . 1 . 2]" 1
1741 1 83 TYR H 1 85 GLY H . . 4.720 3.907 3.427 4.221 . 0 0 "[ . 1 . 2]" 1
1742 1 83 TYR H 1 85 GLY HA3 . . 5.240 4.629 4.190 4.810 . 0 0 "[ . 1 . 2]" 1
1743 1 83 TYR H 1 88 HIS HA . . 5.500 4.596 4.413 4.971 . 0 0 "[ . 1 . 2]" 1
1744 1 83 TYR H 1 89 ILE MG . . 3.730 2.653 2.447 3.081 . 0 0 "[ . 1 . 2]" 1
1745 1 83 TYR HA 1 83 TYR QD . . 3.670 2.768 2.520 3.011 . 0 0 "[ . 1 . 2]" 1
1746 1 83 TYR HA 1 83 TYR QE . . 4.780 4.513 4.407 4.584 . 0 0 "[ . 1 . 2]" 1
1747 1 83 TYR HA 1 84 GLY H . . 2.930 2.179 2.144 2.242 . 0 0 "[ . 1 . 2]" 1
1748 1 83 TYR HA 1 84 GLY HA2 . . 4.600 4.380 4.374 4.401 . 0 0 "[ . 1 . 2]" 1
1749 1 83 TYR HA 1 84 GLY HA3 . . 4.860 4.453 4.342 4.523 . 0 0 "[ . 1 . 2]" 1
1750 1 83 TYR HA 1 85 GLY H . . 4.240 4.000 3.734 4.218 . 0 0 "[ . 1 . 2]" 1
1751 1 83 TYR QB 1 89 ILE MG . . 3.430 2.221 2.026 2.402 . 0 0 "[ . 1 . 2]" 1
1752 1 83 TYR HB2 1 84 GLY H . . 4.690 4.293 4.141 4.532 . 0 0 "[ . 1 . 2]" 1
1753 1 83 TYR HB2 1 89 ILE MG . . 3.960 2.567 2.369 2.812 . 0 0 "[ . 1 . 2]" 1
1754 1 83 TYR HB3 1 84 GLY H . . 4.690 3.975 3.775 4.313 . 0 0 "[ . 1 . 2]" 1
1755 1 83 TYR HB3 1 89 ILE MG . . 3.960 2.445 2.145 2.715 . 0 0 "[ . 1 . 2]" 1
1756 1 83 TYR QD 1 84 GLY H . . 4.090 3.493 3.229 4.078 . 0 0 "[ . 1 . 2]" 1
1757 1 83 TYR QD 1 84 GLY HA3 . . 4.580 3.575 3.094 3.997 . 0 0 "[ . 1 . 2]" 1
1758 1 83 TYR QD 1 89 ILE MG . . 4.490 3.917 3.631 4.138 . 0 0 "[ . 1 . 2]" 1
1759 1 83 TYR QE 1 84 GLY HA3 . . 4.950 4.530 4.194 4.940 . 0 0 "[ . 1 . 2]" 1
1760 1 84 GLY H 1 85 GLY H . . 3.370 3.071 2.765 3.211 . 0 0 "[ . 1 . 2]" 1
1761 1 84 GLY HA3 1 85 GLY HA2 . . 4.970 4.912 4.749 4.976 0.006 20 0 "[ . 1 . 2]" 1
1762 1 85 GLY H 1 86 PRO QD . . 4.200 4.035 3.964 4.171 . 0 0 "[ . 1 . 2]" 1
1763 1 85 GLY HA2 1 86 PRO QD . . 3.470 2.008 1.973 2.029 . 0 0 "[ . 1 . 2]" 1
1764 1 85 GLY HA2 1 86 PRO HG2 . . 4.440 4.389 4.334 4.421 . 0 0 "[ . 1 . 2]" 1
1765 1 85 GLY HA2 1 86 PRO HG3 . . 4.600 4.390 4.360 4.409 . 0 0 "[ . 1 . 2]" 1
1766 1 85 GLY HA3 1 86 PRO HD2 . . 3.800 2.797 2.749 2.880 . 0 0 "[ . 1 . 2]" 1
1767 1 85 GLY HA3 1 86 PRO QD . . 3.240 2.710 2.668 2.786 . 0 0 "[ . 1 . 2]" 1
1768 1 85 GLY HA3 1 86 PRO HD3 . . 3.800 3.637 3.601 3.702 . 0 0 "[ . 1 . 2]" 1
1769 1 85 GLY HA3 1 86 PRO HG2 . . 5.130 4.762 4.722 4.834 . 0 0 "[ . 1 . 2]" 1
1770 1 85 GLY HA3 1 86 PRO HG3 . . 5.470 5.363 5.321 5.436 . 0 0 "[ . 1 . 2]" 1
1771 1 85 GLY HA3 1 87 GLN H . . 4.400 3.065 2.974 3.204 . 0 0 "[ . 1 . 2]" 1
1772 1 86 PRO QD 1 87 GLN H . . 3.620 2.804 2.686 2.946 . 0 0 "[ . 1 . 2]" 1
1773 1 86 PRO HD2 1 87 GLN H . . 4.420 2.868 2.738 3.027 . 0 0 "[ . 1 . 2]" 1
1774 1 86 PRO HD3 1 87 GLN H . . 4.420 3.959 3.891 4.043 . 0 0 "[ . 1 . 2]" 1
