NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
602921 |
5jtk   |
30079 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5jtk
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 1356
_Distance_constraint_stats_list.Viol_count 476
_Distance_constraint_stats_list.Viol_total 61.123
_Distance_constraint_stats_list.Viol_max 0.187
_Distance_constraint_stats_list.Viol_rms 0.0045
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0128
_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 1 MET 0.000 0.000 7 0 "[ . 1]"
1 2 THR 0.064 0.063 9 0 "[ . 1]"
1 3 PRO 0.031 0.020 3 0 "[ . 1]"
1 4 ILE 0.015 0.008 8 0 "[ . 1]"
1 5 GLU 0.071 0.063 9 0 "[ . 1]"
1 6 TYR 0.050 0.025 3 0 "[ . 1]"
1 7 ILE 0.211 0.048 3 0 "[ . 1]"
1 8 ASP 0.096 0.030 8 0 "[ . 1]"
1 9 ARG 0.290 0.073 3 0 "[ . 1]"
1 10 ALA 0.101 0.073 3 0 "[ . 1]"
1 11 LEU 0.103 0.028 10 0 "[ . 1]"
1 12 ALA 0.072 0.033 9 0 "[ . 1]"
1 13 LEU 0.205 0.029 2 0 "[ . 1]"
1 14 VAL 0.039 0.019 7 0 "[ . 1]"
1 15 VAL 0.135 0.033 9 0 "[ . 1]"
1 16 ASP 0.054 0.025 7 0 "[ . 1]"
1 17 ARG 0.127 0.025 7 0 "[ . 1]"
1 18 LEU 0.125 0.020 7 0 "[ . 1]"
1 19 ALA 0.180 0.029 7 0 "[ . 1]"
1 20 ARG 0.000 0.000 . 0 "[ . 1]"
1 21 TYR 0.091 0.020 7 0 "[ . 1]"
1 22 PRO 0.142 0.029 7 0 "[ . 1]"
1 23 GLY 0.025 0.007 7 0 "[ . 1]"
1 24 TYR 0.080 0.015 9 0 "[ . 1]"
1 25 GLU 0.028 0.028 6 0 "[ . 1]"
1 26 VAL 0.015 0.008 7 0 "[ . 1]"
1 27 LEU 0.007 0.005 10 0 "[ . 1]"
1 28 LEU 0.066 0.028 6 0 "[ . 1]"
1 29 SER 0.057 0.029 6 0 "[ . 1]"
1 30 ALA 0.145 0.029 6 0 "[ . 1]"
1 31 GLU 0.111 0.021 10 0 "[ . 1]"
1 32 LYS 0.203 0.115 3 0 "[ . 1]"
1 33 GLN 0.130 0.115 3 0 "[ . 1]"
1 34 LEU 0.127 0.021 10 0 "[ . 1]"
1 35 GLN 0.045 0.016 1 0 "[ . 1]"
1 36 TYR 0.626 0.047 2 0 "[ . 1]"
1 37 ILE 0.232 0.032 6 0 "[ . 1]"
1 38 ARG 0.015 0.005 1 0 "[ . 1]"
1 39 SER 0.000 0.000 . 0 "[ . 1]"
1 40 VAL 0.152 0.018 6 0 "[ . 1]"
1 41 LEU 0.136 0.014 6 0 "[ . 1]"
1 42 LEU 0.098 0.014 6 0 "[ . 1]"
1 43 ASP 0.016 0.005 3 0 "[ . 1]"
1 44 ARG 0.010 0.004 5 0 "[ . 1]"
1 45 SER 0.001 0.001 6 0 "[ . 1]"
1 46 LEU 0.015 0.006 6 0 "[ . 1]"
1 47 ASP 0.015 0.008 3 0 "[ . 1]"
1 48 ARG 0.055 0.013 1 0 "[ . 1]"
1 49 SER 0.005 0.004 3 0 "[ . 1]"
1 50 ALA 0.139 0.023 9 0 "[ . 1]"
1 51 LEU 0.180 0.023 9 0 "[ . 1]"
1 52 HIS 0.000 0.000 9 0 "[ . 1]"
1 53 ARG 0.118 0.026 1 0 "[ . 1]"
1 54 LEU 0.232 0.026 1 0 "[ . 1]"
1 55 THR 0.000 0.000 . 0 "[ . 1]"
1 56 LEU 0.017 0.008 9 0 "[ . 1]"
1 57 GLY 0.000 0.000 . 0 "[ . 1]"
1 58 SER 0.040 0.025 5 0 "[ . 1]"
1 59 ILE 0.095 0.018 7 0 "[ . 1]"
1 60 ALA 0.509 0.066 7 0 "[ . 1]"
1 61 VAL 0.193 0.032 3 0 "[ . 1]"
1 62 LYS 0.040 0.025 5 0 "[ . 1]"
1 63 GLU 0.098 0.015 9 0 "[ . 1]"
1 64 PHE 0.055 0.020 4 0 "[ . 1]"
1 65 ASP 0.560 0.066 7 0 "[ . 1]"
1 66 GLU 0.028 0.009 6 0 "[ . 1]"
1 67 THR 0.028 0.009 6 0 "[ . 1]"
1 68 ASP 0.069 0.018 5 0 "[ . 1]"
1 69 PRO 0.037 0.013 4 0 "[ . 1]"
1 70 GLU 0.211 0.029 2 0 "[ . 1]"
1 71 LEU 0.831 0.187 4 0 "[ . 1]"
1 72 SER 0.039 0.013 4 0 "[ . 1]"
1 73 ARG 0.062 0.018 7 0 "[ . 1]"
1 74 ALA 0.126 0.037 5 0 "[ . 1]"
1 75 LEU 0.204 0.039 8 0 "[ . 1]"
1 76 LYS 0.093 0.021 9 0 "[ . 1]"
1 77 ASP 0.000 0.000 . 0 "[ . 1]"
1 78 ALA 0.697 0.050 9 0 "[ . 1]"
1 79 TYR 0.572 0.050 9 0 "[ . 1]"
1 80 TYR 0.061 0.025 9 0 "[ . 1]"
1 81 VAL 0.089 0.039 9 0 "[ . 1]"
1 82 GLY 0.090 0.039 9 0 "[ . 1]"
1 83 ILE 0.004 0.002 8 0 "[ . 1]"
1 84 ARG 0.095 0.070 10 0 "[ . 1]"
1 85 THR 0.046 0.020 9 0 "[ . 1]"
1 86 GLY 0.004 0.003 3 0 "[ . 1]"
1 87 ARG 0.012 0.006 10 0 "[ . 1]"
1 88 GLY 0.043 0.031 4 0 "[ . 1]"
1 89 LEU 0.145 0.070 10 0 "[ . 1]"
1 90 LYS 0.290 0.160 10 0 "[ . 1]"
1 91 VAL 0.027 0.009 10 0 "[ . 1]"
1 92 ASP 0.029 0.029 9 0 "[ . 1]"
1 93 LEU 0.039 0.029 9 0 "[ . 1]"
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 1 MET HA 1 1 MET QG . . 3.450 2.980 2.267 3.390 . 0 0 "[ . 1]" 1
2 1 1 MET QB 1 2 THR H . . 3.750 3.062 2.212 3.452 . 0 0 "[ . 1]" 1
3 1 1 MET HB2 1 2 THR H . . 4.540 3.515 2.242 4.223 . 0 0 "[ . 1]" 1
4 1 1 MET HB3 1 2 THR H . . 4.540 3.635 2.301 4.089 . 0 0 "[ . 1]" 1
5 1 1 MET QG 1 2 THR H . . 3.930 2.751 1.938 3.931 0.000 7 0 "[ . 1]" 1
6 1 2 THR H 1 2 THR MG . . 3.260 2.122 1.922 2.317 . 0 0 "[ . 1]" 1
7 1 2 THR H 1 4 ILE MG . . 5.120 4.584 4.499 4.902 . 0 0 "[ . 1]" 1
8 1 2 THR H 1 5 GLU H . . 4.550 4.517 4.493 4.613 0.063 9 0 "[ . 1]" 1
9 1 2 THR H 1 5 GLU HB2 . . 3.810 3.658 3.554 3.792 . 0 0 "[ . 1]" 1
10 1 2 THR HA 1 2 THR MG . . 3.690 3.178 3.168 3.203 . 0 0 "[ . 1]" 1
11 1 2 THR HA 1 4 ILE H . . 4.600 4.113 4.105 4.175 . 0 0 "[ . 1]" 1
12 1 2 THR HB 1 4 ILE H . . 5.060 4.389 4.336 4.767 . 0 0 "[ . 1]" 1
13 1 2 THR HB 1 4 ILE MG . . 4.950 3.532 3.516 3.649 . 0 0 "[ . 1]" 1
14 1 2 THR MG 1 4 ILE H . . 4.000 3.644 3.381 3.687 . 0 0 "[ . 1]" 1
15 1 2 THR MG 1 4 ILE MG . . 3.680 2.095 1.926 2.172 . 0 0 "[ . 1]" 1
16 1 2 THR MG 1 5 GLU H . . 4.140 2.683 1.929 2.918 . 0 0 "[ . 1]" 1
17 1 2 THR MG 1 5 GLU HA . . 4.580 4.263 3.636 4.453 . 0 0 "[ . 1]" 1
18 1 2 THR MG 1 5 GLU HB2 . . 4.510 2.269 1.890 2.480 . 0 0 "[ . 1]" 1
19 1 2 THR MG 1 6 TYR H . . 4.420 4.297 3.705 4.420 0.000 2 0 "[ . 1]" 1
20 1 3 PRO HA 1 5 GLU H . . 4.690 3.892 3.839 3.960 . 0 0 "[ . 1]" 1
21 1 3 PRO HA 1 6 TYR H . . 4.210 3.154 3.119 3.234 . 0 0 "[ . 1]" 1
22 1 3 PRO HA 1 6 TYR HA . . 5.500 5.240 5.135 5.322 . 0 0 "[ . 1]" 1
23 1 3 PRO HA 1 6 TYR QD . . 3.600 2.035 1.988 2.110 . 0 0 "[ . 1]" 1
24 1 3 PRO HA 1 6 TYR QE . . 4.080 3.888 3.648 4.100 0.020 3 0 "[ . 1]" 1
25 1 3 PRO HA 1 7 ILE HG13 . . 5.160 5.126 5.060 5.166 0.006 8 0 "[ . 1]" 1
26 1 3 PRO HA 1 7 ILE MG . . 4.210 4.143 3.992 4.213 0.003 5 0 "[ . 1]" 1
27 1 3 PRO HA 1 41 LEU QD . . 5.440 4.812 4.542 5.131 . 0 0 "[ . 1]" 1
28 1 3 PRO HA 1 81 VAL HB . . 5.040 4.163 2.507 4.831 . 0 0 "[ . 1]" 1
29 1 3 PRO HA 1 81 VAL MG1 . . 4.170 3.032 2.219 3.903 . 0 0 "[ . 1]" 1
30 1 3 PRO HA 1 81 VAL MG2 . . 4.170 2.769 2.260 3.714 . 0 0 "[ . 1]" 1
31 1 3 PRO HB2 1 4 ILE H . . 4.000 3.293 3.143 3.314 . 0 0 "[ . 1]" 1
32 1 3 PRO HB2 1 4 ILE MG . . 5.390 5.147 5.028 5.170 . 0 0 "[ . 1]" 1
33 1 3 PRO HB2 1 6 TYR QD . . 4.770 4.493 4.260 4.726 . 0 0 "[ . 1]" 1
34 1 3 PRO HB2 1 41 LEU QD . . 5.300 3.270 2.885 3.614 . 0 0 "[ . 1]" 1
35 1 3 PRO HB2 1 81 VAL QG . . 3.980 2.458 2.066 2.716 . 0 0 "[ . 1]" 1
36 1 3 PRO HB3 1 4 ILE H . . 4.220 4.117 4.030 4.128 . 0 0 "[ . 1]" 1
37 1 3 PRO HB3 1 7 ILE MG . . 4.550 4.404 4.167 4.549 . 0 0 "[ . 1]" 1
38 1 3 PRO HB3 1 81 VAL HA . . 5.370 4.867 4.142 5.342 . 0 0 "[ . 1]" 1
39 1 3 PRO HB3 1 81 VAL MG1 . . 4.000 2.761 1.931 3.732 . 0 0 "[ . 1]" 1
40 1 3 PRO HB3 1 81 VAL QG . . 2.890 1.911 1.721 2.051 . 0 0 "[ . 1]" 1
41 1 3 PRO HB3 1 81 VAL MG2 . . 4.000 2.190 1.900 3.972 . 0 0 "[ . 1]" 1
42 1 3 PRO HG2 1 4 ILE H . . 4.230 2.321 2.150 2.344 . 0 0 "[ . 1]" 1
43 1 3 PRO HG2 1 4 ILE HA . . 4.220 4.093 4.090 4.111 . 0 0 "[ . 1]" 1
44 1 3 PRO HG2 1 4 ILE MD . . 5.290 5.075 4.847 5.196 . 0 0 "[ . 1]" 1
45 1 4 ILE H 1 4 ILE HB . . 3.150 2.418 2.412 2.427 . 0 0 "[ . 1]" 1
46 1 4 ILE H 1 4 ILE MD . . 4.700 4.195 4.106 4.263 . 0 0 "[ . 1]" 1
47 1 4 ILE H 1 4 ILE HG12 . . 4.840 4.650 4.628 4.669 . 0 0 "[ . 1]" 1
48 1 4 ILE H 1 4 ILE MG . . 3.230 2.353 2.343 2.364 . 0 0 "[ . 1]" 1
49 1 4 ILE H 1 5 GLU H . . 3.620 2.777 2.769 2.780 . 0 0 "[ . 1]" 1
50 1 4 ILE H 1 41 LEU QD . . 4.070 2.712 2.402 3.381 . 0 0 "[ . 1]" 1
51 1 4 ILE HA 1 4 ILE MD . . 3.870 3.276 3.124 3.460 . 0 0 "[ . 1]" 1
52 1 4 ILE HA 1 6 TYR H . . 5.080 4.597 4.438 4.865 . 0 0 "[ . 1]" 1
53 1 4 ILE HA 1 7 ILE MD . . 3.330 2.754 2.621 2.903 . 0 0 "[ . 1]" 1
54 1 4 ILE HA 1 7 ILE HG12 . . 4.660 2.377 2.217 2.551 . 0 0 "[ . 1]" 1
55 1 4 ILE HA 1 7 ILE HG13 . . 4.210 2.458 2.324 2.654 . 0 0 "[ . 1]" 1
56 1 4 ILE HA 1 41 LEU QD . . 3.870 3.159 2.538 3.870 0.000 9 0 "[ . 1]" 1
57 1 4 ILE HB 1 4 ILE MD . . 3.140 2.139 2.013 2.265 . 0 0 "[ . 1]" 1
58 1 4 ILE HB 1 41 LEU QD . . 4.700 2.332 1.871 3.369 . 0 0 "[ . 1]" 1
59 1 4 ILE MD 1 38 ARG HA . . 4.110 3.689 3.240 4.095 . 0 0 "[ . 1]" 1
60 1 4 ILE MD 1 38 ARG QB . . 4.650 3.384 2.221 4.379 . 0 0 "[ . 1]" 1
61 1 4 ILE MD 1 41 LEU HB2 . . 5.270 4.387 3.649 5.201 . 0 0 "[ . 1]" 1
62 1 4 ILE MD 1 41 LEU QD . . 4.000 2.619 1.923 3.468 . 0 0 "[ . 1]" 1
63 1 4 ILE HG12 1 5 GLU H . . 5.010 4.359 4.266 4.459 . 0 0 "[ . 1]" 1
64 1 4 ILE HG12 1 7 ILE MD . . 4.800 3.951 3.765 4.309 . 0 0 "[ . 1]" 1
65 1 4 ILE HG12 1 8 ASP H . . 5.500 5.238 5.048 5.435 . 0 0 "[ . 1]" 1
66 1 4 ILE HG13 1 7 ILE H . . 5.500 5.419 5.294 5.501 0.001 5 0 "[ . 1]" 1
67 1 4 ILE HG13 1 8 ASP H . . 4.790 4.403 4.186 4.579 . 0 0 "[ . 1]" 1
68 1 4 ILE MG 1 5 GLU H . . 3.390 1.940 1.933 1.974 . 0 0 "[ . 1]" 1
69 1 4 ILE MG 1 5 GLU HA . . 4.250 3.327 3.305 3.370 . 0 0 "[ . 1]" 1
70 1 4 ILE MG 1 5 GLU HB2 . . 4.050 3.156 2.948 3.323 . 0 0 "[ . 1]" 1
71 1 4 ILE MG 1 5 GLU QG . . 4.350 3.051 2.673 3.853 . 0 0 "[ . 1]" 1
72 1 4 ILE MG 1 6 TYR H . . 4.230 4.204 4.174 4.233 0.003 9 0 "[ . 1]" 1
73 1 4 ILE MG 1 7 ILE H . . 5.230 5.192 5.042 5.238 0.008 8 0 "[ . 1]" 1
74 1 5 GLU H 1 5 GLU HB2 . . 3.170 2.132 2.092 2.163 . 0 0 "[ . 1]" 1
75 1 5 GLU H 1 5 GLU HB3 . . 3.460 3.341 3.064 3.465 0.005 9 0 "[ . 1]" 1
76 1 5 GLU H 1 5 GLU QG . . 4.510 3.323 3.010 3.810 . 0 0 "[ . 1]" 1
77 1 5 GLU H 1 6 TYR H . . 3.580 2.515 2.485 2.552 . 0 0 "[ . 1]" 1
78 1 5 GLU H 1 6 TYR HB2 . . 4.920 4.563 4.408 4.653 . 0 0 "[ . 1]" 1
79 1 5 GLU H 1 6 TYR QD . . 5.140 4.598 3.823 4.929 . 0 0 "[ . 1]" 1
80 1 5 GLU H 1 7 ILE HG13 . . 4.630 4.220 4.136 4.247 . 0 0 "[ . 1]" 1
81 1 5 GLU H 1 8 ASP H . . 4.940 4.511 4.369 4.585 . 0 0 "[ . 1]" 1
82 1 5 GLU H 1 8 ASP QB . . 5.340 4.438 4.327 4.545 . 0 0 "[ . 1]" 1
83 1 5 GLU HA 1 5 GLU QG . . 3.710 2.372 2.159 2.602 . 0 0 "[ . 1]" 1
84 1 5 GLU HA 1 8 ASP H . . 3.890 3.469 3.122 3.629 . 0 0 "[ . 1]" 1
85 1 5 GLU HA 1 8 ASP QB . . 3.680 2.321 1.979 2.533 . 0 0 "[ . 1]" 1
86 1 5 GLU HB2 1 6 TYR H . . 3.780 2.981 2.736 3.357 . 0 0 "[ . 1]" 1
87 1 5 GLU HB2 1 6 TYR QD . . 5.200 4.643 3.855 5.202 0.002 8 0 "[ . 1]" 1
88 1 5 GLU HB3 1 6 TYR H . . 4.140 3.035 2.736 3.191 . 0 0 "[ . 1]" 1