1775 1 86 PRO HG2 1 87 GLN H . . 3.760 3.085 2.813 3.345 . 0 0 "[ . 1 . 2]" 1
1776 1 86 PRO HG2 1 87 GLN HA . . 5.440 4.487 4.374 4.687 . 0 0 "[ . 1 . 2]" 1
1777 1 86 PRO HG3 1 87 GLN H . . 5.150 4.418 4.212 4.617 . 0 0 "[ . 1 . 2]" 1
1778 1 87 GLN H 1 87 GLN QB . . 2.900 2.492 2.212 2.737 . 0 0 "[ . 1 . 2]" 1
1779 1 87 GLN H 1 87 GLN QG . . 3.370 2.538 2.019 3.220 . 0 0 "[ . 1 . 2]" 1
1780 1 87 GLN HA 1 87 GLN QG . . 3.540 2.873 2.281 3.425 . 0 0 "[ . 1 . 2]" 1
1781 1 87 GLN HA 1 88 HIS H . . 2.750 2.420 2.207 2.552 . 0 0 "[ . 1 . 2]" 1
1782 1 87 GLN HA 1 88 HIS HD2 . . 4.500 3.208 2.893 3.571 . 0 0 "[ . 1 . 2]" 1
1783 1 87 GLN QB 1 88 HIS H . . 3.440 2.408 2.089 2.925 . 0 0 "[ . 1 . 2]" 1
1784 1 87 GLN QG 1 88 HIS H . . 3.970 3.618 3.145 3.917 . 0 0 "[ . 1 . 2]" 1
1785 1 88 HIS H 1 88 HIS HB2 . . 3.210 2.373 2.311 2.548 . 0 0 "[ . 1 . 2]" 1
1786 1 88 HIS H 1 88 HIS HB3 . . 3.820 3.590 3.564 3.613 . 0 0 "[ . 1 . 2]" 1
1787 1 88 HIS H 1 88 HIS HD2 . . 3.380 2.423 1.895 2.788 . 0 0 "[ . 1 . 2]" 1
1788 1 88 HIS HA 1 88 HIS HD2 . . 4.990 3.546 3.076 3.966 . 0 0 "[ . 1 . 2]" 1
1789 1 88 HIS HA 1 89 ILE H . . 3.020 2.287 2.166 2.549 . 0 0 "[ . 1 . 2]" 1
1790 1 88 HIS HA 1 89 ILE QG . . 4.760 4.084 3.949 4.243 . 0 0 "[ . 1 . 2]" 1
1791 1 88 HIS HA 1 89 ILE MG . . 3.940 3.636 3.427 3.830 . 0 0 "[ . 1 . 2]" 1
1792 1 88 HIS HB2 1 88 HIS HD2 . . 3.950 3.077 2.887 3.262 . 0 0 "[ . 1 . 2]" 1
1793 1 88 HIS HB2 1 89 ILE H . . 4.490 3.945 3.251 4.223 . 0 0 "[ . 1 . 2]" 1
1794 1 88 HIS HB2 1 92 SER H . . 5.460 5.212 4.304 5.434 . 0 0 "[ . 1 . 2]" 1
1795 1 88 HIS HB2 1 92 SER HB2 . . 4.750 4.028 3.259 4.368 . 0 0 "[ . 1 . 2]" 1
1796 1 88 HIS HB2 1 92 SER QB . . 4.180 3.629 3.209 3.817 . 0 0 "[ . 1 . 2]" 1
1797 1 88 HIS HB2 1 92 SER HB3 . . 4.750 4.188 3.763 4.794 0.044 15 0 "[ . 1 . 2]" 1
1798 1 88 HIS HB3 1 88 HIS HE1 . . 4.820 4.721 4.716 4.736 . 0 0 "[ . 1 . 2]" 1
1799 1 88 HIS HB3 1 89 ILE H . . 3.910 2.771 2.177 3.205 . 0 0 "[ . 1 . 2]" 1
1800 1 88 HIS HB3 1 92 SER H . . 4.230 3.997 3.779 4.147 . 0 0 "[ . 1 . 2]" 1
1801 1 88 HIS HB3 1 92 SER HB2 . . 4.180 2.384 1.987 2.692 . 0 0 "[ . 1 . 2]" 1
1802 1 88 HIS HB3 1 92 SER HB3 . . 4.180 2.564 2.159 3.397 . 0 0 "[ . 1 . 2]" 1
1803 1 88 HIS HB3 1 93 PRO HA . . 5.150 4.090 3.751 4.405 . 0 0 "[ . 1 . 2]" 1
1804 1 88 HIS HD1 1 89 ILE H . . 4.570 4.409 4.187 4.567 . 0 0 "[ . 1 . 2]" 1
1805 1 88 HIS HD1 1 92 SER H . . 5.300 5.232 5.053 5.320 0.020 15 0 "[ . 1 . 2]" 1
1806 1 88 HIS HD1 1 92 SER HA . . 4.850 4.207 3.929 4.397 . 0 0 "[ . 1 . 2]" 1
1807 1 88 HIS HD1 1 92 SER HB2 . . 4.210 3.328 1.931 3.562 . 0 0 "[ . 1 . 2]" 1
1808 1 88 HIS HD1 1 92 SER HB3 . . 4.210 2.091 1.901 3.382 . 0 0 "[ . 1 . 2]" 1
1809 1 88 HIS HD1 1 93 PRO HA . . 4.330 2.526 2.274 2.799 . 0 0 "[ . 1 . 2]" 1
1810 1 88 HIS HE1 1 93 PRO HB2 . . 4.640 4.265 3.799 4.626 . 0 0 "[ . 1 . 2]" 1
1811 1 88 HIS HE1 1 93 PRO QB . . 3.850 2.546 2.100 2.874 . 0 0 "[ . 1 . 2]" 1
1812 1 88 HIS HE1 1 93 PRO HB3 . . 4.640 2.567 2.110 2.903 . 0 0 "[ . 1 . 2]" 1
1813 1 88 HIS HE1 1 93 PRO HD3 . . 4.520 3.887 3.269 4.385 . 0 0 "[ . 1 . 2]" 1
1814 1 88 HIS HE1 1 93 PRO QG . . 4.310 3.799 3.211 4.214 . 0 0 "[ . 1 . 2]" 1
1815 1 89 ILE H 1 89 ILE MD . . 4.460 3.836 3.728 3.902 . 0 0 "[ . 1 . 2]" 1
1816 1 89 ILE H 1 89 ILE QG . . 3.250 2.190 2.063 2.284 . 0 0 "[ . 1 . 2]" 1
1817 1 89 ILE H 1 89 ILE MG . . 3.080 2.388 2.148 2.686 . 0 0 "[ . 1 . 2]" 1
1818 1 89 ILE H 1 90 VAL H . . 4.710 4.603 4.535 4.637 . 0 0 "[ . 1 . 2]" 1
1819 1 89 ILE H 1 92 SER H . . 4.350 4.188 3.659 4.357 0.007 17 0 "[ . 1 . 2]" 1
1820 1 89 ILE H 1 92 SER HB2 . . 4.070 2.639 2.350 3.467 . 0 0 "[ . 1 . 2]" 1
1821 1 89 ILE H 1 92 SER QB . . 3.270 2.580 2.317 3.271 0.001 15 0 "[ . 1 . 2]" 1
1822 1 89 ILE H 1 92 SER HB3 . . 4.070 3.691 3.359 4.008 . 0 0 "[ . 1 . 2]" 1
1823 1 89 ILE HA 1 89 ILE MD . . 4.380 4.109 4.078 4.170 . 0 0 "[ . 1 . 2]" 1
1824 1 89 ILE HA 1 89 ILE MG . . 3.390 2.321 2.208 2.450 . 0 0 "[ . 1 . 2]" 1
1825 1 89 ILE HA 1 90 VAL H . . 3.150 2.386 2.323 2.481 . 0 0 "[ . 1 . 2]" 1
1826 1 89 ILE HA 1 90 VAL HA . . 5.130 4.298 4.296 4.301 . 0 0 "[ . 1 . 2]" 1
1827 1 89 ILE HA 1 90 VAL HB . . 4.870 4.798 4.734 4.849 . 0 0 "[ . 1 . 2]" 1
1828 1 89 ILE HB 1 89 ILE MD . . 3.270 2.167 2.102 2.365 . 0 0 "[ . 1 . 2]" 1
1829 1 89 ILE HB 1 90 VAL H . . 3.070 2.435 2.210 2.582 . 0 0 "[ . 1 . 2]" 1
1830 1 89 ILE HB 1 90 VAL MG1 . . 4.400 2.915 2.826 3.048 . 0 0 "[ . 1 . 2]" 1
1831 1 89 ILE MD 1 90 VAL H . . 4.190 3.867 3.607 4.056 . 0 0 "[ . 1 . 2]" 1
1832 1 89 ILE MD 1 91 GLY HA3 . . 5.370 4.501 4.269 4.777 . 0 0 "[ . 1 . 2]" 1
1833 1 89 ILE MD 1 92 SER H . . 4.220 3.773 3.514 3.977 . 0 0 "[ . 1 . 2]" 1
1834 1 89 ILE MD 1 92 SER QB . . 4.870 3.675 3.455 4.116 . 0 0 "[ . 1 . 2]" 1
1835 1 89 ILE MD 1 94 PHE QD . . 4.670 4.372 4.133 4.671 0.001 15 0 "[ . 1 . 2]" 1
1836 1 89 ILE MD 1 94 PHE QE . . 3.540 2.489 2.208 2.758 . 0 0 "[ . 1 . 2]" 1
1837 1 89 ILE MD 1 94 PHE HZ . . 3.910 3.468 3.025 3.835 . 0 0 "[ . 1 . 2]" 1
1838 1 89 ILE QG 1 89 ILE MG . . 3.280 2.092 2.018 2.213 . 0 0 "[ . 1 . 2]" 1
1839 1 89 ILE QG 1 90 VAL H . . 3.890 3.591 3.301 3.781 . 0 0 "[ . 1 . 2]" 1
1840 1 89 ILE QG 1 92 SER H . . 3.710 2.563 2.331 2.748 . 0 0 "[ . 1 . 2]" 1
1841 1 89 ILE QG 1 92 SER HB2 . . 4.130 2.362 2.055 3.901 . 0 0 "[ . 1 . 2]" 1
1842 1 89 ILE QG 1 92 SER QB . . 3.510 2.306 2.039 3.255 . 0 0 "[ . 1 . 2]" 1