89 1 5 GLU HB3 1 6 TYR HA . . 4.730 3.916 3.824 3.988 . 0 0 "[ . 1]" 1
90 1 5 GLU HB3 1 7 ILE H . . 5.500 5.359 5.053 5.501 0.001 9 0 "[ . 1]" 1
91 1 6 TYR H 1 6 TYR HB2 . . 3.520 2.403 2.338 2.451 . 0 0 "[ . 1]" 1
92 1 6 TYR H 1 6 TYR HB3 . . 3.700 3.579 3.567 3.586 . 0 0 "[ . 1]" 1
93 1 6 TYR H 1 6 TYR QD . . 3.590 3.009 2.378 3.265 . 0 0 "[ . 1]" 1
94 1 6 TYR H 1 6 TYR QE . . 4.730 4.580 4.415 4.728 . 0 0 "[ . 1]" 1
95 1 6 TYR H 1 7 ILE H . . 3.630 2.750 2.651 2.864 . 0 0 "[ . 1]" 1
96 1 6 TYR H 1 7 ILE HG13 . . 4.400 3.992 3.883 4.177 . 0 0 "[ . 1]" 1
97 1 6 TYR H 1 7 ILE MG . . 4.550 4.398 4.271 4.497 . 0 0 "[ . 1]" 1
98 1 6 TYR H 1 8 ASP H . . 4.760 3.972 3.901 4.094 . 0 0 "[ . 1]" 1
99 1 6 TYR H 1 81 VAL QG . . 5.440 4.319 3.562 4.717 . 0 0 "[ . 1]" 1
100 1 6 TYR HA 1 6 TYR QD . . 3.550 2.258 1.991 2.905 . 0 0 "[ . 1]" 1
101 1 6 TYR HA 1 6 TYR QE . . 4.650 4.354 4.239 4.565 . 0 0 "[ . 1]" 1
102 1 6 TYR HA 1 9 ARG H . . 4.130 3.800 3.564 4.033 . 0 0 "[ . 1]" 1
103 1 6 TYR HA 1 9 ARG QB . . 4.230 3.401 2.859 4.255 0.025 3 0 "[ . 1]" 1
104 1 6 TYR HB2 1 7 ILE H . . 4.190 2.520 2.425 2.832 . 0 0 "[ . 1]" 1
105 1 6 TYR HB2 1 7 ILE MG . . 4.450 3.211 3.092 3.330 . 0 0 "[ . 1]" 1
106 1 6 TYR HB2 1 81 VAL QG . . 3.760 2.772 1.993 3.287 . 0 0 "[ . 1]" 1
107 1 6 TYR HB3 1 7 ILE H . . 4.400 3.419 3.344 3.624 . 0 0 "[ . 1]" 1
108 1 6 TYR HB3 1 7 ILE HA . . 4.940 4.267 4.203 4.331 . 0 0 "[ . 1]" 1
109 1 6 TYR HB3 1 81 VAL QG . . 4.350 3.324 2.377 4.025 . 0 0 "[ . 1]" 1
110 1 6 TYR QD 1 7 ILE MG . . 5.500 4.650 4.520 4.806 . 0 0 "[ . 1]" 1
111 1 6 TYR QD 1 81 VAL HB . . 5.500 4.041 3.095 5.037 . 0 0 "[ . 1]" 1
112 1 6 TYR QD 1 81 VAL QG . . 4.740 2.569 1.849 3.183 . 0 0 "[ . 1]" 1
113 1 6 TYR QE 1 81 VAL QG . . 5.260 3.408 2.436 4.476 . 0 0 "[ . 1]" 1
114 1 7 ILE H 1 7 ILE HB . . 3.810 3.622 3.615 3.656 . 0 0 "[ . 1]" 1
115 1 7 ILE H 1 7 ILE MD . . 3.810 3.644 3.567 3.696 . 0 0 "[ . 1]" 1
116 1 7 ILE H 1 7 ILE HG12 . . 3.870 3.095 3.066 3.129 . 0 0 "[ . 1]" 1
117 1 7 ILE H 1 7 ILE HG13 . . 3.530 2.023 1.934 2.084 . 0 0 "[ . 1]" 1
118 1 7 ILE H 1 7 ILE MG . . 3.770 2.308 2.183 2.491 . 0 0 "[ . 1]" 1
119 1 7 ILE H 1 8 ASP H . . 3.480 2.544 2.300 2.623 . 0 0 "[ . 1]" 1
120 1 7 ILE H 1 8 ASP HA . . 5.330 5.153 4.947 5.236 . 0 0 "[ . 1]" 1
121 1 7 ILE H 1 9 ARG H . . 4.930 4.182 4.002 4.334 . 0 0 "[ . 1]" 1
122 1 7 ILE H 1 10 ALA MB . . 5.500 5.258 4.972 5.521 0.021 8 0 "[ . 1]" 1
123 1 7 ILE H 1 78 ALA MB . . 5.500 4.466 4.176 5.004 . 0 0 "[ . 1]" 1
124 1 7 ILE H 1 81 VAL QG . . 4.630 3.955 3.199 4.640 0.010 3 0 "[ . 1]" 1
125 1 7 ILE HA 1 7 ILE MD . . 4.320 3.715 3.669 3.750 . 0 0 "[ . 1]" 1
126 1 7 ILE HA 1 7 ILE MG . . 3.460 2.343 2.262 2.396 . 0 0 "[ . 1]" 1
127 1 7 ILE HA 1 9 ARG H . . 4.740 4.158 4.115 4.243 . 0 0 "[ . 1]" 1
128 1 7 ILE HA 1 10 ALA H . . 4.190 3.445 3.250 3.762 . 0 0 "[ . 1]" 1
129 1 7 ILE HA 1 10 ALA MB . . 4.150 3.015 2.732 3.339 . 0 0 "[ . 1]" 1
130 1 7 ILE HA 1 78 ALA MB . . 4.660 2.527 2.413 2.719 . 0 0 "[ . 1]" 1
131 1 7 ILE HB 1 7 ILE MD . . 3.750 2.100 2.042 2.222 . 0 0 "[ . 1]" 1
132 1 7 ILE HB 1 8 ASP H . . 3.950 3.778 3.748 3.807 . 0 0 "[ . 1]" 1
133 1 7 ILE HB 1 9 ARG H . . 5.500 5.507 5.482 5.548 0.048 3 0 "[ . 1]" 1
134 1 7 ILE HB 1 78 ALA HA . . 5.010 4.465 3.637 5.023 0.013 3 0 "[ . 1]" 1
135 1 7 ILE HB 1 78 ALA MB . . 4.770 3.237 2.733 3.437 . 0 0 "[ . 1]" 1
136 1 7 ILE MD 1 7 ILE MG . . 3.430 3.080 3.061 3.115 . 0 0 "[ . 1]" 1
137 1 7 ILE MD 1 8 ASP H . . 4.110 2.541 2.371 2.649 . 0 0 "[ . 1]" 1
138 1 7 ILE MD 1 9 ARG H . . 4.710 4.555 4.422 4.627 . 0 0 "[ . 1]" 1
139 1 7 ILE MD 1 38 ARG H . . 4.160 3.925 3.355 4.142 . 0 0 "[ . 1]" 1
140 1 7 ILE MD 1 38 ARG HA . . 4.300 3.479 2.528 4.098 . 0 0 "[ . 1]" 1
141 1 7 ILE MD 1 78 ALA MB . . 5.180 4.564 4.195 4.734 . 0 0 "[ . 1]" 1
142 1 7 ILE HG12 1 8 ASP H . . 5.020 3.673 3.654 3.694 . 0 0 "[ . 1]" 1
143 1 7 ILE HG12 1 37 ILE MG . . 4.600 3.488 2.786 4.058 . 0 0 "[ . 1]" 1
144 1 7 ILE HG13 1 8 ASP H . . 4.540 1.966 1.949 2.001 . 0 0 "[ . 1]" 1
145 1 7 ILE HG13 1 37 ILE MG . . 5.500 4.939 4.281 5.505 0.005 3 0 "[ . 1]" 1
146 1 7 ILE MG 1 8 ASP H . . 4.060 3.937 3.931 3.950 . 0 0 "[ . 1]" 1
147 1 7 ILE MG 1 9 ARG H . . 5.500 5.367 5.333 5.411 . 0 0 "[ . 1]" 1
148 1 7 ILE MG 1 37 ILE HB . . 3.610 3.127 2.537 3.579 . 0 0 "[ . 1]" 1
149 1 7 ILE MG 1 37 ILE MG . . 3.870 2.536 1.906 2.980 . 0 0 "[ . 1]" 1
150 1 7 ILE MG 1 38 ARG HA . . 4.820 4.773 4.658 4.823 0.003 5 0 "[ . 1]" 1
151 1 7 ILE MG 1 78 ALA H . . 4.880 4.347 4.106 4.534 . 0 0 "[ . 1]" 1
152 1 7 ILE MG 1 78 ALA HA . . 3.840 2.160 1.912 2.472 . 0 0 "[ . 1]" 1
153 1 7 ILE MG 1 78 ALA MB . . 3.200 2.151 1.830 2.863 . 0 0 "[ . 1]" 1
154 1 8 ASP H 1 8 ASP QB . . 3.110 2.215 2.132 2.260 . 0 0 "[ . 1]" 1
155 1 8 ASP H 1 9 ARG H . . 3.600 2.711 2.560 2.817 . 0 0 "[ . 1]" 1
156 1 8 ASP H 1 10 ALA H . . 4.740 4.309 4.112 4.512 . 0 0 "[ . 1]" 1
157 1 8 ASP H 1 10 ALA MB . . 5.500 5.033 4.900 5.156 . 0 0 "[ . 1]" 1
158 1 8 ASP H 1 78 ALA MB . . 5.500 5.509 5.498 5.530 0.030 8 0 "[ . 1]" 1
159 1 8 ASP HA 1 10 ALA H . . 5.050 4.329 3.993 4.741 . 0 0 "[ . 1]" 1
160 1 8 ASP HA 1 11 LEU H . . 4.170 3.431 3.207 3.595 . 0 0 "[ . 1]" 1
161 1 8 ASP HA 1 11 LEU HB2 . . 4.590 3.403 2.785 3.926 . 0 0 "[ . 1]" 1
162 1 8 ASP HA 1 11 LEU QB . . 3.980 2.770 2.471 3.083 . 0 0 "[ . 1]" 1
163 1 8 ASP HA 1 11 LEU HB3 . . 4.590 3.117 2.555 4.230 . 0 0 "[ . 1]" 1
164 1 8 ASP HA 1 11 LEU QD . . 3.990 3.356 3.069 3.826 . 0 0 "[ . 1]" 1
165 1 8 ASP HA 1 34 LEU MD1 . . 5.500 3.827 3.004 4.189 . 0 0 "[ . 1]" 1
166 1 8 ASP QB 1 9 ARG H . . 3.490 2.718 2.681 2.764 . 0 0 "[ . 1]" 1
167 1 8 ASP QB 1 11 LEU H . . 5.340 4.994 4.850 5.118 . 0 0 "[ . 1]" 1
168 1 8 ASP QB 1 11 LEU QD . . 5.280 4.278 4.045 4.436 . 0 0 "[ . 1]" 1
169 1 9 ARG H 1 9 ARG QB . . 2.970 2.265 2.120 2.641 . 0 0 "[ . 1]" 1
170 1 9 ARG H 1 9 ARG QD . . 4.310 3.731 2.425 4.307 . 0 0 "[ . 1]" 1
171 1 9 ARG H 1 9 ARG HG2 . . 4.830 4.037 2.098 4.618 . 0 0 "[ . 1]" 1
172 1 9 ARG H 1 9 ARG HG3 . . 4.830 3.979 2.433 4.581 . 0 0 "[ . 1]" 1
173 1 9 ARG H 1 10 ALA H . . 3.430 2.719 2.578 2.800 . 0 0 "[ . 1]" 1
174 1 9 ARG H 1 10 ALA MB . . 5.220 4.348 4.232 4.425 . 0 0 "[ . 1]" 1
175 1 9 ARG H 1 11 LEU H . . 4.680 4.181 4.025 4.485 . 0 0 "[ . 1]" 1
176 1 9 ARG H 1 11 LEU QD . . 5.440 5.444 5.425 5.461 0.021 8 0 "[ . 1]" 1
177 1 9 ARG HA 1 9 ARG QD . . 4.190 3.006 2.014 4.212 0.022 3 0 "[ . 1]" 1
178 1 9 ARG HA 1 9 ARG HG2 . . 4.070 3.334 2.404 3.907 . 0 0 "[ . 1]" 1
179 1 9 ARG HA 1 9 ARG HG3 . . 4.070 2.853 2.112 3.762 . 0 0 "[ . 1]" 1
180 1 9 ARG HA 1 13 LEU H . . 5.150 4.843 4.375 5.147 . 0 0 "[ . 1]" 1
181 1 9 ARG HA 1 13 LEU HG . . 5.500 4.888 4.153 5.434 . 0 0 "[ . 1]" 1
182 1 9 ARG QB 1 10 ALA H . . 3.370 2.649 2.303 3.443 0.073 3 0 "[ . 1]" 1
183 1 9 ARG QD 1 10 ALA H . . 5.340 4.430 2.930 4.967 . 0 0 "[ . 1]" 1
184 1 9 ARG QG 1 10 ALA H . . 4.990 3.845 1.932 4.566 . 0 0 "[ . 1]" 1
185 1 10 ALA H 1 10 ALA MB . . 2.920 2.152 2.050 2.231 . 0 0 "[ . 1]" 1
186 1 10 ALA H 1 11 LEU H . . 3.380 2.675 2.552 2.787 . 0 0 "[ . 1]" 1
187 1 10 ALA H 1 11 LEU QB . . 5.270 4.351 4.263 4.465 . 0 0 "[ . 1]" 1
188 1 10 ALA H 1 12 ALA H . . 5.070 4.273 4.043 4.477 . 0 0 "[ . 1]" 1
189 1 10 ALA H 1 13 LEU MD1 . . 4.790 4.447 4.115 4.790 0.000 8 0 "[ . 1]" 1
190 1 10 ALA HA 1 13 LEU H . . 4.090 3.284 3.191 3.565 . 0 0 "[ . 1]" 1
191 1 10 ALA HA 1 13 LEU QB . . 4.120 2.771 2.427 3.373 . 0 0 "[ . 1]" 1
192 1 10 ALA HA 1 13 LEU MD1 . . 3.780 2.626 2.265 2.920 . 0 0 "[ . 1]" 1
193 1 10 ALA HA 1 13 LEU HG . . 3.660 3.486 3.108 3.664 0.004 3 0 "[ . 1]" 1
194 1 10 ALA HA 1 74 ALA MB . . 3.500 2.384 1.942 2.837 . 0 0 "[ . 1]" 1
195 1 10 ALA MB 1 11 LEU H . . 3.250 2.624 2.498 2.783 . 0 0 "[ . 1]" 1
196 1 10 ALA MB 1 14 VAL H . . 4.980 4.275 4.135 4.470 . 0 0 "[ . 1]" 1
197 1 10 ALA MB 1 14 VAL QG . . 3.900 3.024 2.778 3.803 . 0 0 "[ . 1]" 1
198 1 11 LEU H 1 11 LEU HB2 . . 3.450 2.567 2.091 2.759 . 0 0 "[ . 1]" 1
199 1 11 LEU H 1 11 LEU QB . . 2.930 2.176 2.057 2.229 . 0 0 "[ . 1]" 1
200 1 11 LEU H 1 11 LEU HB3 . . 3.450 2.476 2.279 3.058 . 0 0 "[ . 1]" 1
201 1 11 LEU H 1 11 LEU QD . . 4.090 3.555 3.311 3.691 . 0 0 "[ . 1]" 1
202 1 11 LEU H 1 12 ALA H . . 3.380 2.772 2.591 2.869 . 0 0 "[ . 1]" 1
203 1 11 LEU H 1 13 LEU H . . 4.560 4.238 4.038 4.515 . 0 0 "[ . 1]" 1
204 1 11 LEU H 1 14 VAL QG . . 4.590 3.897 3.593 4.066 . 0 0 "[ . 1]" 1
205 1 11 LEU H 1 34 LEU MD1 . . 4.590 3.959 3.618 4.417 . 0 0 "[ . 1]" 1
206 1 11 LEU H 1 34 LEU MD2 . . 4.240 3.627 2.854 4.239 . 0 0 "[ . 1]" 1
207 1 11 LEU HA 1 11 LEU QD . . 4.000 3.042 2.609 3.208 . 0 0 "[ . 1]" 1
208 1 11 LEU HA 1 14 VAL H . . 3.900 3.519 3.308 3.896 . 0 0 "[ . 1]" 1
209 1 11 LEU HA 1 14 VAL HB . . 4.080 2.955 2.375 4.011 . 0 0 "[ . 1]" 1
210 1 11 LEU HA 1 14 VAL MG1 . . 4.600 3.645 2.017 4.296 . 0 0 "[ . 1]" 1
211 1 11 LEU HA 1 14 VAL QG . . 3.260 2.430 2.014 2.732 . 0 0 "[ . 1]" 1
212 1 11 LEU HA 1 14 VAL MG2 . . 4.600 2.926 2.028 4.434 . 0 0 "[ . 1]" 1
213 1 11 LEU HA 1 15 VAL H . . 4.420 3.978 3.432 4.448 0.028 10 0 "[ . 1]" 1
214 1 11 LEU HA 1 34 LEU MD2 . . 3.720 2.619 2.020 3.179 . 0 0 "[ . 1]" 1
215 1 11 LEU QB 1 12 ALA H . . 3.450 2.668 2.533 2.859 . 0 0 "[ . 1]" 1
216 1 11 LEU QB 1 34 LEU MD2 . . 4.810 2.725 1.931 3.785 . 0 0 "[ . 1]" 1
217 1 11 LEU QB 1 35 GLN HE22 . . 5.340 5.094 4.504 5.339 . 0 0 "[ . 1]" 1
218 1 11 LEU QD 1 12 ALA H . . 4.060 3.124 2.582 4.018 . 0 0 "[ . 1]" 1
219 1 11 LEU QD 1 12 ALA HA . . 4.410 3.057 2.450 4.368 . 0 0 "[ . 1]" 1
220 1 11 LEU QD 1 34 LEU MD1 . . 4.310 2.337 1.806 2.944 . 0 0 "[ . 1]" 1
221 1 11 LEU QD 1 35 GLN HE22 . . 3.900 2.862 2.174 3.493 . 0 0 "[ . 1]" 1
222 1 11 LEU HG 1 14 VAL QG . . 4.960 4.111 3.384 4.582 . 0 0 "[ . 1]" 1
223 1 12 ALA H 1 12 ALA MB . . 2.740 2.126 2.032 2.279 . 0 0 "[ . 1]" 1
224 1 12 ALA H 1 13 LEU H . . 3.380 2.616 2.375 2.904 . 0 0 "[ . 1]" 1
225 1 12 ALA H 1 13 LEU HG . . 4.450 4.401 4.264 4.454 0.004 9 0 "[ . 1]" 1
226 1 12 ALA HA 1 15 VAL H . . 3.850 3.795 3.622 3.883 0.033 9 0 "[ . 1]" 1