1843 1 89 ILE QG 1 92 SER HB3 . . 4.130 3.570 3.390 3.747 . 0 0 "[ . 1 . 2]" 1
1844 1 89 ILE QG 1 94 PHE QD . . 4.930 4.588 4.380 4.798 . 0 0 "[ . 1 . 2]" 1
1845 1 89 ILE QG 1 94 PHE QE . . 4.140 3.141 2.870 3.380 . 0 0 "[ . 1 . 2]" 1
1846 1 89 ILE MG 1 90 VAL H . . 4.010 3.725 3.577 3.810 . 0 0 "[ . 1 . 2]" 1
1847 1 89 ILE MG 1 92 SER QB . . 5.340 4.063 3.738 4.896 . 0 0 "[ . 1 . 2]" 1
1848 1 90 VAL H 1 90 VAL HB . . 3.090 2.604 2.495 2.693 . 0 0 "[ . 1 . 2]" 1
1849 1 90 VAL H 1 90 VAL MG1 . . 3.090 2.091 1.907 2.296 . 0 0 "[ . 1 . 2]" 1
1850 1 90 VAL H 1 90 VAL MG2 . . 3.950 3.765 3.755 3.775 . 0 0 "[ . 1 . 2]" 1
1851 1 90 VAL H 1 91 GLY H . . 4.510 4.415 4.279 4.508 . 0 0 "[ . 1 . 2]" 1
1852 1 90 VAL H 1 92 SER H . . 5.250 4.634 4.529 4.747 . 0 0 "[ . 1 . 2]" 1
1853 1 90 VAL HA 1 90 VAL MG1 . . 3.190 3.180 3.168 3.191 0.001 12 0 "[ . 1 . 2]" 1
1854 1 90 VAL HA 1 90 VAL MG2 . . 3.300 2.395 2.262 2.466 . 0 0 "[ . 1 . 2]" 1
1855 1 90 VAL HA 1 91 GLY H . . 2.630 2.157 2.144 2.200 . 0 0 "[ . 1 . 2]" 1
1856 1 90 VAL HA 1 91 GLY HA2 . . 4.440 4.366 4.333 4.395 . 0 0 "[ . 1 . 2]" 1
1857 1 90 VAL HA 1 91 GLY HA3 . . 5.340 4.395 4.388 4.413 . 0 0 "[ . 1 . 2]" 1
1858 1 90 VAL HA 1 92 SER H . . 4.130 3.982 3.762 4.120 . 0 0 "[ . 1 . 2]" 1
1859 1 90 VAL HB 1 91 GLY H . . 4.580 4.320 4.170 4.462 . 0 0 "[ . 1 . 2]" 1
1860 1 90 VAL MG2 1 91 GLY H . . 3.450 2.899 2.681 3.207 . 0 0 "[ . 1 . 2]" 1
1861 1 90 VAL MG2 1 91 GLY HA2 . . 4.280 3.607 3.485 3.787 . 0 0 "[ . 1 . 2]" 1
1862 1 90 VAL MG2 1 91 GLY HA3 . . 3.940 3.592 3.349 3.797 . 0 0 "[ . 1 . 2]" 1
1863 1 91 GLY H 1 92 SER H . . 3.280 2.866 2.569 3.110 . 0 0 "[ . 1 . 2]" 1
1864 1 91 GLY HA2 1 94 PHE QE . . 4.730 4.371 3.555 4.662 . 0 0 "[ . 1 . 2]" 1
1865 1 91 GLY HA2 1 94 PHE HZ . . 4.530 4.374 3.754 4.529 . 0 0 "[ . 1 . 2]" 1
1866 1 91 GLY HA3 1 94 PHE QD . . 5.200 5.037 4.514 5.213 0.013 16 0 "[ . 1 . 2]" 1
1867 1 91 GLY HA3 1 94 PHE QE . . 4.330 3.455 2.831 3.670 . 0 0 "[ . 1 . 2]" 1
1868 1 91 GLY HA3 1 94 PHE HZ . . 4.330 2.777 2.102 2.958 . 0 0 "[ . 1 . 2]" 1
1869 1 92 SER H 1 92 SER HB2 . . 3.630 2.308 2.176 3.468 . 0 0 "[ . 1 . 2]" 1
1870 1 92 SER H 1 92 SER QB . . 3.030 2.259 2.155 2.954 . 0 0 "[ . 1 . 2]" 1
1871 1 92 SER H 1 92 SER HB3 . . 3.630 3.510 3.201 3.588 . 0 0 "[ . 1 . 2]" 1
1872 1 92 SER H 1 93 PRO HA . . 4.980 4.710 4.694 4.738 . 0 0 "[ . 1 . 2]" 1
1873 1 92 SER H 1 94 PHE QD . . 4.820 4.758 4.495 4.829 0.009 20 0 "[ . 1 . 2]" 1
1874 1 92 SER H 1 94 PHE QE . . 4.380 3.533 3.291 3.707 . 0 0 "[ . 1 . 2]" 1
1875 1 92 SER HA 1 93 PRO HA . . 3.310 2.449 2.381 2.511 . 0 0 "[ . 1 . 2]" 1
1876 1 92 SER HA 1 93 PRO HB2 . . 4.900 4.437 4.394 4.477 . 0 0 "[ . 1 . 2]" 1
1877 1 92 SER HA 1 93 PRO QB . . 4.310 3.998 3.955 4.038 . 0 0 "[ . 1 . 2]" 1
1878 1 92 SER HA 1 93 PRO HB3 . . 4.900 4.542 4.487 4.594 . 0 0 "[ . 1 . 2]" 1
1879 1 92 SER HA 1 94 PHE H . . 3.870 3.471 2.788 3.678 . 0 0 "[ . 1 . 2]" 1
1880 1 92 SER HA 1 94 PHE QD . . 4.060 3.172 3.001 3.408 . 0 0 "[ . 1 . 2]" 1
1881 1 92 SER HA 1 94 PHE QE . . 4.460 3.495 3.304 3.717 . 0 0 "[ . 1 . 2]" 1
1882 1 92 SER QB 1 93 PRO QB . . 5.180 3.517 3.417 3.562 . 0 0 "[ . 1 . 2]" 1
1883 1 92 SER QB 1 94 PHE H . . 4.990 4.037 2.884 4.308 . 0 0 "[ . 1 . 2]" 1
1884 1 92 SER QB 1 94 PHE QD . . 4.380 3.677 2.187 3.888 . 0 0 "[ . 1 . 2]" 1
1885 1 92 SER HB2 1 93 PRO HA . . 4.680 3.498 1.981 3.599 . 0 0 "[ . 1 . 2]" 1
1886 1 92 SER HB2 1 94 PHE QE . . 4.400 3.825 3.493 4.257 . 0 0 "[ . 1 . 2]" 1
1887 1 92 SER HB3 1 93 PRO HA . . 4.680 2.022 1.982 2.610 . 0 0 "[ . 1 . 2]" 1
1888 1 92 SER HB3 1 94 PHE QE . . 4.400 4.253 2.531 4.420 0.020 20 0 "[ . 1 . 2]" 1
1889 1 93 PRO HA 1 94 PHE H . . 3.080 2.442 2.191 2.555 . 0 0 "[ . 1 . 2]" 1
1890 1 93 PRO HA 1 94 PHE QD . . 4.270 3.688 3.466 3.977 . 0 0 "[ . 1 . 2]" 1
1891 1 93 PRO QB 1 94 PHE H . . 3.650 2.457 2.212 3.100 . 0 0 "[ . 1 . 2]" 1
1892 1 93 PRO HB2 1 94 PHE H . . 4.250 2.523 2.249 3.275 . 0 0 "[ . 1 . 2]" 1
1893 1 93 PRO HB3 1 94 PHE H . . 4.250 3.413 3.281 3.832 . 0 0 "[ . 1 . 2]" 1
1894 1 94 PHE H 1 94 PHE HB2 . . 3.600 2.516 2.426 2.592 . 0 0 "[ . 1 . 2]" 1
1895 1 94 PHE H 1 94 PHE HB3 . . 3.940 3.698 3.637 3.746 . 0 0 "[ . 1 . 2]" 1
1896 1 94 PHE H 1 94 PHE QD . . 3.350 3.149 2.549 3.356 0.006 7 0 "[ . 1 . 2]" 1
1897 1 94 PHE H 1 95 LYS H . . 4.550 4.327 4.188 4.514 . 0 0 "[ . 1 . 2]" 1
1898 1 94 PHE HA 1 94 PHE QD . . 3.840 2.739 2.574 2.880 . 0 0 "[ . 1 . 2]" 1
1899 1 94 PHE HA 1 95 LYS H . . 2.670 2.158 2.138 2.250 . 0 0 "[ . 1 . 2]" 1
1900 1 94 PHE HA 1 95 LYS QB . . 4.310 4.035 3.949 4.085 . 0 0 "[ . 1 . 2]" 1
1901 1 94 PHE HB2 1 95 LYS H . . 4.650 4.307 4.024 4.438 . 0 0 "[ . 1 . 2]" 1
1902 1 94 PHE HB3 1 95 LYS H . . 3.610 3.346 2.850 3.601 . 0 0 "[ . 1 . 2]" 1
1903 1 94 PHE QD 1 95 LYS H . . 4.100 3.856 3.513 4.035 . 0 0 "[ . 1 . 2]" 1
1904 1 95 LYS H 1 95 LYS HB2 . . 3.260 2.537 2.349 2.769 . 0 0 "[ . 1 . 2]" 1
1905 1 95 LYS H 1 95 LYS HB3 . . 3.260 2.719 2.489 2.852 . 0 0 "[ . 1 . 2]" 1
1906 1 95 LYS H 1 95 LYS HG2 . . 4.840 4.649 4.552 4.714 . 0 0 "[ . 1 . 2]" 1
1907 1 95 LYS H 1 95 LYS HG3 . . 4.840 4.433 4.327 4.541 . 0 0 "[ . 1 . 2]" 1
1908 1 95 LYS H 1 96 ALA H . . 4.530 4.445 4.351 4.525 . 0 0 "[ . 1 . 2]" 1
1909 1 95 LYS HA 1 95 LYS HG2 . . 4.240 3.384 3.009 3.807 . 0 0 "[ . 1 . 2]" 1
1910 1 95 LYS HA 1 95 LYS QG . . 3.720 2.394 2.151 2.834 . 0 0 "[ . 1 . 2]" 1