227 1 12 ALA HA 1 15 VAL HB . . 3.990 3.588 3.113 3.998 0.008 6 0 "[ . 1]" 1
228 1 12 ALA HA 1 15 VAL QG . . 3.990 2.399 1.934 2.888 . 0 0 "[ . 1]" 1
229 1 12 ALA MB 1 13 LEU H . . 3.150 2.644 2.392 2.813 . 0 0 "[ . 1]" 1
230 1 12 ALA MB 1 13 LEU HG . . 3.440 3.238 2.979 3.373 . 0 0 "[ . 1]" 1
231 1 12 ALA MB 1 14 VAL H . . 5.460 4.528 4.370 4.765 . 0 0 "[ . 1]" 1
232 1 12 ALA MB 1 15 VAL H . . 5.030 4.863 4.714 4.984 . 0 0 "[ . 1]" 1
233 1 12 ALA MB 1 16 ASP H . . 5.500 5.163 4.849 5.427 . 0 0 "[ . 1]" 1
234 1 13 LEU H 1 13 LEU QB . . 3.410 2.414 2.331 2.553 . 0 0 "[ . 1]" 1
235 1 13 LEU H 1 13 LEU MD1 . . 4.870 3.537 3.275 3.685 . 0 0 "[ . 1]" 1
236 1 13 LEU H 1 13 LEU HG . . 3.380 2.357 2.045 2.550 . 0 0 "[ . 1]" 1
237 1 13 LEU H 1 14 VAL H . . 3.390 2.531 2.378 2.615 . 0 0 "[ . 1]" 1
238 1 13 LEU H 1 14 VAL HA . . 5.340 5.159 5.049 5.226 . 0 0 "[ . 1]" 1
239 1 13 LEU H 1 14 VAL HB . . 5.250 4.861 4.748 4.992 . 0 0 "[ . 1]" 1
240 1 13 LEU H 1 14 VAL QG . . 3.980 3.793 3.482 3.979 . 0 0 "[ . 1]" 1
241 1 13 LEU H 1 71 LEU QD . . 4.790 4.113 3.825 4.639 . 0 0 "[ . 1]" 1
242 1 13 LEU HA 1 13 LEU HG . . 3.710 3.018 2.917 3.185 . 0 0 "[ . 1]" 1
243 1 13 LEU HA 1 14 VAL HA . . 5.330 4.796 4.725 4.864 . 0 0 "[ . 1]" 1
244 1 13 LEU HA 1 16 ASP H . . 3.990 3.678 3.484 3.865 . 0 0 "[ . 1]" 1
245 1 13 LEU HA 1 16 ASP HB2 . . 4.450 3.448 3.116 3.644 . 0 0 "[ . 1]" 1
246 1 13 LEU HA 1 16 ASP HB3 . . 4.030 3.672 3.317 4.031 0.001 3 0 "[ . 1]" 1
247 1 13 LEU HA 1 70 GLU HB3 . . 5.060 5.068 5.047 5.089 0.029 2 0 "[ . 1]" 1
248 1 13 LEU QB 1 14 VAL H . . 3.470 2.613 2.397 2.699 . 0 0 "[ . 1]" 1
249 1 13 LEU QB 1 14 VAL HA . . 4.630 3.874 3.809 3.921 . 0 0 "[ . 1]" 1
250 1 13 LEU QB 1 71 LEU QD . . 3.270 1.850 1.773 1.947 . 0 0 "[ . 1]" 1
251 1 13 LEU HB2 1 14 VAL H . . 4.190 2.673 2.449 2.769 . 0 0 "[ . 1]" 1
252 1 13 LEU HB3 1 14 VAL H . . 4.190 3.691 3.409 3.868 . 0 0 "[ . 1]" 1
253 1 13 LEU MD1 1 14 VAL H . . 5.190 4.465 4.246 4.593 . 0 0 "[ . 1]" 1
254 1 13 LEU MD1 1 70 GLU HB2 . . 3.950 3.507 3.360 3.778 . 0 0 "[ . 1]" 1
255 1 13 LEU MD1 1 70 GLU HB3 . . 3.200 2.034 1.917 2.203 . 0 0 "[ . 1]" 1
256 1 13 LEU MD1 1 70 GLU QG . . 3.920 3.156 2.468 3.800 . 0 0 "[ . 1]" 1
257 1 13 LEU MD1 1 71 LEU H . . 4.230 3.936 3.644 4.117 . 0 0 "[ . 1]" 1
258 1 13 LEU MD1 1 71 LEU QD . . 3.490 2.857 2.410 3.321 . 0 0 "[ . 1]" 1
259 1 13 LEU MD1 1 74 ALA MB . . 3.840 2.403 2.006 2.975 . 0 0 "[ . 1]" 1
260 1 13 LEU HG 1 14 VAL H . . 4.820 4.359 4.121 4.454 . 0 0 "[ . 1]" 1
261 1 13 LEU HG 1 14 VAL QG . . 5.440 5.117 4.901 5.444 0.004 3 0 "[ . 1]" 1
262 1 13 LEU HG 1 70 GLU HB3 . . 4.340 4.334 4.195 4.362 0.022 3 0 "[ . 1]" 1
263 1 13 LEU HG 1 71 LEU QD . . 4.520 4.169 3.848 4.496 . 0 0 "[ . 1]" 1
264 1 14 VAL H 1 14 VAL HB . . 3.190 2.573 2.525 2.631 . 0 0 "[ . 1]" 1
265 1 14 VAL H 1 14 VAL MG1 . . 4.250 3.424 2.034 3.779 . 0 0 "[ . 1]" 1
266 1 14 VAL H 1 14 VAL QG . . 2.920 2.140 2.026 2.230 . 0 0 "[ . 1]" 1
267 1 14 VAL H 1 14 VAL MG2 . . 4.250 2.497 2.119 3.765 . 0 0 "[ . 1]" 1
268 1 14 VAL H 1 15 VAL H . . 4.010 2.702 2.563 2.810 . 0 0 "[ . 1]" 1
269 1 14 VAL H 1 15 VAL QG . . 4.650 3.951 3.556 4.188 . 0 0 "[ . 1]" 1
270 1 14 VAL H 1 71 LEU QD . . 4.230 3.030 2.417 3.726 . 0 0 "[ . 1]" 1
271 1 14 VAL HA 1 14 VAL MG1 . . 3.500 2.457 2.208 3.198 . 0 0 "[ . 1]" 1
272 1 14 VAL HA 1 14 VAL QG . . 3.060 2.113 2.041 2.274 . 0 0 "[ . 1]" 1
273 1 14 VAL HA 1 14 VAL MG2 . . 3.500 2.386 2.306 2.416 . 0 0 "[ . 1]" 1
274 1 14 VAL HA 1 16 ASP H . . 4.650 4.293 4.023 4.554 . 0 0 "[ . 1]" 1
275 1 14 VAL HA 1 17 ARG H . . 3.620 3.378 3.215 3.598 . 0 0 "[ . 1]" 1
276 1 14 VAL HA 1 17 ARG HB2 . . 4.320 2.732 2.596 2.868 . 0 0 "[ . 1]" 1
277 1 14 VAL HA 1 17 ARG HB3 . . 4.470 4.210 3.999 4.489 0.019 7 0 "[ . 1]" 1
278 1 14 VAL HA 1 18 LEU H . . 4.520 4.095 3.902 4.313 . 0 0 "[ . 1]" 1
279 1 14 VAL HA 1 71 LEU HA . . 5.500 5.282 4.986 5.512 0.012 8 0 "[ . 1]" 1
280 1 14 VAL HA 1 71 LEU MD1 . . 4.320 2.702 2.079 3.578 . 0 0 "[ . 1]" 1
281 1 14 VAL HA 1 71 LEU QD . . 3.660 2.078 1.835 2.348 . 0 0 "[ . 1]" 1
282 1 14 VAL HA 1 71 LEU MD2 . . 4.320 2.214 1.960 2.798 . 0 0 "[ . 1]" 1
283 1 14 VAL HB 1 15 VAL H . . 4.090 2.746 2.291 3.962 . 0 0 "[ . 1]" 1
284 1 14 VAL HB 1 71 LEU QD . . 5.440 3.741 2.605 4.414 . 0 0 "[ . 1]" 1
285 1 14 VAL QG 1 15 VAL H . . 3.950 2.943 2.039 3.228 . 0 0 "[ . 1]" 1
286 1 14 VAL QG 1 17 ARG H . . 4.630 4.085 3.924 4.348 . 0 0 "[ . 1]" 1
287 1 14 VAL QG 1 17 ARG HB2 . . 3.560 3.432 3.260 3.562 0.002 10 0 "[ . 1]" 1
288 1 14 VAL QG 1 18 LEU QD . . 3.620 1.792 1.772 1.853 . 0 0 "[ . 1]" 1
289 1 14 VAL QG 1 31 GLU H . . 4.370 3.700 3.328 3.987 . 0 0 "[ . 1]" 1
290 1 14 VAL QG 1 31 GLU HA . . 3.940 3.144 2.863 3.374 . 0 0 "[ . 1]" 1
291 1 14 VAL QG 1 31 GLU QB . . 3.190 2.305 1.970 2.576 . 0 0 "[ . 1]" 1
292 1 14 VAL QG 1 34 LEU MD2 . . 3.780 2.716 2.128 2.991 . 0 0 "[ . 1]" 1
293 1 14 VAL MG1 1 15 VAL H . . 4.580 3.156 2.050 3.503 . 0 0 "[ . 1]" 1
294 1 14 VAL MG2 1 15 VAL H . . 4.580 3.701 3.593 3.836 . 0 0 "[ . 1]" 1
295 1 15 VAL H 1 15 VAL HB . . 3.110 2.560 2.456 2.632 . 0 0 "[ . 1]" 1
296 1 15 VAL H 1 15 VAL QG . . 3.070 2.142 2.070 2.280 . 0 0 "[ . 1]" 1
297 1 15 VAL H 1 16 ASP H . . 3.350 2.825 2.777 2.890 . 0 0 "[ . 1]" 1
298 1 15 VAL H 1 16 ASP HA . . 5.500 5.398 5.366 5.445 . 0 0 "[ . 1]" 1
299 1 15 VAL H 1 18 LEU QD . . 4.470 3.909 3.523 4.312 . 0 0 "[ . 1]" 1
300 1 15 VAL H 1 18 LEU HG . . 5.500 5.486 5.354 5.506 0.006 10 0 "[ . 1]" 1
301 1 15 VAL HA 1 15 VAL MG1 . . 3.540 2.582 2.285 3.199 . 0 0 "[ . 1]" 1
302 1 15 VAL HA 1 15 VAL MG2 . . 3.540 2.353 2.302 2.384 . 0 0 "[ . 1]" 1
303 1 15 VAL HA 1 17 ARG H . . 4.970 4.340 4.148 4.873 . 0 0 "[ . 1]" 1
304 1 15 VAL HA 1 18 LEU H . . 3.890 3.397 3.183 3.702 . 0 0 "[ . 1]" 1
305 1 15 VAL HA 1 18 LEU HA . . 5.410 5.176 4.926 5.409 . 0 0 "[ . 1]" 1
306 1 15 VAL HA 1 18 LEU HB2 . . 4.020 2.383 2.158 2.525 . 0 0 "[ . 1]" 1
307 1 15 VAL HA 1 18 LEU HB3 . . 4.320 3.873 3.599 4.079 . 0 0 "[ . 1]" 1
308 1 15 VAL HA 1 18 LEU QD . . 3.620 2.860 2.159 3.372 . 0 0 "[ . 1]" 1
309 1 15 VAL HA 1 18 LEU HG . . 4.960 3.545 3.283 4.268 . 0 0 "[ . 1]" 1
310 1 15 VAL HA 1 19 ALA H . . 4.660 4.341 4.145 4.613 . 0 0 "[ . 1]" 1
311 1 15 VAL HB 1 16 ASP H . . 3.990 2.958 2.412 3.970 . 0 0 "[ . 1]" 1
312 1 15 VAL QG 1 16 ASP H . . 3.380 2.822 1.912 3.321 . 0 0 "[ . 1]" 1
313 1 15 VAL QG 1 16 ASP HA . . 4.150 3.335 3.077 3.594 . 0 0 "[ . 1]" 1
314 1 15 VAL QG 1 16 ASP HB2 . . 4.710 3.909 2.944 4.445 . 0 0 "[ . 1]" 1
315 1 15 VAL QG 1 17 ARG H . . 5.440 4.398 3.982 4.845 . 0 0 "[ . 1]" 1
316 1 15 VAL QG 1 18 LEU QD . . 4.470 3.629 2.940 4.085 . 0 0 "[ . 1]" 1
317 1 15 VAL QG 1 19 ALA H . . 4.500 4.068 3.933 4.358 . 0 0 "[ . 1]" 1
318 1 15 VAL MG1 1 16 ASP H . . 3.860 2.981 1.918 3.619 . 0 0 "[ . 1]" 1
319 1 15 VAL MG2 1 16 ASP H . . 3.860 3.782 3.671 3.865 0.005 5 0 "[ . 1]" 1
320 1 16 ASP H 1 16 ASP HB2 . . 3.080 2.291 2.121 2.414 . 0 0 "[ . 1]" 1
321 1 16 ASP H 1 16 ASP HB3 . . 3.130 2.822 2.681 3.066 . 0 0 "[ . 1]" 1
322 1 16 ASP H 1 17 ARG H . . 3.400 2.675 2.510 2.900 . 0 0 "[ . 1]" 1
323 1 16 ASP H 1 18 LEU H . . 4.550 4.082 3.969 4.242 . 0 0 "[ . 1]" 1
324 1 16 ASP H 1 18 LEU HB2 . . 5.070 4.807 4.639 5.075 0.005 10 0 "[ . 1]" 1
325 1 16 ASP H 1 18 LEU QD . . 5.020 4.810 4.657 5.023 0.003 3 0 "[ . 1]" 1
326 1 16 ASP HA 1 19 ALA H . . 4.020 3.931 3.668 4.026 0.006 5 0 "[ . 1]" 1
327 1 16 ASP HA 1 19 ALA MB . . 3.880 3.407 3.022 3.636 . 0 0 "[ . 1]" 1
328 1 16 ASP HB2 1 17 ARG H . . 3.900 3.686 3.313 3.822 . 0 0 "[ . 1]" 1
329 1 16 ASP HB3 1 17 ARG H . . 3.720 2.681 2.269 2.773 . 0 0 "[ . 1]" 1
330 1 16 ASP HB3 1 17 ARG QG . . 4.160 3.825 3.115 4.185 0.025 7 0 "[ . 1]" 1
331 1 17 ARG H 1 17 ARG HB2 . . 3.310 2.188 2.103 2.445 . 0 0 "[ . 1]" 1
332 1 17 ARG H 1 17 ARG HB3 . . 4.030 3.451 3.341 3.601 . 0 0 "[ . 1]" 1
333 1 17 ARG H 1 17 ARG QG . . 3.450 3.120 2.326 3.458 0.008 7 0 "[ . 1]" 1
334 1 17 ARG H 1 18 LEU H . . 3.580 2.501 2.418 2.800 . 0 0 "[ . 1]" 1
335 1 17 ARG H 1 18 LEU QD . . 4.900 4.078 3.856 4.889 . 0 0 "[ . 1]" 1
336 1 17 ARG H 1 19 ALA H . . 4.370 4.305 4.025 4.383 0.013 7 0 "[ . 1]" 1
337 1 17 ARG H 1 20 ARG H . . 5.310 5.049 4.925 5.298 . 0 0 "[ . 1]" 1
338 1 17 ARG H 1 27 LEU MD1 . . 5.500 5.109 4.696 5.280 . 0 0 "[ . 1]" 1
339 1 17 ARG HA 1 17 ARG QD . . 3.930 2.322 1.986 3.616 . 0 0 "[ . 1]" 1
340 1 17 ARG HA 1 17 ARG QG . . 3.480 2.479 2.190 2.856 . 0 0 "[ . 1]" 1
341 1 17 ARG HA 1 20 ARG QB . . 5.030 2.796 2.457 3.244 . 0 0 "[ . 1]" 1
342 1 17 ARG HB2 1 17 ARG QD . . 3.650 3.128 2.074 3.542 . 0 0 "[ . 1]" 1
343 1 17 ARG HB2 1 18 LEU H . . 4.030 2.923 2.662 3.112 . 0 0 "[ . 1]" 1
344 1 17 ARG HB2 1 18 LEU QD . . 4.500 3.724 3.087 4.504 0.004 10 0 "[ . 1]" 1
345 1 17 ARG HB2 1 27 LEU MD2 . . 4.450 2.957 2.416 3.554 . 0 0 "[ . 1]" 1
346 1 17 ARG HB2 1 71 LEU QD . . 3.730 2.503 1.949 3.405 . 0 0 "[ . 1]" 1
347 1 17 ARG HB3 1 21 TYR H . . 5.500 4.749 4.556 5.033 . 0 0 "[ . 1]" 1
348 1 17 ARG HB3 1 27 LEU MD2 . . 3.960 2.268 1.882 2.573 . 0 0 "[ . 1]" 1
349 1 17 ARG HB3 1 71 LEU QD . . 4.440 3.270 2.731 4.386 . 0 0 "[ . 1]" 1
350 1 17 ARG HB3 1 71 LEU HG . . 5.500 5.198 4.546 5.518 0.018 2 0 "[ . 1]" 1
351 1 17 ARG QG 1 71 LEU QD . . 3.840 2.118 1.755 3.369 . 0 0 "[ . 1]" 1
352 1 18 LEU H 1 18 LEU HB2 . . 3.250 2.156 2.091 2.292 . 0 0 "[ . 1]" 1
353 1 18 LEU H 1 18 LEU HB3 . . 3.600 3.465 3.406 3.546 . 0 0 "[ . 1]" 1
354 1 18 LEU H 1 18 LEU MD1 . . 4.300 3.880 3.117 4.122 . 0 0 "[ . 1]" 1
355 1 18 LEU H 1 18 LEU QD . . 3.520 2.535 2.317 3.169 . 0 0 "[ . 1]" 1
356 1 18 LEU H 1 18 LEU MD2 . . 4.300 2.734 2.330 4.020 . 0 0 "[ . 1]" 1
357 1 18 LEU H 1 18 LEU HG . . 4.090 3.767 2.722 4.096 0.006 3 0 "[ . 1]" 1
358 1 18 LEU H 1 19 ALA H . . 3.300 2.856 2.722 2.913 . 0 0 "[ . 1]" 1
359 1 18 LEU H 1 20 ARG H . . 4.580 4.215 4.112 4.383 . 0 0 "[ . 1]" 1
360 1 18 LEU HA 1 18 LEU MD1 . . 3.950 2.572 2.155 3.821 . 0 0 "[ . 1]" 1
361 1 18 LEU HA 1 18 LEU QD . . 3.120 2.059 1.923 2.526 . 0 0 "[ . 1]" 1
362 1 18 LEU HA 1 18 LEU MD2 . . 3.950 2.227 2.108 2.563 . 0 0 "[ . 1]" 1