1911 1 95 LYS HA 1 95 LYS HG3 . . 4.240 2.450 2.189 2.928 . 0 0 "[ . 1 . 2]" 1
1912 1 95 LYS HA 1 96 ALA H . . 2.830 2.148 2.140 2.160 . 0 0 "[ . 1 . 2]" 1
1913 1 95 LYS HA 1 96 ALA HA . . 5.120 4.395 4.392 4.401 . 0 0 "[ . 1 . 2]" 1
1914 1 95 LYS HA 1 96 ALA MB . . 4.270 3.964 3.880 4.027 . 0 0 "[ . 1 . 2]" 1
1915 1 95 LYS QB 1 95 LYS QE . . 3.460 2.360 1.953 3.422 . 0 0 "[ . 1 . 2]" 1
1916 1 95 LYS QB 1 96 ALA H . . 3.890 3.752 3.652 3.865 . 0 0 "[ . 1 . 2]" 1
1917 1 95 LYS QB 1 96 ALA HA . . 5.340 4.460 4.313 4.601 . 0 0 "[ . 1 . 2]" 1
1918 1 95 LYS HB2 1 95 LYS QE . . 4.260 2.409 1.968 3.632 . 0 0 "[ . 1 . 2]" 1
1919 1 95 LYS HB2 1 96 ALA H . . 4.520 4.396 4.224 4.521 0.001 1 0 "[ . 1 . 2]" 1
1920 1 95 LYS HB3 1 95 LYS QE . . 4.260 3.583 3.252 4.229 . 0 0 "[ . 1 . 2]" 1
1921 1 95 LYS HB3 1 96 ALA H . . 4.520 4.077 3.905 4.273 . 0 0 "[ . 1 . 2]" 1
1922 1 95 LYS QG 1 96 ALA H . . 4.110 2.939 2.634 3.195 . 0 0 "[ . 1 . 2]" 1
1923 1 95 LYS QG 1 97 LYS H . . 5.320 4.479 3.611 5.111 . 0 0 "[ . 1 . 2]" 1
1924 1 95 LYS HG2 1 96 ALA H . . 4.790 3.916 3.243 4.734 . 0 0 "[ . 1 . 2]" 1
1925 1 95 LYS HG3 1 96 ALA H . . 4.790 3.106 2.656 3.417 . 0 0 "[ . 1 . 2]" 1
1926 1 96 ALA H 1 96 ALA MB . . 3.120 2.403 2.259 2.511 . 0 0 "[ . 1 . 2]" 1
1927 1 96 ALA H 1 97 LYS H . . 4.660 4.263 4.055 4.524 . 0 0 "[ . 1 . 2]" 1
1928 1 96 ALA HA 1 97 LYS H . . 2.710 2.156 2.141 2.223 . 0 0 "[ . 1 . 2]" 1
1929 1 96 ALA HA 1 97 LYS HA . . 5.500 4.403 4.387 4.432 . 0 0 "[ . 1 . 2]" 1
1930 1 96 ALA HA 1 97 LYS HB2 . . 4.820 4.638 4.311 4.808 . 0 0 "[ . 1 . 2]" 1
1931 1 96 ALA HA 1 97 LYS QB . . 4.160 4.099 3.978 4.167 0.007 16 0 "[ . 1 . 2]" 1
1932 1 96 ALA HA 1 97 LYS HB3 . . 4.820 4.579 4.469 4.736 . 0 0 "[ . 1 . 2]" 1
1933 1 96 ALA MB 1 97 LYS H . . 3.500 3.272 2.837 3.481 . 0 0 "[ . 1 . 2]" 1
1934 1 96 ALA MB 1 97 LYS HA . . 4.650 4.227 4.077 4.325 . 0 0 "[ . 1 . 2]" 1
1935 1 97 LYS H 1 97 LYS HB2 . . 3.300 2.904 2.701 3.067 . 0 0 "[ . 1 . 2]" 1
1936 1 97 LYS H 1 97 LYS HB3 . . 3.300 2.492 2.370 2.716 . 0 0 "[ . 1 . 2]" 1
1937 1 97 LYS H 1 97 LYS HG2 . . 4.730 4.412 4.283 4.726 . 0 0 "[ . 1 . 2]" 1
1938 1 97 LYS H 1 97 LYS HG3 . . 4.730 4.600 4.316 4.713 . 0 0 "[ . 1 . 2]" 1
1939 1 97 LYS H 1 98 VAL H . . 4.560 4.267 4.086 4.461 . 0 0 "[ . 1 . 2]" 1
1940 1 97 LYS H 1 98 VAL MG2 . . 4.750 4.400 4.116 4.732 . 0 0 "[ . 1 . 2]" 1
1941 1 97 LYS HA 1 97 LYS QD . . 4.580 3.897 2.239 4.271 . 0 0 "[ . 1 . 2]" 1
1942 1 97 LYS HA 1 97 LYS QG . . 3.730 2.526 2.329 2.829 . 0 0 "[ . 1 . 2]" 1
1943 1 97 LYS HA 1 98 VAL H . . 2.820 2.158 2.141 2.193 . 0 0 "[ . 1 . 2]" 1
1944 1 97 LYS HA 1 98 VAL HB . . 4.720 4.632 4.514 4.702 . 0 0 "[ . 1 . 2]" 1
1945 1 97 LYS HB2 1 98 VAL H . . 4.520 4.380 4.159 4.513 . 0 0 "[ . 1 . 2]" 1