363 1 18 LEU HA 1 18 LEU HG . . 4.250 3.436 2.557 3.665 . 0 0 "[ . 1]" 1
364 1 18 LEU HA 1 21 TYR H . . 3.680 3.314 3.208 3.414 . 0 0 "[ . 1]" 1
365 1 18 LEU HA 1 27 LEU MD1 . . 3.710 2.138 1.883 2.413 . 0 0 "[ . 1]" 1
366 1 18 LEU HB2 1 18 LEU MD1 . . 3.640 2.978 2.164 3.181 . 0 0 "[ . 1]" 1
367 1 18 LEU HB2 1 18 LEU MD2 . . 3.640 2.552 2.361 3.151 . 0 0 "[ . 1]" 1
368 1 18 LEU HB2 1 19 ALA H . . 3.640 2.791 2.717 2.899 . 0 0 "[ . 1]" 1
369 1 18 LEU HB2 1 21 TYR H . . 5.500 5.508 5.499 5.520 0.020 7 0 "[ . 1]" 1
370 1 18 LEU HB3 1 18 LEU MD1 . . 3.640 2.301 2.156 2.663 . 0 0 "[ . 1]" 1
371 1 18 LEU HB3 1 18 LEU MD2 . . 3.640 2.983 2.050 3.195 . 0 0 "[ . 1]" 1
372 1 18 LEU HB3 1 19 ALA H . . 4.380 3.044 2.839 3.490 . 0 0 "[ . 1]" 1
373 1 18 LEU QD 1 19 ALA H . . 4.320 3.954 3.884 4.139 . 0 0 "[ . 1]" 1
374 1 18 LEU QD 1 21 TYR H . . 4.990 4.375 4.097 4.933 . 0 0 "[ . 1]" 1
375 1 18 LEU QD 1 23 GLY H . . 3.760 3.249 2.795 3.448 . 0 0 "[ . 1]" 1
376 1 18 LEU QD 1 24 TYR H . . 3.700 3.523 3.145 3.696 . 0 0 "[ . 1]" 1
377 1 18 LEU QD 1 24 TYR QB . . 4.170 3.673 3.397 3.894 . 0 0 "[ . 1]" 1
378 1 18 LEU QD 1 27 LEU H . . 5.260 4.593 4.364 4.825 . 0 0 "[ . 1]" 1
379 1 18 LEU QD 1 27 LEU QB . . 3.150 2.003 1.822 2.132 . 0 0 "[ . 1]" 1
380 1 18 LEU QD 1 28 LEU H . . 4.190 3.899 3.525 4.192 0.002 5 0 "[ . 1]" 1
381 1 18 LEU QD 1 28 LEU HA . . 5.440 3.744 3.187 4.090 . 0 0 "[ . 1]" 1
382 1 18 LEU MD1 1 19 ALA H . . 4.930 4.461 4.371 4.554 . 0 0 "[ . 1]" 1
383 1 18 LEU MD1 1 27 LEU HB2 . . 4.740 3.536 2.796 4.745 0.005 10 0 "[ . 1]" 1
384 1 18 LEU MD1 1 27 LEU HB3 . . 4.740 2.787 2.239 3.493 . 0 0 "[ . 1]" 1
385 1 18 LEU MD2 1 19 ALA H . . 4.930 4.429 4.287 4.856 . 0 0 "[ . 1]" 1
386 1 18 LEU MD2 1 27 LEU HB2 . . 4.740 3.318 2.531 3.715 . 0 0 "[ . 1]" 1
387 1 18 LEU MD2 1 27 LEU HB3 . . 4.740 2.133 1.945 2.350 . 0 0 "[ . 1]" 1
388 1 19 ALA H 1 19 ALA MB . . 2.610 2.119 2.026 2.214 . 0 0 "[ . 1]" 1
389 1 19 ALA H 1 20 ARG H . . 3.110 2.748 2.702 2.823 . 0 0 "[ . 1]" 1
390 1 19 ALA H 1 21 TYR H . . 4.210 4.131 4.074 4.181 . 0 0 "[ . 1]" 1
391 1 19 ALA HA 1 22 PRO HA . . 4.560 4.574 4.563 4.589 0.029 7 0 "[ . 1]" 1
392 1 19 ALA MB 1 20 ARG H . . 3.240 2.652 2.488 2.771 . 0 0 "[ . 1]" 1
393 1 20 ARG H 1 20 ARG QB . . 3.260 2.261 2.110 2.366 . 0 0 "[ . 1]" 1
394 1 20 ARG H 1 20 ARG QG . . 4.220 2.848 2.398 3.962 . 0 0 "[ . 1]" 1
395 1 20 ARG H 1 21 TYR H . . 3.040 2.524 2.487 2.552 . 0 0 "[ . 1]" 1
396 1 20 ARG H 1 21 TYR HB2 . . 5.380 4.957 4.838 5.076 . 0 0 "[ . 1]" 1
397 1 20 ARG HA 1 20 ARG QG . . 3.510 2.406 2.282 2.707 . 0 0 "[ . 1]" 1
398 1 20 ARG QB 1 20 ARG QD . . 3.250 2.215 2.119 2.376 . 0 0 "[ . 1]" 1
399 1 20 ARG QB 1 21 TYR QE . . 3.620 2.893 2.577 3.197 . 0 0 "[ . 1]" 1
400 1 20 ARG HB2 1 21 TYR QD . . 4.220 2.846 2.229 3.765 . 0 0 "[ . 1]" 1
401 1 20 ARG HB2 1 21 TYR QE . . 4.310 3.901 3.133 4.306 . 0 0 "[ . 1]" 1
402 1 20 ARG HB3 1 21 TYR QD . . 4.220 2.573 2.002 3.826 . 0 0 "[ . 1]" 1
403 1 20 ARG HB3 1 21 TYR QE . . 4.310 3.021 2.684 3.629 . 0 0 "[ . 1]" 1
404 1 20 ARG QD 1 21 TYR QE . . 4.030 3.425 2.077 4.028 . 0 0 "[ . 1]" 1
405 1 21 TYR H 1 21 TYR HB2 . . 3.440 2.658 2.579 2.778 . 0 0 "[ . 1]" 1
406 1 21 TYR H 1 21 TYR QD . . 3.430 2.920 2.705 3.217 . 0 0 "[ . 1]" 1
407 1 21 TYR H 1 22 PRO QD . . 4.210 3.019 2.951 3.098 . 0 0 "[ . 1]" 1
408 1 21 TYR HA 1 21 TYR QD . . 3.630 3.003 2.644 3.141 . 0 0 "[ . 1]" 1
409 1 21 TYR HA 1 21 TYR QE . . 4.770 4.648 4.600 4.743 . 0 0 "[ . 1]" 1
410 1 21 TYR HA 1 22 PRO QD . . 3.370 2.043 2.018 2.077 . 0 0 "[ . 1]" 1
411 1 21 TYR HA 1 22 PRO QG . . 4.750 3.922 3.904 3.947 . 0 0 "[ . 1]" 1
412 1 21 TYR HB2 1 24 TYR H . . 4.880 4.760 4.529 4.885 0.005 9 0 "[ . 1]" 1
413 1 21 TYR HB2 1 24 TYR QB . . 4.050 2.980 2.757 3.157 . 0 0 "[ . 1]" 1
414 1 21 TYR HB2 1 24 TYR QD . . 4.380 4.202 3.806 4.380 0.000 2 0 "[ . 1]" 1
415 1 22 PRO HA 1 23 GLY H . . 3.070 2.417 2.385 2.429 . 0 0 "[ . 1]" 1
416 1 22 PRO QB 1 23 GLY H . . 4.030 3.910 3.889 3.918 . 0 0 "[ . 1]" 1
417 1 23 GLY H 1 24 TYR H . . 3.660 1.941 1.898 2.087 . 0 0 "[ . 1]" 1
418 1 23 GLY H 1 24 TYR QB . . 4.310 3.421 3.340 3.523 . 0 0 "[ . 1]" 1
419 1 23 GLY H 1 24 TYR QD . . 5.380 5.025 4.799 5.294 . 0 0 "[ . 1]" 1
420 1 23 GLY H 1 28 LEU MD2 . . 4.740 4.709 4.520 4.746 0.006 6 0 "[ . 1]" 1
421 1 23 GLY QA 1 28 LEU MD2 . . 3.980 3.436 3.251 3.495 . 0 0 "[ . 1]" 1
422 1 23 GLY HA2 1 28 LEU MD2 . . 4.810 3.526 3.337 3.589 . 0 0 "[ . 1]" 1
423 1 23 GLY HA3 1 28 LEU MD2 . . 4.810 4.749 4.490 4.817 0.007 7 0 "[ . 1]" 1
424 1 24 TYR H 1 24 TYR QB . . 2.950 2.315 2.245 2.385 . 0 0 "[ . 1]" 1
425 1 24 TYR H 1 24 TYR QD . . 4.490 4.048 3.897 4.141 . 0 0 "[ . 1]" 1
426 1 24 TYR H 1 25 GLU H . . 4.590 4.434 4.320 4.537 . 0 0 "[ . 1]" 1
427 1 24 TYR H 1 27 LEU QB . . 4.900 3.042 2.823 3.215 . 0 0 "[ . 1]" 1
428 1 24 TYR H 1 28 LEU MD2 . . 4.110 3.524 3.263 3.707 . 0 0 "[ . 1]" 1
429 1 24 TYR H 1 28 LEU HG . . 5.500 4.960 4.694 5.134 . 0 0 "[ . 1]" 1
430 1 24 TYR HA 1 24 TYR QD . . 3.190 2.241 2.159 2.351 . 0 0 "[ . 1]" 1
431 1 24 TYR HA 1 24 TYR QE . . 4.240 4.210 4.198 4.228 . 0 0 "[ . 1]" 1
432 1 24 TYR HA 1 25 GLU HA . . 4.650 4.362 4.336 4.395 . 0 0 "[ . 1]" 1
433 1 24 TYR QB 1 26 VAL QG . . 5.280 4.023 3.939 4.066 . 0 0 "[ . 1]" 1
434 1 24 TYR QB 1 27 LEU H . . 4.270 2.042 1.944 2.129 . 0 0 "[ . 1]" 1
435 1 24 TYR QB 1 27 LEU QB . . 4.530 1.966 1.948 2.015 . 0 0 "[ . 1]" 1
436 1 24 TYR QB 1 27 LEU MD1 . . 3.980 1.897 1.840 2.141 . 0 0 "[ . 1]" 1
437 1 24 TYR QB 1 28 LEU H . . 5.300 3.546 3.491 3.633 . 0 0 "[ . 1]" 1
438 1 24 TYR QB 1 28 LEU MD2 . . 5.340 4.251 4.075 4.372 . 0 0 "[ . 1]" 1
439 1 24 TYR QD 1 26 VAL HB . . 4.450 2.058 1.996 2.194 . 0 0 "[ . 1]" 1
440 1 24 TYR QD 1 26 VAL QG . . 3.510 2.969 2.909 3.073 . 0 0 "[ . 1]" 1
441 1 24 TYR QD 1 27 LEU QB . . 4.490 3.592 3.499 3.679 . 0 0 "[ . 1]" 1
442 1 24 TYR QD 1 27 LEU MD1 . . 3.860 3.229 3.134 3.467 . 0 0 "[ . 1]" 1
443 1 24 TYR QD 1 27 LEU MD2 . . 4.250 3.573 3.436 3.735 . 0 0 "[ . 1]" 1
444 1 24 TYR QD 1 27 LEU HG . . 3.720 2.181 2.021 2.284 . 0 0 "[ . 1]" 1
445 1 24 TYR QE 1 26 VAL HB . . 4.300 2.789 2.448 3.147 . 0 0 "[ . 1]" 1
446 1 24 TYR QE 1 26 VAL MG1 . . 4.070 3.608 3.306 3.962 . 0 0 "[ . 1]" 1
447 1 24 TYR QE 1 26 VAL QG . . 3.340 2.676 2.368 3.031 . 0 0 "[ . 1]" 1
448 1 24 TYR QE 1 26 VAL MG2 . . 4.070 2.761 2.413 3.147 . 0 0 "[ . 1]" 1
449 1 24 TYR QE 1 27 LEU HG . . 4.440 4.292 4.094 4.407 . 0 0 "[ . 1]" 1
450 1 24 TYR QE 1 63 GLU HB2 . . 5.370 5.344 5.182 5.385 0.015 9 0 "[ . 1]" 1
451 1 24 TYR QE 1 63 GLU HB3 . . 4.730 4.477 4.152 4.742 0.012 2 0 "[ . 1]" 1
452 1 25 GLU H 1 25 GLU QB . . 3.540 2.408 2.241 2.563 . 0 0 "[ . 1]" 1
453 1 25 GLU H 1 25 GLU QG . . 4.190 2.291 1.928 2.622 . 0 0 "[ . 1]" 1
454 1 25 GLU H 1 26 VAL H . . 4.320 2.696 2.623 2.782 . 0 0 "[ . 1]" 1
455 1 25 GLU HA 1 25 GLU QG . . 3.610 2.561 2.217 3.329 . 0 0 "[ . 1]" 1
456 1 25 GLU HA 1 28 LEU H . . 4.060 3.780 3.684 3.939 . 0 0 "[ . 1]" 1
457 1 25 GLU HA 1 28 LEU HB2 . . 5.080 4.830 4.760 4.904 . 0 0 "[ . 1]" 1
458 1 25 GLU HA 1 28 LEU QB . . 4.360 4.138 4.073 4.202 . 0 0 "[ . 1]" 1
459 1 25 GLU HA 1 28 LEU HB3 . . 5.080 4.501 4.426 4.597 . 0 0 "[ . 1]" 1
460 1 25 GLU HA 1 28 LEU MD2 . . 3.520 1.959 1.948 1.994 . 0 0 "[ . 1]" 1
461 1 25 GLU QB 1 26 VAL H . . 4.260 2.751 2.633 3.441 . 0 0 "[ . 1]" 1
462 1 25 GLU QG 1 28 LEU MD2 . . 4.320 3.153 2.842 4.348 0.028 6 0 "[ . 1]" 1
463 1 26 VAL H 1 26 VAL QG . . 3.440 2.099 2.005 2.249 . 0 0 "[ . 1]" 1
464 1 26 VAL H 1 27 LEU H . . 3.860 2.541 2.475 2.652 . 0 0 "[ . 1]" 1
465 1 26 VAL HA 1 29 SER H . . 4.120 3.591 3.410 3.649 . 0 0 "[ . 1]" 1
466 1 26 VAL HA 1 29 SER HB2 . . 4.650 3.541 2.491 4.210 . 0 0 "[ . 1]" 1
467 1 26 VAL HA 1 29 SER QB . . 3.900 2.615 2.149 3.489 . 0 0 "[ . 1]" 1
468 1 26 VAL HA 1 29 SER HB3 . . 4.650 2.987 2.172 4.053 . 0 0 "[ . 1]" 1
469 1 26 VAL HA 1 59 ILE MD . . 3.660 3.076 2.761 3.420 . 0 0 "[ . 1]" 1
470 1 26 VAL HB 1 27 LEU H . . 3.730 2.703 2.364 2.769 . 0 0 "[ . 1]" 1
471 1 26 VAL QG 1 27 LEU H . . 3.850 3.305 3.135 3.348 . 0 0 "[ . 1]" 1
472 1 26 VAL QG 1 29 SER QB . . 5.280 3.608 3.252 4.192 . 0 0 "[ . 1]" 1
473 1 26 VAL QG 1 59 ILE HB . . 3.690 2.946 2.657 3.381 . 0 0 "[ . 1]" 1
474 1 26 VAL QG 1 63 GLU HG2 . . 5.440 3.825 2.546 4.625 . 0 0 "[ . 1]" 1
475 1 26 VAL QG 1 63 GLU HG3 . . 3.830 3.359 2.792 3.838 0.008 7 0 "[ . 1]" 1
476 1 26 VAL MG1 1 27 LEU H . . 5.300 3.686 3.448 3.763 . 0 0 "[ . 1]" 1
477 1 26 VAL MG1 1 63 GLU HG3 . . 4.820 3.936 3.163 4.790 . 0 0 "[ . 1]" 1
478 1 26 VAL MG2 1 27 LEU H . . 5.300 3.736 3.602 3.794 . 0 0 "[ . 1]" 1
479 1 26 VAL MG2 1 63 GLU HG3 . . 4.820 3.660 3.107 4.125 . 0 0 "[ . 1]" 1
480 1 27 LEU H 1 27 LEU HB2 . . 4.180 2.324 2.296 2.411 . 0 0 "[ . 1]" 1
481 1 27 LEU H 1 27 LEU QB . . 3.490 2.295 2.269 2.375 . 0 0 "[ . 1]" 1
482 1 27 LEU H 1 27 LEU HB3 . . 4.180 3.559 3.552 3.577 . 0 0 "[ . 1]" 1
483 1 27 LEU H 1 27 LEU MD1 . . 4.030 3.682 3.589 3.782 . 0 0 "[ . 1]" 1
484 1 27 LEU H 1 27 LEU MD2 . . 4.680 3.649 3.540 3.743 . 0 0 "[ . 1]" 1
485 1 27 LEU H 1 27 LEU HG . . 3.690 2.582 2.377 2.647 . 0 0 "[ . 1]" 1
486 1 27 LEU H 1 28 LEU H . . 3.380 2.722 2.681 2.915 . 0 0 "[ . 1]" 1
487 1 27 LEU H 1 28 LEU MD2 . . 5.310 4.506 4.365 4.614 . 0 0 "[ . 1]" 1
488 1 27 LEU H 1 29 SER H . . 4.340 3.895 3.840 4.039 . 0 0 "[ . 1]" 1
489 1 27 LEU HA 1 27 LEU MD2 . . 3.270 2.047 1.969 2.240 . 0 0 "[ . 1]" 1
490 1 27 LEU HA 1 30 ALA H . . 4.080 3.709 3.565 3.961 . 0 0 "[ . 1]" 1
491 1 27 LEU HA 1 31 GLU H . . 4.380 3.762 3.514 4.067 . 0 0 "[ . 1]" 1
492 1 27 LEU QB 1 28 LEU H . . 3.400 2.367 2.351 2.386 . 0 0 "[ . 1]" 1
493 1 27 LEU QB 1 28 LEU MD2 . . 4.800 4.031 3.917 4.163 . 0 0 "[ . 1]" 1
494 1 27 LEU QB 1 29 SER H . . 5.130 4.447 4.416 4.484 . 0 0 "[ . 1]" 1
495 1 27 LEU HB2 1 28 LEU H . . 3.900 2.432 2.410 2.450 . 0 0 "[ . 1]" 1
496 1 27 LEU HB3 1 28 LEU H . . 3.900 3.247 3.220 3.281 . 0 0 "[ . 1]" 1
497 1 28 LEU H 1 28 LEU HB2 . . 3.950 3.579 3.576 3.582 . 0 0 "[ . 1]" 1