1946 1 97 LYS HB3 1 98 VAL H . . 4.520 4.381 4.185 4.488 . 0 0 "[ . 1 . 2]" 1
1947 1 97 LYS QE 1 97 LYS QG . . 3.440 2.277 2.102 2.593 . 0 0 "[ . 1 . 2]" 1
1948 1 97 LYS QG 1 98 VAL H . . 3.880 3.151 2.722 3.386 . 0 0 "[ . 1 . 2]" 1
1949 1 97 LYS QG 1 99 THR H . . 5.340 4.704 4.378 5.045 . 0 0 "[ . 1 . 2]" 1
1950 1 97 LYS HG2 1 98 VAL H . . 4.420 3.686 3.057 4.418 . 0 0 "[ . 1 . 2]" 1
1951 1 97 LYS HG3 1 98 VAL H . . 4.420 3.612 2.749 4.172 . 0 0 "[ . 1 . 2]" 1
1952 1 98 VAL H 1 98 VAL HB . . 3.300 2.515 2.363 2.697 . 0 0 "[ . 1 . 2]" 1
1953 1 98 VAL H 1 98 VAL MG1 . . 3.970 3.792 3.722 3.879 . 0 0 "[ . 1 . 2]" 1
1954 1 98 VAL H 1 98 VAL MG2 . . 3.470 2.521 2.257 2.746 . 0 0 "[ . 1 . 2]" 1
1955 1 98 VAL H 1 99 THR H . . 4.670 4.523 4.426 4.613 . 0 0 "[ . 1 . 2]" 1
1956 1 98 VAL HA 1 98 VAL MG1 . . 3.460 2.411 2.295 2.465 . 0 0 "[ . 1 . 2]" 1
1957 1 98 VAL HA 1 98 VAL MG2 . . 3.470 2.354 2.165 2.459 . 0 0 "[ . 1 . 2]" 1
1958 1 98 VAL HA 1 99 THR H . . 2.690 2.201 2.163 2.293 . 0 0 "[ . 1 . 2]" 1
1959 1 98 VAL HB 1 99 THR H . . 4.590 4.032 3.817 4.162 . 0 0 "[ . 1 . 2]" 1
1960 1 98 VAL MG1 1 99 THR H . . 3.320 2.207 1.925 2.542 . 0 0 "[ . 1 . 2]" 1
1961 1 98 VAL MG2 1 99 THR H . . 4.040 3.898 3.677 4.020 . 0 0 "[ . 1 . 2]" 1
1962 1 99 THR H 1 99 THR MG . . 3.400 2.277 1.898 3.043 . 0 0 "[ . 1 . 2]" 1
1963 1 99 THR HA 1 99 THR MG . . 3.310 2.849 2.235 3.207 . 0 0 "[ . 1 . 2]" 1
1964 1 99 THR HA 1 100 GLY H . . 2.990 2.379 2.160 2.479 . 0 0 "[ . 1 . 2]" 1
1965 1 99 THR HB 1 100 GLY H . . 3.860 3.236 2.330 3.835 . 0 0 "[ . 1 . 2]" 1
1966 1 99 THR MG 1 100 GLY H . . 3.900 3.668 3.199 3.909 0.009 13 0 "[ . 1 . 2]" 1
1967 1 100 GLY H 1 101 PRO HD2 . . 5.000 4.788 4.728 4.820 . 0 0 "[ . 1 . 2]" 1
1968 1 100 GLY H 1 101 PRO QD . . 4.370 4.181 4.071 4.288 . 0 0 "[ . 1 . 2]" 1
1969 1 100 GLY H 1 101 PRO HD3 . . 5.000 4.611 4.442 4.805 . 0 0 "[ . 1 . 2]" 1
1970 1 100 GLY HA2 1 101 PRO HD2 . . 3.510 2.578 2.436 2.686 . 0 0 "[ . 1 . 2]" 1
1971 1 100 GLY HA2 1 101 PRO QD . . 3.070 2.200 2.111 2.274 . 0 0 "[ . 1 . 2]" 1
1972 1 100 GLY HA2 1 101 PRO HD3 . . 3.510 2.387 2.313 2.454 . 0 0 "[ . 1 . 2]" 1
1973 1 100 GLY HA2 1 101 PRO HG2 . . 4.970 4.658 4.540 4.749 . 0 0 "[ . 1 . 2]" 1
1974 1 100 GLY HA2 1 101 PRO HG3 . . 5.500 4.589 4.492 4.669 . 0 0 "[ . 1 . 2]" 1
1975 1 100 GLY HA3 1 101 PRO HD2 . . 3.610 2.450 2.346 2.591 . 0 0 "[ . 1 . 2]" 1
1976 1 100 GLY HA3 1 101 PRO HD3 . . 3.610 3.336 3.234 3.467 . 0 0 "[ . 1 . 2]" 1
1977 1 100 GLY HA3 1 101 PRO HG3 . . 5.200 5.043 4.943 5.176 . 0 0 "[ . 1 . 2]" 1
1978 1 101 PRO HA 1 102 ARG H . . 2.940 2.250 2.151 2.464 . 0 0 "[ . 1 . 2]" 1
1979 1 101 PRO QB 1 102 ARG H . . 3.610 2.970 2.404 3.420 . 0 0 "[ . 1 . 2]" 1
1980 1 101 PRO QB 1 102 ARG HA . . 5.340 4.672 4.380 4.915 . 0 0 "[ . 1 . 2]" 1
1981 1 101 PRO HB2 1 102 ARG H . . 4.310 3.122 2.460 3.666 . 0 0 "[ . 1 . 2]" 1
1982 1 101 PRO HB3 1 102 ARG H . . 4.310 3.748 3.378 4.092 . 0 0 "[ . 1 . 2]" 1
1983 1 101 PRO HG2 1 103 LEU MD1 . . 4.410 3.031 2.608 3.323 . 0 0 "[ . 1 . 2]" 1
1984 1 101 PRO HG2 1 103 LEU HG . . 3.460 2.881 2.485 3.422 . 0 0 "[ . 1 . 2]" 1
1985 1 101 PRO HG3 1 103 LEU MD1 . . 4.700 4.380 3.981 4.684 . 0 0 "[ . 1 . 2]" 1
1986 1 102 ARG H 1 102 ARG HB2 . . 3.600 2.365 2.168 3.610 0.010 8 0 "[ . 1 . 2]" 1
1987 1 102 ARG H 1 102 ARG QB . . 3.020 2.218 2.118 2.450 . 0 0 "[ . 1 . 2]" 1
1988 1 102 ARG H 1 102 ARG HB3 . . 3.600 3.078 2.198 3.596 . 0 0 "[ . 1 . 2]" 1
1989 1 102 ARG H 1 102 ARG QD . . 4.870 4.080 1.804 4.778 . 0 0 "[ . 1 . 2]" 1
1990 1 102 ARG H 1 102 ARG QG . . 3.860 3.391 2.151 3.868 0.008 9 0 "[ . 1 . 2]" 1
1991 1 102 ARG HA 1 102 ARG QD . . 4.730 3.865 2.937 4.120 . 0 0 "[ . 1 . 2]" 1
1992 1 102 ARG HA 1 102 ARG QG . . 3.620 2.387 2.144 3.499 . 0 0 "[ . 1 . 2]" 1
1993 1 102 ARG HA 1 103 LEU H . . 2.990 2.193 2.141 2.346 . 0 0 "[ . 1 . 2]" 1
1994 1 102 ARG QB 1 103 LEU H . . 4.180 3.746 3.120 4.000 . 0 0 "[ . 1 . 2]" 1
1995 1 102 ARG HB2 1 102 ARG QD . . 3.540 2.623 2.207 3.499 . 0 0 "[ . 1 . 2]" 1
1996 1 102 ARG HB3 1 102 ARG QD . . 3.540 2.534 2.094 3.457 . 0 0 "[ . 1 . 2]" 1
1997 1 102 ARG QG 1 103 LEU H . . 4.190 3.702 2.847 4.191 0.001 15 0 "[ . 1 . 2]" 1
1998 1 103 LEU H 1 103 LEU HB2 . . 3.790 2.357 2.170 2.652 . 0 0 "[ . 1 . 2]" 1
1999 1 103 LEU H 1 103 LEU QB . . 3.190 2.326 2.150 2.602 . 0 0 "[ . 1 . 2]" 1
2000 1 103 LEU H 1 103 LEU HB3 . . 3.790 3.585 3.478 3.772 . 0 0 "[ . 1 . 2]" 1
2001 1 103 LEU H 1 103 LEU MD1 . . 4.390 3.746 3.470 4.093 . 0 0 "[ . 1 . 2]" 1
2002 1 103 LEU H 1 103 LEU MD2 . . 4.650 4.228 3.980 4.441 . 0 0 "[ . 1 . 2]" 1
2003 1 103 LEU H 1 103 LEU HG . . 4.230 3.274 2.798 3.583 . 0 0 "[ . 1 . 2]" 1
2004 1 103 LEU H 1 104 SER H . . 4.720 3.945 3.247 4.455 . 0 0 "[ . 1 . 2]" 1
2005 1 103 LEU HA 1 103 LEU MD1 . . 4.580 3.838 3.791 3.890 . 0 0 "[ . 1 . 2]" 1
2006 1 103 LEU HA 1 103 LEU MD2 . . 3.160 2.303 2.048 2.505 . 0 0 "[ . 1 . 2]" 1
2007 1 103 LEU HA 1 103 LEU HG . . 3.990 2.660 2.499 2.798 . 0 0 "[ . 1 . 2]" 1
2008 1 103 LEU QB 1 103 LEU MD1 . . 2.940 2.015 1.938 2.099 . 0 0 "[ . 1 . 2]" 1
2009 1 103 LEU HB2 1 103 LEU MD1 . . 3.420 2.114 1.993 2.331 . 0 0 "[ . 1 . 2]" 1
2010 1 103 LEU HB3 1 103 LEU MD1 . . 3.420 2.568 2.380 2.685 . 0 0 "[ . 1 . 2]" 1
2011 1 107 GLY QA 1 108 PRO QD . . 3.160 2.000 1.908 2.280 . 0 0 "[ . 1 . 2]" 1
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