498 1 28 LEU H 1 28 LEU QB . . 3.400 2.600 2.563 2.616 . 0 0 "[ . 1]" 1
499 1 28 LEU H 1 28 LEU HB3 . . 3.950 2.670 2.625 2.689 . 0 0 "[ . 1]" 1
500 1 28 LEU H 1 28 LEU MD2 . . 3.410 2.991 2.925 3.065 . 0 0 "[ . 1]" 1
501 1 28 LEU H 1 28 LEU HG . . 3.320 1.963 1.945 2.019 . 0 0 "[ . 1]" 1
502 1 28 LEU H 1 29 SER H . . 3.520 2.613 2.592 2.633 . 0 0 "[ . 1]" 1
503 1 28 LEU HA 1 28 LEU MD1 . . 3.750 3.698 3.629 3.756 0.006 6 0 "[ . 1]" 1
504 1 28 LEU HA 1 31 GLU H . . 4.580 3.651 3.227 3.959 . 0 0 "[ . 1]" 1
505 1 28 LEU HA 1 31 GLU QB . . 5.030 2.959 2.081 3.752 . 0 0 "[ . 1]" 1
506 1 28 LEU QB 1 29 SER H . . 3.620 3.422 3.383 3.449 . 0 0 "[ . 1]" 1
507 1 28 LEU HB2 1 29 SER H . . 4.450 3.699 3.650 3.739 . 0 0 "[ . 1]" 1
508 1 28 LEU HB3 1 29 SER H . . 4.450 4.033 3.996 4.063 . 0 0 "[ . 1]" 1
509 1 28 LEU MD1 1 29 SER H . . 3.920 2.410 2.297 2.493 . 0 0 "[ . 1]" 1
510 1 28 LEU MD1 1 29 SER HA . . 4.850 2.800 2.699 2.918 . 0 0 "[ . 1]" 1
511 1 28 LEU MD1 1 29 SER HB2 . . 4.390 3.014 2.320 3.845 . 0 0 "[ . 1]" 1
512 1 28 LEU MD1 1 29 SER QB . . 3.580 2.640 2.296 3.187 . 0 0 "[ . 1]" 1
513 1 28 LEU MD1 1 29 SER HB3 . . 4.390 3.371 2.401 3.938 . 0 0 "[ . 1]" 1
514 1 28 LEU MD1 1 30 ALA H . . 5.100 4.541 4.435 4.706 . 0 0 "[ . 1]" 1
515 1 28 LEU MD2 1 29 SER H . . 4.260 3.953 3.900 3.996 . 0 0 "[ . 1]" 1
516 1 28 LEU HG 1 29 SER H . . 4.430 2.298 2.245 2.357 . 0 0 "[ . 1]" 1
517 1 29 SER H 1 29 SER QB . . 3.070 2.286 2.127 2.564 . 0 0 "[ . 1]" 1
518 1 29 SER H 1 30 ALA MB . . 4.860 4.341 4.222 4.522 . 0 0 "[ . 1]" 1
519 1 29 SER H 1 31 GLU H . . 4.740 4.097 3.915 4.272 . 0 0 "[ . 1]" 1
520 1 29 SER HA 1 32 LYS H . . 4.270 3.845 3.691 4.141 . 0 0 "[ . 1]" 1
521 1 29 SER HA 1 32 LYS QB . . 3.820 3.022 2.696 3.633 . 0 0 "[ . 1]" 1
522 1 29 SER QB 1 30 ALA H . . 3.580 2.723 2.419 3.335 . 0 0 "[ . 1]" 1
523 1 29 SER QB 1 30 ALA MB . . 4.350 3.943 3.728 4.379 0.029 6 0 "[ . 1]" 1
524 1 29 SER QB 1 32 LYS QB . . 5.180 4.684 4.262 5.207 0.027 3 0 "[ . 1]" 1
525 1 29 SER QB 1 59 ILE MD . . 3.890 3.321 3.034 3.728 . 0 0 "[ . 1]" 1
526 1 29 SER HB2 1 59 ILE MD . . 4.620 4.092 3.483 4.599 . 0 0 "[ . 1]" 1
527 1 29 SER HB3 1 59 ILE MD . . 4.620 3.661 3.103 4.617 . 0 0 "[ . 1]" 1
528 1 30 ALA H 1 30 ALA MB . . 3.250 2.213 2.156 2.255 . 0 0 "[ . 1]" 1
529 1 30 ALA H 1 31 GLU H . . 3.870 2.589 2.357 2.794 . 0 0 "[ . 1]" 1
530 1 30 ALA H 1 31 GLU QB . . 5.340 4.475 4.130 4.784 . 0 0 "[ . 1]" 1
531 1 30 ALA H 1 32 LYS QB . . 5.340 4.860 4.526 5.355 0.015 3 0 "[ . 1]" 1
532 1 30 ALA H 1 56 LEU QD . . 5.260 3.759 3.335 4.056 . 0 0 "[ . 1]" 1
533 1 30 ALA H 1 59 ILE MD . . 3.930 3.895 3.763 3.941 0.011 2 0 "[ . 1]" 1
534 1 30 ALA HA 1 33 GLN H . . 4.000 3.480 3.176 3.802 . 0 0 "[ . 1]" 1
535 1 30 ALA HA 1 33 GLN QB . . 4.220 2.873 2.464 3.508 . 0 0 "[ . 1]" 1
536 1 30 ALA HA 1 56 LEU QD . . 3.430 2.005 1.883 2.220 . 0 0 "[ . 1]" 1
537 1 30 ALA HA 1 56 LEU HG . . 4.410 3.299 2.045 4.413 0.003 3 0 "[ . 1]" 1
538 1 30 ALA HA 1 59 ILE MD . . 4.370 4.002 3.598 4.369 . 0 0 "[ . 1]" 1
539 1 30 ALA MB 1 31 GLU H . . 3.660 2.504 2.244 2.747 . 0 0 "[ . 1]" 1
540 1 30 ALA MB 1 31 GLU HA . . 5.140 3.791 3.695 3.853 . 0 0 "[ . 1]" 1
541 1 30 ALA MB 1 34 LEU H . . 5.500 4.916 4.440 5.345 . 0 0 "[ . 1]" 1
542 1 30 ALA MB 1 56 LEU QD . . 3.270 2.564 1.835 3.237 . 0 0 "[ . 1]" 1
543 1 30 ALA MB 1 56 LEU HG . . 4.430 3.782 3.131 4.434 0.004 3 0 "[ . 1]" 1
544 1 30 ALA MB 1 59 ILE MD . . 2.980 2.888 2.760 2.977 . 0 0 "[ . 1]" 1
545 1 30 ALA MB 1 59 ILE MG . . 5.420 5.419 5.355 5.438 0.018 7 0 "[ . 1]" 1
546 1 31 GLU H 1 31 GLU HB2 . . 3.720 3.113 2.538 3.581 . 0 0 "[ . 1]" 1
547 1 31 GLU H 1 31 GLU QB . . 3.000 2.280 2.227 2.372 . 0 0 "[ . 1]" 1
548 1 31 GLU H 1 31 GLU HB3 . . 3.720 2.384 2.319 2.514 . 0 0 "[ . 1]" 1
549 1 31 GLU H 1 31 GLU QG . . 4.390 3.212 2.354 4.042 . 0 0 "[ . 1]" 1
550 1 31 GLU H 1 32 LYS H . . 3.560 2.701 2.450 2.786 . 0 0 "[ . 1]" 1
551 1 31 GLU H 1 32 LYS QG . . 5.340 4.857 3.980 5.133 . 0 0 "[ . 1]" 1
552 1 31 GLU HA 1 31 GLU QG . . 3.460 2.944 2.491 3.450 . 0 0 "[ . 1]" 1
553 1 31 GLU HA 1 34 LEU MD2 . . 4.130 2.009 1.889 2.232 . 0 0 "[ . 1]" 1
554 1 31 GLU HA 1 34 LEU HG . . 4.170 3.591 3.457 3.817 . 0 0 "[ . 1]" 1
555 1 31 GLU HA 1 35 GLN H . . 4.880 4.766 4.574 4.896 0.016 1 0 "[ . 1]" 1
556 1 31 GLU QB 1 32 LYS H . . 3.820 3.060 2.311 3.506 . 0 0 "[ . 1]" 1
557 1 31 GLU QB 1 34 LEU HB3 . . 5.340 5.239 4.713 5.361 0.021 10 0 "[ . 1]" 1
558 1 31 GLU QB 1 34 LEU MD2 . . 3.400 2.991 2.199 3.407 0.007 1 0 "[ . 1]" 1
559 1 31 GLU QG 1 32 LYS HA . . 4.640 3.574 3.049 4.280 . 0 0 "[ . 1]" 1
560 1 31 GLU QG 1 32 LYS QG . . 5.180 3.682 2.581 5.185 0.005 3 0 "[ . 1]" 1
561 1 32 LYS H 1 32 LYS QB . . 2.930 2.222 2.139 2.431 . 0 0 "[ . 1]" 1
562 1 32 LYS H 1 32 LYS QD . . 4.820 3.919 3.443 4.441 . 0 0 "[ . 1]" 1
563 1 32 LYS H 1 32 LYS HG2 . . 4.040 3.403 2.311 4.035 . 0 0 "[ . 1]" 1
564 1 32 LYS H 1 32 LYS QG . . 3.330 2.730 2.278 3.020 . 0 0 "[ . 1]" 1
565 1 32 LYS H 1 32 LYS HG3 . . 4.040 3.250 2.591 3.858 . 0 0 "[ . 1]" 1
566 1 32 LYS H 1 33 GLN H . . 3.590 2.630 2.474 2.789 . 0 0 "[ . 1]" 1
567 1 32 LYS H 1 33 GLN QB . . 5.120 4.365 4.232 4.493 . 0 0 "[ . 1]" 1
568 1 32 LYS H 1 34 LEU MD2 . . 4.800 4.673 4.479 4.813 0.013 6 0 "[ . 1]" 1
569 1 32 LYS HA 1 32 LYS QD . . 4.960 3.399 2.086 4.434 . 0 0 "[ . 1]" 1
570 1 32 LYS HA 1 32 LYS HG2 . . 4.220 2.664 2.331 3.810 . 0 0 "[ . 1]" 1
571 1 32 LYS HA 1 32 LYS QG . . 3.660 2.471 2.275 3.329 . 0 0 "[ . 1]" 1
572 1 32 LYS HA 1 32 LYS HG3 . . 4.220 3.144 2.575 3.693 . 0 0 "[ . 1]" 1
573 1 32 LYS HA 1 35 GLN HB2 . . 4.440 2.960 2.629 3.271 . 0 0 "[ . 1]" 1
574 1 32 LYS HA 1 35 GLN HG2 . . 4.380 3.269 2.773 3.545 . 0 0 "[ . 1]" 1
575 1 32 LYS HA 1 35 GLN QG . . 3.720 2.441 2.225 2.773 . 0 0 "[ . 1]" 1
576 1 32 LYS HA 1 35 GLN HG3 . . 4.380 2.537 2.273 2.923 . 0 0 "[ . 1]" 1
577 1 32 LYS QB 1 33 GLN H . . 3.360 2.872 2.748 3.475 0.115 3 0 "[ . 1]" 1
578 1 32 LYS QE 1 32 LYS QG . . 3.220 2.266 2.091 2.548 . 0 0 "[ . 1]" 1
579 1 33 GLN H 1 33 GLN HB2 . . 3.730 2.205 2.067 2.377 . 0 0 "[ . 1]" 1
580 1 33 GLN H 1 33 GLN QB . . 3.100 2.148 2.048 2.276 . 0 0 "[ . 1]" 1
581 1 33 GLN H 1 33 GLN HB3 . . 3.730 3.154 2.677 3.553 . 0 0 "[ . 1]" 1
582 1 33 GLN H 1 33 GLN QG . . 4.390 3.410 2.574 4.061 . 0 0 "[ . 1]" 1
583 1 33 GLN H 1 34 LEU H . . 3.670 2.806 2.700 2.923 . 0 0 "[ . 1]" 1
584 1 33 GLN H 1 56 LEU QD . . 4.840 3.602 3.021 4.201 . 0 0 "[ . 1]" 1
585 1 33 GLN HA 1 36 TYR H . . 3.960 3.338 3.218 3.509 . 0 0 "[ . 1]" 1
586 1 33 GLN HA 1 36 TYR HB3 . . 3.980 2.959 2.831 3.136 . 0 0 "[ . 1]" 1
587 1 33 GLN HA 1 36 TYR QD . . 4.140 4.053 3.809 4.147 0.007 10 0 "[ . 1]" 1
588 1 33 GLN QB 1 34 LEU H . . 3.660 2.363 2.136 2.547 . 0 0 "[ . 1]" 1
589 1 33 GLN QB 1 36 TYR HB3 . . 5.340 4.605 4.124 5.001 . 0 0 "[ . 1]" 1
590 1 33 GLN QB 1 56 LEU QD . . 3.780 2.250 1.632 3.250 . 0 0 "[ . 1]" 1
591 1 33 GLN QB 1 56 LEU HG . . 4.430 3.433 2.146 4.429 . 0 0 "[ . 1]" 1
592 1 33 GLN QG 1 34 LEU H . . 4.810 4.067 3.431 4.366 . 0 0 "[ . 1]" 1
593 1 34 LEU H 1 34 LEU HB3 . . 3.810 2.191 2.171 2.213 . 0 0 "[ . 1]" 1
594 1 34 LEU H 1 34 LEU MD2 . . 3.720 3.266 3.203 3.308 . 0 0 "[ . 1]" 1
595 1 34 LEU H 1 34 LEU HG . . 3.320 2.994 2.935 3.052 . 0 0 "[ . 1]" 1
596 1 34 LEU HA 1 34 LEU MD2 . . 4.730 4.107 4.092 4.127 . 0 0 "[ . 1]" 1
597 1 34 LEU HA 1 34 LEU HG . . 4.090 3.676 3.669 3.682 . 0 0 "[ . 1]" 1
598 1 34 LEU HA 1 37 ILE H . . 4.050 3.649 3.398 3.783 . 0 0 "[ . 1]" 1
599 1 34 LEU HA 1 37 ILE HB . . 3.910 3.075 2.783 3.416 . 0 0 "[ . 1]" 1
600 1 34 LEU HA 1 37 ILE MD . . 3.260 2.042 1.948 2.279 . 0 0 "[ . 1]" 1
601 1 34 LEU HB3 1 35 GLN H . . 4.010 3.766 3.751 3.778 . 0 0 "[ . 1]" 1
602 1 34 LEU MD1 1 35 GLN H . . 4.930 3.257 3.103 3.349 . 0 0 "[ . 1]" 1
603 1 34 LEU MD1 1 35 GLN HA . . 4.160 2.656 2.457 2.811 . 0 0 "[ . 1]" 1
604 1 34 LEU MD1 1 35 GLN HE22 . . 4.130 3.044 2.550 3.416 . 0 0 "[ . 1]" 1
605 1 34 LEU MD1 1 36 TYR H . . 5.220 4.824 4.728 4.901 . 0 0 "[ . 1]" 1
606 1 34 LEU MD2 1 35 GLN H . . 4.720 3.780 3.754 3.801 . 0 0 "[ . 1]" 1
607 1 34 LEU HG 1 35 GLN H . . 3.480 2.183 2.131 2.227 . 0 0 "[ . 1]" 1
608 1 34 LEU HG 1 35 GLN HA . . 4.290 3.473 3.406 3.534 . 0 0 "[ . 1]" 1
609 1 34 LEU HG 1 35 GLN HB2 . . 4.920 4.164 4.035 4.276 . 0 0 "[ . 1]" 1
610 1 34 LEU HG 1 35 GLN HE21 . . 3.600 2.766 2.059 3.156 . 0 0 "[ . 1]" 1
611 1 34 LEU HG 1 35 GLN HE22 . . 4.790 4.422 3.632 4.797 0.007 5 0 "[ . 1]" 1
612 1 34 LEU HG 1 35 GLN HG2 . . 4.160 2.160 2.089 2.236 . 0 0 "[ . 1]" 1
613 1 34 LEU HG 1 35 GLN HG3 . . 4.160 3.821 3.644 3.962 . 0 0 "[ . 1]" 1
614 1 34 LEU HG 1 36 TYR H . . 5.380 4.648 4.618 4.684 . 0 0 "[ . 1]" 1
615 1 35 GLN H 1 35 GLN HB2 . . 3.240 2.511 2.416 2.595 . 0 0 "[ . 1]" 1
616 1 35 GLN H 1 35 GLN HB3 . . 3.780 3.596 3.590 3.603 . 0 0 "[ . 1]" 1
617 1 35 GLN H 1 35 GLN HG2 . . 3.610 2.217 2.016 2.390 . 0 0 "[ . 1]" 1
618 1 35 GLN H 1 35 GLN HG3 . . 3.610 3.351 3.205 3.586 . 0 0 "[ . 1]" 1
619 1 35 GLN H 1 36 TYR H . . 3.430 2.549 2.490 2.599 . 0 0 "[ . 1]" 1
620 1 35 GLN H 1 36 TYR HB3 . . 4.720 4.591 4.547 4.625 . 0 0 "[ . 1]" 1
621 1 35 GLN HA 1 35 GLN HE21 . . 4.460 3.410 2.681 3.798 . 0 0 "[ . 1]" 1
622 1 35 GLN HA 1 35 GLN HE22 . . 4.940 4.032 3.708 4.392 . 0 0 "[ . 1]" 1
623 1 35 GLN HA 1 35 GLN QG . . 3.710 2.747 2.654 2.929 . 0 0 "[ . 1]" 1
624 1 35 GLN HB2 1 36 TYR H . . 3.580 2.750 2.712 2.797 . 0 0 "[ . 1]" 1
625 1 35 GLN HB3 1 35 GLN HE21 . . 4.250 4.117 3.763 4.253 0.003 2 0 "[ . 1]" 1
626 1 35 GLN HB3 1 35 GLN HE22 . . 4.510 4.365 4.150 4.497 . 0 0 "[ . 1]" 1
627 1 35 GLN HB3 1 36 TYR H . . 4.620 3.802 3.723 3.861 . 0 0 "[ . 1]" 1
628 1 35 GLN QG 1 36 TYR H . . 4.210 4.020 3.904 4.129 . 0 0 "[ . 1]" 1
629 1 35 GLN HG2 1 36 TYR H . . 4.980 4.309 4.124 4.412 . 0 0 "[ . 1]" 1
630 1 35 GLN HG3 1 36 TYR H . . 4.980 4.816 4.708 4.974 . 0 0 "[ . 1]" 1
631 1 36 TYR H 1 36 TYR HB3 . . 2.970 2.314 2.270 2.358 . 0 0 "[ . 1]" 1
632 1 36 TYR H 1 36 TYR QD . . 4.130 4.162 4.142 4.177 0.047 2 0 "[ . 1]" 1
633 1 36 TYR H 1 37 ILE H . . 3.440 2.699 2.549 2.827 . 0 0 "[ . 1]" 1
634 1 36 TYR H 1 37 ILE MD . . 4.040 3.824 3.631 4.040 . 0 0 "[ . 1]" 1
635 1 36 TYR HA 1 36 TYR QD . . 3.580 2.347 2.291 2.479 . 0 0 "[ . 1]" 1
636 1 36 TYR HA 1 36 TYR QE . . 5.020 4.607 4.586 4.650 . 0 0 "[ . 1]" 1
637 1 36 TYR HB3 1 37 ILE H . . 3.700 2.445 2.373 2.586 . 0 0 "[ . 1]" 1
638 1 36 TYR HB3 1 37 ILE MD . . 4.660 3.434 3.123 3.868 . 0 0 "[ . 1]" 1
639 1 36 TYR QD 1 37 ILE H . . 4.060 3.476 3.381 3.627 . 0 0 "[ . 1]" 1
640 1 36 TYR QD 1 37 ILE HA . . 4.690 4.056 3.930 4.132 . 0 0 "[ . 1]" 1
641 1 36 TYR QD 1 37 ILE MD . . 4.010 3.544 3.222 3.898 . 0 0 "[ . 1]" 1
642 1 36 TYR QD 1 40 VAL MG1 . . 4.130 3.753 3.429 3.923 . 0 0 "[ . 1]" 1
643 1 36 TYR QD 1 50 ALA MB . . 4.680 4.550 4.035 4.687 0.007 8 0 "[ . 1]" 1
644 1 36 TYR QD 1 54 LEU HB3 . . 4.190 3.824 3.355 4.024 . 0 0 "[ . 1]" 1
645 1 36 TYR QD 1 54 LEU QD . . 3.430 2.448 2.309 2.554 . 0 0 "[ . 1]" 1
646 1 36 TYR QE 1 37 ILE HA . . 4.590 4.604 4.596 4.622 0.032 6 0 "[ . 1]" 1
647 1 36 TYR QE 1 37 ILE MD . . 5.260 4.991 4.753 5.262 0.002 9 0 "[ . 1]" 1
648 1 36 TYR QE 1 37 ILE HG13 . . 4.660 4.231 4.043 4.372 . 0 0 "[ . 1]" 1
649 1 36 TYR QE 1 40 VAL HA . . 5.500 4.526 4.172 4.782 . 0 0 "[ . 1]" 1
650 1 36 TYR QE 1 40 VAL MG1 . . 3.840 3.552 3.238 3.801 . 0 0 "[ . 1]" 1
651 1 36 TYR QE 1 40 VAL MG2 . . 4.150 3.372 2.916 3.613 . 0 0 "[ . 1]" 1
652 1 36 TYR QE 1 50 ALA H . . 5.500 5.299 4.616 5.506 0.006 8 0 "[ . 1]" 1
653 1 36 TYR QE 1 50 ALA HA . . 5.230 4.951 4.572 5.101 . 0 0 "[ . 1]" 1
654 1 36 TYR QE 1 50 ALA MB . . 3.490 2.918 2.547 3.146 . 0 0 "[ . 1]" 1
655 1 36 TYR QE 1 51 LEU H . . 4.080 3.838 3.270 4.053 . 0 0 "[ . 1]" 1
656 1 36 TYR QE 1 51 LEU HA . . 3.780 2.355 2.025 2.533 . 0 0 "[ . 1]" 1
657 1 36 TYR QE 1 51 LEU HB2 . . 5.040 4.912 4.396 5.049 0.009 10 0 "[ . 1]" 1
658 1 36 TYR QE 1 51 LEU HB3 . . 4.950 4.732 4.456 4.949 . 0 0 "[ . 1]" 1
659 1 36 TYR QE 1 51 LEU QD . . 3.390 2.954 2.540 3.389 . 0 0 "[ . 1]" 1
660 1 36 TYR QE 1 54 LEU HA . . 5.500 5.509 5.500 5.521 0.021 6 0 "[ . 1]" 1
661 1 36 TYR QE 1 54 LEU HB3 . . 4.860 3.041 3.019 3.069 . 0 0 "[ . 1]" 1
662 1 36 TYR QE 1 54 LEU QD . . 4.380 1.979 1.948 2.094 . 0 0 "[ . 1]" 1
663 1 37 ILE H 1 37 ILE HB . . 3.500 2.590 2.540 2.634 . 0 0 "[ . 1]" 1
664 1 37 ILE H 1 37 ILE MD . . 3.480 2.409 2.136 2.691 . 0 0 "[ . 1]" 1
665 1 37 ILE H 1 37 ILE HG13 . . 3.390 2.363 2.109 2.521 . 0 0 "[ . 1]" 1
666 1 37 ILE H 1 37 ILE MG . . 4.540 3.765 3.763 3.767 . 0 0 "[ . 1]" 1
667 1 37 ILE H 1 40 VAL MG1 . . 4.130 4.058 3.891 4.148 0.018 6 0 "[ . 1]" 1
668 1 37 ILE H 1 54 LEU QD . . 4.780 4.285 4.128 4.536 . 0 0 "[ . 1]" 1
669 1 37 ILE HA 1 37 ILE HG13 . . 4.010 2.417 2.343 2.528 . 0 0 "[ . 1]" 1
670 1 37 ILE HA 1 37 ILE MG . . 3.390 2.309 2.290 2.326 . 0 0 "[ . 1]" 1
671 1 37 ILE HA 1 39 SER H . . 4.790 4.537 4.371 4.745 . 0 0 "[ . 1]" 1
672 1 37 ILE HA 1 40 VAL H . . 4.620 3.997 3.889 4.111 . 0 0 "[ . 1]" 1
673 1 37 ILE HA 1 40 VAL MG1 . . 3.460 2.173 2.025 2.280 . 0 0 "[ . 1]" 1
674 1 37 ILE HA 1 40 VAL MG2 . . 4.910 4.625 4.450 4.823 . 0 0 "[ . 1]" 1
675 1 37 ILE HA 1 51 LEU HA . . 5.500 5.283 5.090 5.458 . 0 0 "[ . 1]" 1
676 1 37 ILE HA 1 51 LEU MD1 . . 4.860 4.209 2.552 4.865 0.005 8 0 "[ . 1]" 1
677 1 37 ILE HA 1 51 LEU QD . . 3.830 2.504 2.065 2.975 . 0 0 "[ . 1]" 1
678 1 37 ILE HA 1 51 LEU MD2 . . 4.860 2.702 2.076 4.353 . 0 0 "[ . 1]" 1
679 1 37 ILE HB 1 37 ILE MD . . 3.730 2.081 1.991 2.224 . 0 0 "[ . 1]" 1
680 1 37 ILE HB 1 38 ARG H . . 3.840 2.672 2.361 2.795 . 0 0 "[ . 1]" 1
681 1 37 ILE MD 1 37 ILE MG . . 3.160 2.845 2.610 3.003 . 0 0 "[ . 1]" 1
682 1 37 ILE MD 1 38 ARG H . . 4.910 3.876 3.543 4.100 . 0 0 "[ . 1]" 1
683 1 37 ILE MD 1 54 LEU QD . . 3.530 2.653 2.395 3.064 . 0 0 "[ . 1]" 1
684 1 37 ILE MD 1 78 ALA HA . . 5.500 4.622 4.023 5.180 . 0 0 "[ . 1]" 1
685 1 37 ILE MD 1 78 ALA MB . . 4.620 2.868 2.564 3.230 . 0 0 "[ . 1]" 1
686 1 37 ILE MD 1 79 TYR H . . 5.150 3.785 3.273 4.041 . 0 0 "[ . 1]" 1
687 1 37 ILE MD 1 79 TYR HB2 . . 5.500 3.424 2.946 3.947 . 0 0 "[ . 1]" 1
688 1 37 ILE MD 1 82 GLY QA . . 4.380 4.121 3.850 4.388 0.008 3 0 "[ . 1]" 1
689 1 37 ILE HG12 1 54 LEU QD . . 5.240 3.034 2.603 3.283 . 0 0 "[ . 1]" 1
690 1 37 ILE HG13 1 38 ARG H . . 4.700 4.486 4.370 4.595 . 0 0 "[ . 1]" 1
691 1 37 ILE HG13 1 40 VAL MG1 . . 4.070 3.999 3.826 4.081 0.011 2 0 "[ . 1]" 1
692 1 37 ILE HG13 1 51 LEU HA . . 5.360 4.722 4.356 5.065 . 0 0 "[ . 1]" 1
693 1 37 ILE MG 1 38 ARG H . . 4.480 3.519 3.219 3.622 . 0 0 "[ . 1]" 1
694 1 37 ILE MG 1 39 SER H . . 5.500 5.118 4.871 5.293 . 0 0 "[ . 1]" 1
695 1 37 ILE MG 1 54 LEU QD . . 4.580 4.029 3.680 4.226 . 0 0 "[ . 1]" 1
696 1 37 ILE MG 1 78 ALA MB . . 4.430 4.211 4.020 4.428 . 0 0 "[ . 1]" 1
697 1 37 ILE MG 1 79 TYR HA . . 4.190 3.514 2.995 4.008 . 0 0 "[ . 1]" 1
698 1 37 ILE MG 1 81 VAL QG . . 4.140 3.181 2.740 3.735 . 0 0 "[ . 1]" 1
699 1 37 ILE MG 1 82 GLY H . . 3.620 3.341 2.721 3.628 0.008 6 0 "[ . 1]" 1
700 1 37 ILE MG 1 82 GLY HA2 . . 4.400 2.762 2.482 3.283 . 0 0 "[ . 1]" 1
701 1 37 ILE MG 1 82 GLY QA . . 3.820 2.291 1.941 2.685 . 0 0 "[ . 1]" 1
702 1 37 ILE MG 1 82 GLY HA3 . . 4.400 2.466 2.027 2.848 . 0 0 "[ . 1]" 1
703 1 38 ARG H 1 38 ARG HB2 . . 4.160 3.180 2.705 3.624 . 0 0 "[ . 1]" 1
704 1 38 ARG H 1 38 ARG QB . . 3.590 2.356 2.228 2.528 . 0 0 "[ . 1]" 1
705 1 38 ARG H 1 38 ARG HB3 . . 4.160 2.444 2.351 2.580 . 0 0 "[ . 1]" 1
706 1 38 ARG H 1 38 ARG QG . . 4.520 3.068 2.122 3.947 . 0 0 "[ . 1]" 1
707 1 38 ARG H 1 39 SER H . . 3.450 2.507 2.387 2.653 . 0 0 "[ . 1]" 1
708 1 38 ARG H 1 40 VAL H . . 4.730 4.366 4.197 4.698 . 0 0 "[ . 1]" 1
709 1 38 ARG HA 1 38 ARG QG . . 3.660 2.950 2.558 3.344 . 0 0 "[ . 1]" 1
710 1 38 ARG HA 1 40 VAL H . . 5.360 4.863 4.671 5.059 . 0 0 "[ . 1]" 1
711 1 38 ARG HA 1 41 LEU HB2 . . 4.490 2.675 2.428 2.927 . 0 0 "[ . 1]" 1
712 1 38 ARG HA 1 41 LEU HB3 . . 4.450 3.520 3.299 3.741 . 0 0 "[ . 1]" 1
713 1 38 ARG HA 1 41 LEU QD . . 4.220 2.934 2.623 3.210 . 0 0 "[ . 1]" 1
714 1 38 ARG QB 1 38 ARG QD . . 3.240 2.202 2.094 2.349 . 0 0 "[ . 1]" 1
715 1 38 ARG HB2 1 39 SER H . . 4.000 3.925 3.859 3.994 . 0 0 "[ . 1]" 1
716 1 38 ARG HB3 1 39 SER H . . 4.000 3.246 2.499 3.961 . 0 0 "[ . 1]" 1
717 1 38 ARG QD 1 39 SER H . . 5.200 4.381 4.147 4.956 . 0 0 "[ . 1]" 1
718 1 38 ARG QG 1 39 SER H . . 4.570 2.791 2.204 3.439 . 0 0 "[ . 1]" 1
719 1 38 ARG QG 1 40 VAL H . . 5.340 4.965 4.519 5.345 0.005 1 0 "[ . 1]" 1
720 1 39 SER H 1 39 SER QB . . 3.230 2.309 2.138 2.547 . 0 0 "[ . 1]" 1
721 1 39 SER H 1 40 VAL H . . 3.600 2.799 2.668 2.908 . 0 0 "[ . 1]" 1
722 1 39 SER H 1 40 VAL HB . . 5.500 5.203 5.065 5.356 . 0 0 "[ . 1]" 1
723 1 39 SER H 1 40 VAL MG1 . . 4.110 3.735 3.616 3.841 . 0 0 "[ . 1]" 1
724 1 39 SER H 1 41 LEU H . . 5.070 3.957 3.864 4.017 . 0 0 "[ . 1]" 1
725 1 40 VAL H 1 40 VAL HB . . 3.600 2.518 2.468 2.555 . 0 0 "[ . 1]" 1
726 1 40 VAL H 1 40 VAL MG1 . . 2.980 2.098 1.996 2.178 . 0 0 "[ . 1]" 1
727 1 40 VAL H 1 40 VAL MG2 . . 3.870 3.761 3.755 3.763 . 0 0 "[ . 1]" 1
728 1 40 VAL H 1 41 LEU H . . 3.760 2.755 2.702 2.790 . 0 0 "[ . 1]" 1
729 1 40 VAL H 1 41 LEU HB2 . . 5.250 4.639 4.550 4.693 . 0 0 "[ . 1]" 1
730 1 40 VAL H 1 41 LEU HB3 . . 5.500 5.499 5.472 5.507 0.007 3 0 "[ . 1]" 1
731 1 40 VAL HA 1 40 VAL MG1 . . 3.530 3.199 3.189 3.204 . 0 0 "[ . 1]" 1
732 1 40 VAL HA 1 40 VAL MG2 . . 3.440 2.306 2.236 2.382 . 0 0 "[ . 1]" 1
733 1 40 VAL HA 1 42 LEU H . . 4.440 4.031 3.956 4.447 0.007 6 0 "[ . 1]" 1
734 1 40 VAL HA 1 43 ASP H . . 3.860 3.069 2.989 3.302 . 0 0 "[ . 1]" 1
735 1 40 VAL HA 1 46 LEU QB . . 4.330 3.101 2.288 3.764 . 0 0 "[ . 1]" 1
736 1 40 VAL HA 1 46 LEU QD . . 4.050 3.290 2.000 4.056 0.006 6 0 "[ . 1]" 1
737 1 40 VAL HB 1 41 LEU H . . 4.510 3.980 3.966 4.001 . 0 0 "[ . 1]" 1
738 1 40 VAL MG1 1 41 LEU H . . 3.400 2.094 1.921 2.177 . 0 0 "[ . 1]" 1
739 1 40 VAL MG1 1 41 LEU HA . . 4.300 3.178 3.034 3.325 . 0 0 "[ . 1]" 1
740 1 40 VAL MG1 1 41 LEU HB2 . . 4.030 3.275 3.135 3.317 . 0 0 "[ . 1]" 1
741 1 40 VAL MG1 1 41 LEU HB3 . . 4.870 4.452 4.369 4.505 . 0 0 "[ . 1]" 1
742 1 40 VAL MG1 1 41 LEU HG . . 4.310 4.234 4.147 4.318 0.008 6 0 "[ . 1]" 1
743 1 40 VAL MG1 1 42 LEU H . . 4.760 4.331 4.277 4.412 . 0 0 "[ . 1]" 1
744 1 40 VAL MG1 1 51 LEU QD . . 3.510 1.893 1.672 2.494 . 0 0 "[ . 1]" 1
745 1 40 VAL MG2 1 46 LEU HB2 . . 4.070 2.974 2.115 4.035 . 0 0 "[ . 1]" 1
746 1 40 VAL MG2 1 46 LEU QB . . 3.560 2.629 1.822 3.562 0.002 1 0 "[ . 1]" 1
747 1 40 VAL MG2 1 46 LEU HB3 . . 4.070 3.068 1.981 3.964 . 0 0 "[ . 1]" 1
748 1 40 VAL MG2 1 48 ARG H . . 4.980 4.768 4.045 4.989 0.009 6 0 "[ . 1]" 1
749 1 40 VAL MG2 1 48 ARG HA . . 4.200 2.947 1.948 3.470 . 0 0 "[ . 1]" 1
750 1 40 VAL MG2 1 48 ARG QB . . 4.920 4.162 2.098 4.685 . 0 0 "[ . 1]" 1
751 1 40 VAL MG2 1 48 ARG QD . . 5.230 3.981 3.474 4.696 . 0 0 "[ . 1]" 1
752 1 40 VAL MG2 1 48 ARG HG2 . . 4.330 3.848 2.854 4.335 0.005 5 0 "[ . 1]" 1
753 1 40 VAL MG2 1 48 ARG QG . . 3.770 3.083 2.770 3.638 . 0 0 "[ . 1]" 1
754 1 40 VAL MG2 1 48 ARG HG3 . . 4.330 3.583 2.931 4.343 0.013 1 0 "[ . 1]" 1
755 1 40 VAL MG2 1 51 LEU QD . . 3.440 2.225 1.848 3.022 . 0 0 "[ . 1]" 1
756 1 41 LEU H 1 41 LEU HB2 . . 3.720 2.117 2.095 2.132 . 0 0 "[ . 1]" 1
757 1 41 LEU H 1 41 LEU HB3 . . 3.530 3.000 2.969 3.046 . 0 0 "[ . 1]" 1
758 1 41 LEU H 1 41 LEU MD1 . . 4.730 4.068 3.855 4.193 . 0 0 "[ . 1]" 1
759 1 41 LEU H 1 41 LEU QD . . 4.090 3.715 3.627 3.750 . 0 0 "[ . 1]" 1
760 1 41 LEU H 1 41 LEU MD2 . . 4.730 4.303 4.222 4.417 . 0 0 "[ . 1]" 1
761 1 41 LEU H 1 42 LEU H . . 3.570 2.783 2.742 2.804 . 0 0 "[ . 1]" 1
762 1 41 LEU H 1 51 LEU QD . . 5.360 4.386 4.055 5.168 . 0 0 "[ . 1]" 1
763 1 41 LEU HA 1 41 LEU QD . . 3.020 2.580 2.355 2.931 . 0 0 "[ . 1]" 1
764 1 41 LEU HB2 1 41 LEU QD . . 3.140 2.252 2.116 2.352 . 0 0 "[ . 1]" 1
765 1 41 LEU HB2 1 42 LEU H . . 3.880 3.551 3.424 3.604 . 0 0 "[ . 1]" 1
766 1 41 LEU HB2 1 42 LEU MD1 . . 5.500 5.507 5.502 5.514 0.014 6 0 "[ . 1]" 1
767 1 41 LEU HB2 1 42 LEU MD2 . . 4.550 3.484 3.449 3.527 . 0 0 "[ . 1]" 1
768 1 41 LEU HB2 1 43 ASP H . . 5.500 5.471 5.365 5.505 0.005 3 0 "[ . 1]" 1
769 1 41 LEU HB3 1 42 LEU H . . 4.350 2.751 2.535 2.809 . 0 0 "[ . 1]" 1
770 1 41 LEU HB3 1 43 ASP H . . 5.500 4.918 4.803 4.955 . 0 0 "[ . 1]" 1
771 1 41 LEU QD 1 42 LEU H . . 5.050 3.713 3.622 3.795 . 0 0 "[ . 1]" 1
772 1 41 LEU QD 1 42 LEU MD2 . . 4.270 2.371 2.117 2.483 . 0 0 "[ . 1]" 1
773 1 41 LEU HG 1 42 LEU MD2 . . 4.470 4.440 4.287 4.482 0.012 6 0 "[ . 1]" 1
774 1 42 LEU H 1 42 LEU HB2 . . 3.000 2.292 2.246 2.320 . 0 0 "[ . 1]" 1
775 1 42 LEU H 1 42 LEU HB3 . . 3.840 3.563 3.536 3.579 . 0 0 "[ . 1]" 1
776 1 42 LEU H 1 42 LEU MD2 . . 3.240 2.387 2.221 2.479 . 0 0 "[ . 1]" 1
777 1 42 LEU H 1 43 ASP H . . 3.250 2.218 2.142 2.430 . 0 0 "[ . 1]" 1
778 1 42 LEU HA 1 42 LEU MD1 . . 3.130 2.113 2.106 2.120 . 0 0 "[ . 1]" 1
779 1 42 LEU HA 1 42 LEU MD2 . . 3.530 2.691 2.655 2.752 . 0 0 "[ . 1]" 1
780 1 42 LEU HA 1 42 LEU HG . . 4.110 3.697 3.696 3.697 . 0 0 "[ . 1]" 1
781 1 42 LEU HB2 1 42 LEU MD2 . . 3.490 2.282 2.231 2.318 . 0 0 "[ . 1]" 1
782 1 42 LEU HB2 1 43 ASP H . . 3.380 2.814 2.794 2.863 . 0 0 "[ . 1]" 1
783 1 42 LEU HB3 1 42 LEU MD1 . . 3.490 2.297 2.292 2.301 . 0 0 "[ . 1]" 1
784 1 42 LEU HB3 1 43 ASP H . . 3.840 3.524 3.508 3.565 . 0 0 "[ . 1]" 1
785 1 42 LEU MD2 1 43 ASP H . . 4.730 4.013 3.970 4.043 . 0 0 "[ . 1]" 1
786 1 43 ASP H 1 43 ASP QB . . 3.350 2.335 2.075 2.592 . 0 0 "[ . 1]" 1
787 1 43 ASP H 1 44 ARG H . . 4.650 4.494 4.306 4.636 . 0 0 "[ . 1]" 1
788 1 43 ASP H 1 46 LEU QD . . 5.390 4.475 3.707 5.076 . 0 0 "[ . 1]" 1
789 1 43 ASP HA 1 44 ARG H . . 3.120 2.214 2.141 2.454 . 0 0 "[ . 1]" 1
790 1 43 ASP HA 1 45 SER H . . 4.580 3.942 3.676 4.552 . 0 0 "[ . 1]" 1
791 1 43 ASP QB 1 44 ARG H . . 3.890 3.306 2.711 3.884 . 0 0 "[ . 1]" 1
792 1 43 ASP QB 1 46 LEU QD . . 3.870 2.144 1.880 2.884 . 0 0 "[ . 1]" 1
793 1 43 ASP HB2 1 44 ARG H . . 4.450 4.220 3.761 4.454 0.004 5 0 "[ . 1]" 1
794 1 43 ASP HB3 1 44 ARG H . . 4.450 3.481 2.781 4.279 . 0 0 "[ . 1]" 1
795 1 44 ARG H 1 44 ARG HB2 . . 3.760 2.698 2.248 3.759 . 0 0 "[ . 1]" 1
796 1 44 ARG H 1 44 ARG QB . . 3.260 2.518 2.224 3.013 . 0 0 "[ . 1]" 1
797 1 44 ARG H 1 44 ARG HB3 . . 3.760 3.521 3.037 3.763 0.003 4 0 "[ . 1]" 1
798 1 44 ARG H 1 44 ARG QD . . 4.570 3.492 2.283 4.572 0.002 4 0 "[ . 1]" 1
799 1 44 ARG H 1 44 ARG QG . . 3.540 2.625 1.997 3.492 . 0 0 "[ . 1]" 1
800 1 44 ARG HA 1 44 ARG QD . . 3.680 2.949 1.976 3.673 . 0 0 "[ . 1]" 1
801 1 44 ARG HA 1 44 ARG QG . . 3.520 2.745 2.163 3.430 . 0 0 "[ . 1]" 1
802 1 44 ARG QG 1 45 SER H . . 5.050 3.975 2.062 4.747 . 0 0 "[ . 1]" 1
803 1 45 SER H 1 46 LEU H . . 4.140 2.700 2.089 3.321 . 0 0 "[ . 1]" 1
804 1 45 SER H 1 46 LEU QB . . 5.340 4.421 3.881 4.887 . 0 0 "[ . 1]" 1
805 1 45 SER QB 1 46 LEU H . . 3.860 2.755 2.403 3.861 0.001 6 0 "[ . 1]" 1
806 1 45 SER QB 1 46 LEU QD . . 5.220 3.456 2.815 4.433 . 0 0 "[ . 1]" 1
807 1 46 LEU H 1 46 LEU MD1 . . 4.210 3.496 2.088 4.096 . 0 0 "[ . 1]" 1
808 1 46 LEU H 1 46 LEU QD . . 3.290 2.514 1.935 3.295 0.005 5 0 "[ . 1]" 1
809 1 46 LEU H 1 46 LEU MD2 . . 4.210 3.008 1.940 4.054 . 0 0 "[ . 1]" 1
810 1 46 LEU H 1 46 LEU HG . . 4.640 3.563 2.346 4.280 . 0 0 "[ . 1]" 1
811 1 46 LEU H 1 47 ASP H . . 4.760 4.630 4.566 4.644 . 0 0 "[ . 1]" 1
812 1 46 LEU HA 1 46 LEU QD . . 3.250 2.147 1.936 2.711 . 0 0 "[ . 1]" 1
813 1 46 LEU HA 1 47 ASP H . . 3.010 2.319 2.228 2.438 . 0 0 "[ . 1]" 1
814 1 46 LEU HA 1 47 ASP QB . . 5.230 4.520 4.305 4.668 . 0 0 "[ . 1]" 1
815 1 46 LEU QB 1 47 ASP H . . 3.460 2.691 2.399 2.856 . 0 0 "[ . 1]" 1
816 1 46 LEU HB2 1 47 ASP H . . 4.150 4.014 3.710 4.145 . 0 0 "[ . 1]" 1
817 1 46 LEU HB3 1 47 ASP H . . 4.150 2.735 2.424 2.910 . 0 0 "[ . 1]" 1
818 1 46 LEU QD 1 47 ASP H . . 3.860 2.800 2.174 3.806 . 0 0 "[ . 1]" 1
819 1 47 ASP H 1 47 ASP QB . . 2.950 2.401 2.187 2.672 . 0 0 "[ . 1]" 1
820 1 47 ASP H 1 48 ARG H . . 4.630 4.583 4.528 4.638 0.008 3 0 "[ . 1]" 1
821 1 47 ASP HA 1 48 ARG H . . 3.230 2.195 2.147 2.308 . 0 0 "[ . 1]" 1
822 1 47 ASP HA 1 49 SER H . . 4.100 3.986 3.799 4.104 0.004 3 0 "[ . 1]" 1
823 1 47 ASP QB 1 49 SER H . . 4.960 3.278 2.639 3.930 . 0 0 "[ . 1]" 1
824 1 48 ARG H 1 48 ARG HB2 . . 4.150 2.462 2.207 3.667 . 0 0 "[ . 1]" 1
825 1 48 ARG H 1 48 ARG QB . . 3.560 2.370 2.184 3.012 . 0 0 "[ . 1]" 1
826 1 48 ARG H 1 48 ARG HB3 . . 4.150 3.529 3.201 3.727 . 0 0 "[ . 1]" 1
827 1 48 ARG H 1 48 ARG QD . . 4.730 3.410 2.370 4.731 0.001 2 0 "[ . 1]" 1
828 1 48 ARG H 1 48 ARG HG2 . . 4.480 3.995 2.799 4.485 0.005 5 0 "[ . 1]" 1
829 1 48 ARG H 1 48 ARG QG . . 3.870 3.080 1.914 3.667 . 0 0 "[ . 1]" 1
830 1 48 ARG H 1 48 ARG HG3 . . 4.480 3.228 1.949 3.890 . 0 0 "[ . 1]" 1
831 1 48 ARG H 1 51 LEU QD . . 5.060 4.708 4.093 5.059 . 0 0 "[ . 1]" 1
832 1 48 ARG HA 1 48 ARG QD . . 4.590 3.564 3.080 4.159 . 0 0 "[ . 1]" 1
833 1 48 ARG HA 1 48 ARG QG . . 3.730 2.349 2.125 3.320 . 0 0 "[ . 1]" 1
834 1 48 ARG HA 1 50 ALA H . . 4.840 4.017 3.722 4.277 . 0 0 "[ . 1]" 1
835 1 48 ARG HA 1 51 LEU H . . 4.080 3.607 3.363 3.777 . 0 0 "[ . 1]" 1
836 1 48 ARG HA 1 51 LEU QD . . 3.950 2.439 1.961 2.751 . 0 0 "[ . 1]" 1
837 1 48 ARG QB 1 49 SER H . . 4.130 2.876 2.605 3.824 . 0 0 "[ . 1]" 1
838 1 48 ARG HB2 1 49 SER H . . 4.770 3.028 2.729 4.152 . 0 0 "[ . 1]" 1
839 1 48 ARG HB3 1 49 SER H . . 4.770 3.626 3.297 4.475 . 0 0 "[ . 1]" 1
840 1 48 ARG QD 1 51 LEU QD . . 4.390 4.042 2.880 4.396 0.006 2 0 "[ . 1]" 1
841 1 48 ARG QG 1 49 SER H . . 5.160 4.169 1.963 4.549 . 0 0 "[ . 1]" 1
842 1 49 SER H 1 50 ALA H . . 3.740 2.686 2.361 2.788 . 0 0 "[ . 1]" 1
843 1 49 SER H 1 50 ALA MB . . 4.520 4.255 3.956 4.374 . 0 0 "[ . 1]" 1
844 1 50 ALA H 1 50 ALA MB . . 2.970 2.099 2.036 2.170 . 0 0 "[ . 1]" 1
845 1 50 ALA H 1 51 LEU HB2 . . 4.800 4.774 4.489 4.823 0.023 9 0 "[ . 1]" 1
846 1 50 ALA H 1 53 ARG QB . . 5.130 4.692 4.431 4.939 . 0 0 "[ . 1]" 1
847 1 50 ALA HA 1 53 ARG H . . 4.370 2.967 2.892 3.024 . 0 0 "[ . 1]" 1
848 1 50 ALA HA 1 53 ARG HA . . 5.500 4.832 4.730 4.895 . 0 0 "[ . 1]" 1
849 1 50 ALA HA 1 53 ARG QB . . 4.190 2.227 2.028 2.325 . 0 0 "[ . 1]" 1
850 1 50 ALA HA 1 53 ARG HD2 . . 5.500 5.015 3.746 5.482 . 0 0 "[ . 1]" 1
851 1 50 ALA HA 1 53 ARG HD3 . . 5.500 4.564 2.153 5.294 . 0 0 "[ . 1]" 1
852 1 50 ALA HA 1 53 ARG QG . . 4.410 3.189 2.299 4.118 . 0 0 "[ . 1]" 1
853 1 50 ALA MB 1 51 LEU H . . 3.840 2.795 2.707 2.888 . 0 0 "[ . 1]" 1
854 1 50 ALA MB 1 53 ARG H . . 5.230 4.246 4.145 4.290 . 0 0 "[ . 1]" 1
855 1 50 ALA MB 1 53 ARG QB . . 4.620 3.363 3.234 3.448 . 0 0 "[ . 1]" 1
856 1 51 LEU H 1 51 LEU HB2 . . 3.330 2.342 2.245 2.374 . 0 0 "[ . 1]" 1
857 1 51 LEU H 1 51 LEU QD . . 3.920 2.935 1.957 3.320 . 0 0 "[ . 1]" 1
858 1 51 LEU H 1 52 HIS H . . 3.810 2.793 2.786 2.805 . 0 0 "[ . 1]" 1
859 1 51 LEU H 1 86 GLY QA . . 5.010 4.428 3.844 4.809 . 0 0 "[ . 1]" 1
860 1 51 LEU HA 1 51 LEU MD1 . . 4.610 3.611 1.955 3.866 . 0 0 "[ . 1]" 1
861 1 51 LEU HA 1 51 LEU QD . . 3.390 2.399 1.902 2.991 . 0 0 "[ . 1]" 1
862 1 51 LEU HA 1 51 LEU MD2 . . 4.610 2.528 2.230 3.385 . 0 0 "[ . 1]" 1
863 1 51 LEU HA 1 54 LEU H . . 4.250 3.964 3.847 4.102 . 0 0 "[ . 1]" 1
864 1 51 LEU HA 1 54 LEU HB3 . . 5.500 3.689 3.519 3.885 . 0 0 "[ . 1]" 1
865 1 51 LEU HA 1 54 LEU QD . . 3.920 1.912 1.876 1.971 . 0 0 "[ . 1]" 1
866 1 51 LEU HB2 1 52 HIS H . . 4.960 2.818 2.789 2.905 . 0 0 "[ . 1]" 1
867 1 51 LEU HB2 1 86 GLY H . . 4.740 4.224 3.584 4.741 0.001 6 0 "[ . 1]" 1
868 1 51 LEU HB2 1 86 GLY QA . . 4.660 2.529 2.003 3.002 . 0 0 "[ . 1]" 1
869 1 51 LEU HB2 1 87 ARG H . . 5.380 5.221 4.883 5.386 0.006 10 0 "[ . 1]" 1
870 1 51 LEU HB3 1 52 HIS H . . 4.630 3.551 3.439 3.591 . 0 0 "[ . 1]" 1
871 1 51 LEU HB3 1 86 GLY H . . 4.410 3.846 3.102 4.413 0.003 3 0 "[ . 1]" 1
872 1 51 LEU HB3 1 86 GLY QA . . 4.590 3.118 2.726 3.683 . 0 0 "[ . 1]" 1
873 1 51 LEU QD 1 52 HIS H . . 5.390 4.099 3.824 4.201 . 0 0 "[ . 1]" 1
874 1 51 LEU QD 1 82 GLY QA . . 3.750 2.658 2.254 3.228 . 0 0 "[ . 1]" 1
875 1 51 LEU QD 1 85 THR H . . 4.640 4.462 4.145 4.650 0.010 7 0 "[ . 1]" 1
876 1 51 LEU QD 1 85 THR HA . . 5.440 5.104 4.719 5.446 0.006 6 0 "[ . 1]" 1
877 1 51 LEU QD 1 85 THR MG . . 4.210 3.722 2.640 4.208 . 0 0 "[ . 1]" 1
878 1 51 LEU QD 1 86 GLY H . . 3.880 2.942 2.560 3.593 . 0 0 "[ . 1]" 1
879 1 51 LEU QD 1 86 GLY QA . . 3.450 2.007 1.838 2.597 . 0 0 "[ . 1]" 1
880 1 51 LEU QD 1 87 ARG H . . 5.160 4.479 4.163 5.164 0.004 2 0 "[ . 1]" 1
881 1 51 LEU MD1 1 86 GLY H . . 4.650 3.144 2.576 4.400 . 0 0 "[ . 1]" 1
882 1 51 LEU MD2 1 86 GLY H . . 4.650 4.200 3.053 4.650 . 0 0 "[ . 1]" 1
883 1 52 HIS H 1 53 ARG QB . . 4.980 4.220 4.061 4.452 . 0 0 "[ . 1]" 1
884 1 52 HIS H 1 83 ILE HG12 . . 5.500 4.700 3.933 5.500 0.000 9 0 "[ . 1]" 1
885 1 52 HIS HA 1 52 HIS HD2 . . 3.790 2.863 2.310 3.662 . 0 0 "[ . 1]" 1
886 1 52 HIS HA 1 83 ILE MD . . 4.560 3.496 2.526 4.241 . 0 0 "[ . 1]" 1
887 1 52 HIS HA 1 83 ILE HG12 . . 5.500 2.328 2.002 3.083 . 0 0 "[ . 1]" 1
888 1 52 HIS HA 1 83 ILE MG . . 4.540 2.650 1.960 3.371 . 0 0 "[ . 1]" 1
889 1 52 HIS QB 1 53 ARG H . . 3.990 2.719 2.691 2.750 . 0 0 "[ . 1]" 1
890 1 52 HIS QB 1 83 ILE MG . . 4.420 2.692 2.040 3.480 . 0 0 "[ . 1]" 1
891 1 52 HIS HB2 1 53 ARG H . . 4.830 3.626 2.744 4.046 . 0 0 "[ . 1]" 1
892 1 52 HIS HB3 1 53 ARG H . . 4.830 3.118 2.750 3.952 . 0 0 "[ . 1]" 1
893 1 52 HIS HD2 1 83 ILE MG . . 3.830 2.455 1.936 2.852 . 0 0 "[ . 1]" 1
894 1 53 ARG H 1 53 ARG HB2 . . 3.900 2.343 2.212 2.555 . 0 0 "[ . 1]" 1
895 1 53 ARG H 1 53 ARG QB . . 3.330 2.285 2.145 2.504 . 0 0 "[ . 1]" 1
896 1 53 ARG H 1 53 ARG HB3 . . 3.900 3.269 2.686 3.590 . 0 0 "[ . 1]" 1
897 1 53 ARG H 1 53 ARG QG . . 4.370 3.097 2.046 4.044 . 0 0 "[ . 1]" 1
898 1 53 ARG H 1 54 LEU H . . 3.620 2.714 2.663 2.772 . 0 0 "[ . 1]" 1
899 1 53 ARG H 1 54 LEU HB3 . . 4.830 4.771 4.696 4.834 0.004 5 0 "[ . 1]" 1
900 1 53 ARG H 1 54 LEU QD . . 5.440 4.485 4.477 4.495 . 0 0 "[ . 1]" 1
901 1 53 ARG H 1 54 LEU HG . . 5.500 4.672 4.647 4.734 . 0 0 "[ . 1]" 1
902 1 53 ARG HA 1 53 ARG QD . . 3.260 2.386 2.159 3.011 . 0 0 "[ . 1]" 1
903 1 53 ARG HA 1 53 ARG QG . . 3.520 2.559 2.198 2.818 . 0 0 "[ . 1]" 1
904 1 53 ARG HA 1 54 LEU HG . . 5.500 5.511 5.502 5.526 0.026 1 0 "[ . 1]" 1
905 1 53 ARG QB 1 53 ARG QD . . 3.290 2.275 2.107 2.580 . 0 0 "[ . 1]" 1
906 1 53 ARG QB 1 54 LEU H . . 3.820 2.514 2.443 2.608 . 0 0 "[ . 1]" 1
907 1 53 ARG HB2 1 54 LEU H . . 4.610 3.006 2.536 3.749 . 0 0 "[ . 1]" 1
908 1 53 ARG HB3 1 54 LEU H . . 4.610 3.104 2.488 3.654 . 0 0 "[ . 1]" 1
909 1 53 ARG QG 1 54 LEU H . . 4.840 4.069 3.822 4.484 . 0 0 "[ . 1]" 1
910 1 54 LEU H 1 54 LEU HB3 . . 3.270 2.251 2.236 2.257 . 0 0 "[ . 1]" 1
911 1 54 LEU H 1 54 LEU QD . . 4.250 3.077 3.057 3.113 . 0 0 "[ . 1]" 1
912 1 54 LEU H 1 54 LEU HG . . 3.640 2.837 2.820 2.871 . 0 0 "[ . 1]" 1
913 1 54 LEU HA 1 54 LEU QD . . 4.160 3.279 3.252 3.324 . 0 0 "[ . 1]" 1
914 1 54 LEU HA 1 54 LEU HG . . 3.720 3.687 3.686 3.689 . 0 0 "[ . 1]" 1
915 1 54 LEU HA 1 55 THR HA . . 4.760 4.453 4.385 4.549 . 0 0 "[ . 1]" 1
916 1 54 LEU HA 1 56 LEU H . . 5.300 5.186 4.835 5.308 0.008 9 0 "[ . 1]" 1
917 1 54 LEU HB3 1 54 LEU QD . . 3.090 2.018 1.971 2.145 . 0 0 "[ . 1]" 1
918 1 54 LEU QD 1 79 TYR HA . . 4.500 3.201 2.808 3.427 . 0 0 "[ . 1]" 1
919 1 54 LEU QD 1 79 TYR QD . . 3.800 2.508 1.967 2.991 . 0 0 "[ . 1]" 1
920 1 54 LEU HG 1 55 THR H . . 5.500 4.322 3.921 4.489 . 0 0 "[ . 1]" 1
921 1 54 LEU HG 1 79 TYR QD . . 4.030 3.836 3.574 4.036 0.006 3 0 "[ . 1]" 1
922 1 55 THR H 1 55 THR MG . . 4.120 3.978 3.868 4.056 . 0 0 "[ . 1]" 1
923 1 55 THR HA 1 55 THR MG . . 3.120 2.235 2.116 2.341 . 0 0 "[ . 1]" 1
924 1 55 THR HA 1 56 LEU HA . . 4.610 4.422 4.386 4.491 . 0 0 "[ . 1]" 1
925 1 55 THR HB 1 56 LEU HA . . 4.830 4.677 4.593 4.767 . 0 0 "[ . 1]" 1
926 1 55 THR MG 1 56 LEU H . . 5.330 3.571 3.385 3.843 . 0 0 "[ . 1]" 1
927 1 55 THR MG 1 56 LEU HA . . 4.720 4.109 3.865 4.466 . 0 0 "[ . 1]" 1
928 1 56 LEU H 1 56 LEU QD . . 5.120 3.667 3.408 3.860 . 0 0 "[ . 1]" 1
929 1 56 LEU H 1 56 LEU HG . . 5.020 4.694 4.372 4.920 . 0 0 "[ . 1]" 1
930 1 56 LEU HA 1 56 LEU QD . . 3.670 2.072 1.927 2.545 . 0 0 "[ . 1]" 1
931 1 56 LEU HA 1 59 ILE MG . . 5.020 4.547 4.257 4.868 . 0 0 "[ . 1]" 1
932 1 56 LEU QD 1 57 GLY H . . 4.490 2.375 1.914 3.060 . 0 0 "[ . 1]" 1
933 1 56 LEU QD 1 58 SER H . . 5.060 4.175 3.829 4.818 . 0 0 "[ . 1]" 1
934 1 56 LEU QD 1 59 ILE MD . . 3.710 2.578 2.178 3.063 . 0 0 "[ . 1]" 1
935 1 56 LEU QD 1 59 ILE HG12 . . 4.120 3.126 2.558 3.856 . 0 0 "[ . 1]" 1
936 1 57 GLY H 1 58 SER H . . 3.900 2.720 2.442 3.043 . 0 0 "[ . 1]" 1
937 1 57 GLY QA 1 60 ALA MB . . 3.780 2.399 2.279 2.532 . 0 0 "[ . 1]" 1
938 1 57 GLY QA 1 76 LYS HA . . 4.220 3.093 2.449 3.746 . 0 0 "[ . 1]" 1
939 1 57 GLY HA2 1 60 ALA H . . 4.780 3.072 2.975 3.203 . 0 0 "[ . 1]" 1
940 1 57 GLY HA2 1 60 ALA MB . . 4.520 2.427 2.299 2.571 . 0 0 "[ . 1]" 1
941 1 57 GLY HA3 1 60 ALA H . . 4.780 4.340 4.233 4.489 . 0 0 "[ . 1]" 1
942 1 57 GLY HA3 1 60 ALA MB . . 4.520 3.798 3.673 3.911 . 0 0 "[ . 1]" 1
943 1 58 SER H 1 58 SER QB . . 3.220 2.488 2.259 2.731 . 0 0 "[ . 1]" 1
944 1 58 SER H 1 59 ILE H . . 3.790 2.698 2.610 2.763 . 0 0 "[ . 1]" 1
945 1 58 SER H 1 59 ILE HG12 . . 4.460 4.025 3.908 4.102 . 0 0 "[ . 1]" 1
946 1 58 SER H 1 59 ILE MG . . 4.670 4.239 4.033 4.356 . 0 0 "[ . 1]" 1
947 1 58 SER H 1 60 ALA H . . 5.150 4.118 4.021 4.217 . 0 0 "[ . 1]" 1
948 1 58 SER H 1 61 VAL MG1 . . 5.490 4.022 3.941 4.230 . 0 0 "[ . 1]" 1
949 1 58 SER HA 1 61 VAL H . . 4.210 3.664 3.573 3.751 . 0 0 "[ . 1]" 1
950 1 58 SER HA 1 61 VAL HB . . 3.980 3.786 3.678 3.859 . 0 0 "[ . 1]" 1
951 1 58 SER HA 1 61 VAL MG1 . . 4.350 1.947 1.876 2.062 . 0 0 "[ . 1]" 1
952 1 58 SER HA 1 62 LYS H . . 4.790 4.653 4.395 4.815 0.025 5 0 "[ . 1]" 1
953 1 58 SER QB 1 59 ILE H . . 3.720 2.817 2.769 2.869 . 0 0 "[ . 1]" 1
954 1 58 SER QB 1 59 ILE HA . . 4.020 3.964 3.923 3.987 . 0 0 "[ . 1]" 1
955 1 58 SER QB 1 59 ILE MG . . 4.080 3.134 3.053 3.233 . 0 0 "[ . 1]" 1
956 1 59 ILE H 1 59 ILE MD . . 4.040 3.579 3.551 3.609 . 0 0 "[ . 1]" 1
957 1 59 ILE H 1 59 ILE HG12 . . 3.330 1.973 1.943 2.029 . 0 0 "[ . 1]" 1
958 1 59 ILE H 1 59 ILE HG13 . . 3.990 3.142 3.080 3.209 . 0 0 "[ . 1]" 1
959 1 59 ILE H 1 59 ILE MG . . 3.690 2.430 2.296 2.564 . 0 0 "[ . 1]" 1
960 1 59 ILE H 1 60 ALA H . . 3.780 2.376 2.341 2.430 . 0 0 "[ . 1]" 1
961 1 59 ILE H 1 61 VAL H . . 5.500 3.931 3.859 4.003 . 0 0 "[ . 1]" 1
962 1 59 ILE HA 1 59 ILE MD . . 4.260 4.171 4.167 4.177 . 0 0 "[ . 1]" 1
963 1 59 ILE HA 1 59 ILE MG . . 3.670 2.300 2.264 2.355 . 0 0 "[ . 1]" 1
964 1 59 ILE HA 1 63 GLU H . . 4.610 3.600 3.502 3.772 . 0 0 "[ . 1]" 1
965 1 59 ILE HB 1 59 ILE MD . . 3.450 2.374 2.352 2.405 . 0 0 "[ . 1]" 1
966 1 59 ILE HB 1 60 ALA H . . 4.510 3.848 3.804 3.901 . 0 0 "[ . 1]" 1
967 1 59 ILE MD 1 60 ALA H . . 4.600 3.872 3.829 3.911 . 0 0 "[ . 1]" 1
968 1 59 ILE HG12 1 60 ALA H . . 3.350 2.574 2.516 2.673 . 0 0 "[ . 1]" 1
969 1 59 ILE HG13 1 60 ALA H . . 4.110 2.368 2.320 2.430 . 0 0 "[ . 1]" 1
970 1 59 ILE HG13 1 60 ALA MB . . 4.210 3.024 2.991 3.065 . 0 0 "[ . 1]" 1
971 1 59 ILE MG 1 60 ALA H . . 4.330 3.936 3.888 3.961 . 0 0 "[ . 1]" 1
972 1 59 ILE MG 1 63 GLU H . . 5.500 5.209 5.141 5.319 . 0 0 "[ . 1]" 1
973 1 59 ILE MG 1 63 GLU HG2 . . 5.500 4.651 4.245 5.083 . 0 0 "[ . 1]" 1
974 1 60 ALA H 1 60 ALA MB . . 3.470 2.219 2.197 2.256 . 0 0 "[ . 1]" 1
975 1 60 ALA H 1 61 VAL H . . 3.890 2.478 2.450 2.545 . 0 0 "[ . 1]" 1
976 1 60 ALA H 1 75 LEU HB3 . . 5.470 5.324 4.953 5.485 0.015 9 0 "[ . 1]" 1
977 1 60 ALA HA 1 63 GLU H . . 4.490 3.611 3.458 3.659 . 0 0 "[ . 1]" 1
978 1 60 ALA HA 1 64 PHE H . . 4.450 2.327 2.268 2.430 . 0 0 "[ . 1]" 1
979 1 60 ALA HA 1 64 PHE HB2 . . 4.410 2.529 2.269 2.898 . 0 0 "[ . 1]" 1
980 1 60 ALA HA 1 64 PHE QD . . 3.720 2.410 2.302 2.746 . 0 0 "[ . 1]" 1
981 1 60 ALA MB 1 61 VAL H . . 3.340 2.660 2.574 2.708 . 0 0 "[ . 1]" 1
982 1 60 ALA MB 1 61 VAL HA . . 4.670 3.851 3.816 3.864 . 0 0 "[ . 1]" 1
983 1 60 ALA MB 1 61 VAL HB . . 4.930 4.153 4.110 4.216 . 0 0 "[ . 1]" 1
984 1 60 ALA MB 1 61 VAL MG1 . . 4.590 4.115 4.005 4.253 . 0 0 "[ . 1]" 1
985 1 60 ALA MB 1 64 PHE H . . 4.660 3.715 3.677 3.762 . 0 0 "[ . 1]" 1
986 1 60 ALA MB 1 64 PHE HB2 . . 3.710 2.513 2.369 2.748 . 0 0 "[ . 1]" 1
987 1 60 ALA MB 1 64 PHE QD . . 4.650 2.272 2.029 2.689 . 0 0 "[ . 1]" 1
988 1 60 ALA MB 1 65 ASP H . . 5.500 5.540 5.513 5.566 0.066 7 0 "[ . 1]" 1
989 1 60 ALA MB 1 72 SER H . . 4.400 3.677 3.157 4.240 . 0 0 "[ . 1]" 1
990 1 60 ALA MB 1 72 SER HA . . 4.000 2.145 1.900 2.485 . 0 0 "[ . 1]" 1
991 1 60 ALA MB 1 72 SER HB2 . . 5.330 2.591 1.963 4.377 . 0 0 "[ . 1]" 1
992 1 60 ALA MB 1 72 SER QB . . 4.670 2.490 1.952 3.609 . 0 0 "[ . 1]" 1
993 1 60 ALA MB 1 72 SER HB3 . . 5.330 3.799 3.420 4.553 . 0 0 "[ . 1]" 1
994 1 60 ALA MB 1 75 LEU H . . 4.660 4.524 4.251 4.664 0.004 4 0 "[ . 1]" 1
995 1 60 ALA MB 1 75 LEU HB2 . . 4.090 3.039 2.705 3.187 . 0 0 "[ . 1]" 1
996 1 60 ALA MB 1 75 LEU HB3 . . 3.910 3.310 2.962 3.606 . 0 0 "[ . 1]" 1
997 1 60 ALA MB 1 75 LEU QD . . 4.200 3.081 1.694 3.583 . 0 0 "[ . 1]" 1
998 1 60 ALA MB 1 75 LEU HG . . 3.830 3.277 2.907 3.869 0.039 8 0 "[ . 1]" 1
999 1 60 ALA MB 1 76 LYS H . . 5.430 4.295 3.951 4.597 . 0 0 "[ . 1]" 1
1000 1 61 VAL H 1 61 VAL HB . . 3.260 2.536 2.420 2.603 . 0 0 "[ . 1]" 1
1001 1 61 VAL H 1 61 VAL MG1 . . 3.190 2.125 2.020 2.405 . 0 0 "[ . 1]" 1
1002 1 61 VAL H 1 61 VAL MG2 . . 3.840 3.763 3.741 3.768 . 0 0 "[ . 1]" 1
1003 1 61 VAL H 1 62 LYS H . . 3.580 2.581 2.549 2.670 . 0 0 "[ . 1]" 1
1004 1 61 VAL HA 1 61 VAL MG1 . . 3.320 3.200 3.184 3.203 . 0 0 "[ . 1]" 1
1005 1 61 VAL HA 1 61 VAL MG2 . . 3.450 2.261 2.187 2.338 . 0 0 "[ . 1]" 1
1006 1 61 VAL HA 1 65 ASP HA . . 4.350 3.324 3.202 3.524 . 0 0 "[ . 1]" 1
1007 1 61 VAL HA 1 65 ASP QB . . 4.080 4.083 3.987 4.112 0.032 3 0 "[ . 1]" 1
1008 1 61 VAL HB 1 62 LYS H . . 4.400 4.085 4.054 4.147 . 0 0 "[ . 1]" 1
1009 1 61 VAL MG1 1 62 LYS HA . . 3.630 3.439 3.368 3.527 . 0 0 "[ . 1]" 1
1010 1 61 VAL MG1 1 62 LYS QB . . 4.770 2.703 2.580 3.152 . 0 0 "[ . 1]" 1
1011 1 61 VAL MG1 1 63 GLU H . . 5.500 4.311 4.238 4.396 . 0 0 "[ . 1]" 1
1012 1 61 VAL MG1 1 76 LYS QE . . 4.120 3.839 2.556 4.130 0.010 6 0 "[ . 1]" 1
1013 1 61 VAL MG2 1 62 LYS H . . 4.540 3.891 3.777 4.000 . 0 0 "[ . 1]" 1
1014 1 61 VAL MG2 1 76 LYS QE . . 4.650 2.648 2.251 3.003 . 0 0 "[ . 1]" 1
1015 1 62 LYS H 1 62 LYS HB2 . . 4.020 2.645 2.269 2.849 . 0 0 "[ . 1]" 1
1016 1 62 LYS H 1 62 LYS QB . . 3.300 2.357 2.242 2.393 . 0 0 "[ . 1]" 1
1017 1 62 LYS H 1 62 LYS HB3 . . 4.020 2.748 2.512 3.515 . 0 0 "[ . 1]" 1
1018 1 62 LYS H 1 62 LYS QG . . 4.230 3.974 3.188 4.135 . 0 0 "[ . 1]" 1
1019 1 62 LYS H 1 63 GLU H . . 4.100 2.353 2.324 2.370 . 0 0 "[ . 1]" 1
1020 1 62 LYS HA 1 62 LYS QD . . 5.050 2.850 1.991 4.033 . 0 0 "[ . 1]" 1
1021 1 62 LYS QB 1 63 GLU H . . 3.510 2.273 2.236 2.419 . 0 0 "[ . 1]" 1
1022 1 62 LYS HB2 1 63 GLU H . . 4.050 3.482 2.558 3.713 . 0 0 "[ . 1]" 1
1023 1 62 LYS HB3 1 63 GLU H . . 4.050 2.351 2.258 2.983 . 0 0 "[ . 1]" 1
1024 1 62 LYS QE 1 62 LYS QG . . 3.330 2.219 2.027 2.415 . 0 0 "[ . 1]" 1
1025 1 62 LYS QG 1 63 GLU H . . 5.060 3.674 3.337 4.221 . 0 0 "[ . 1]" 1
1026 1 63 GLU H 1 63 GLU HB2 . . 3.940 2.472 2.238 2.579 . 0 0 "[ . 1]" 1
1027 1 63 GLU H 1 63 GLU HB3 . . 3.930 3.585 3.527 3.603 . 0 0 "[ . 1]" 1
1028 1 63 GLU H 1 63 GLU HG2 . . 4.270 2.696 2.055 3.925 . 0 0 "[ . 1]" 1
1029 1 63 GLU H 1 63 GLU HG3 . . 4.270 3.494 2.671 4.083 . 0 0 "[ . 1]" 1
1030 1 63 GLU H 1 64 PHE H . . 3.720 2.677 2.597 2.801 . 0 0 "[ . 1]" 1
1031 1 63 GLU H 1 65 ASP H . . 5.500 4.100 4.064 4.136 . 0 0 "[ . 1]" 1
1032 1 63 GLU HA 1 63 GLU HG2 . . 4.230 3.144 2.440 3.669 . 0 0 "[ . 1]" 1
1033 1 63 GLU HA 1 63 GLU HG3 . . 4.000 3.399 2.384 3.827 . 0 0 "[ . 1]" 1
1034 1 63 GLU HB2 1 64 PHE H . . 4.650 2.372 2.292 2.583 . 0 0 "[ . 1]" 1
1035 1 63 GLU HB2 1 64 PHE HB2 . . 4.560 4.313 4.159 4.459 . 0 0 "[ . 1]" 1
1036 1 63 GLU HB2 1 64 PHE QD . . 4.170 3.953 3.769 4.160 . 0 0 "[ . 1]" 1
1037 1 63 GLU HB3 1 64 PHE H . . 4.890 3.403 3.078 3.547 . 0 0 "[ . 1]" 1
1038 1 63 GLU HB3 1 64 PHE QD . . 4.510 4.201 3.803 4.524 0.014 4 0 "[ . 1]" 1
1039 1 63 GLU HG3 1 64 PHE H . . 5.370 4.640 4.178 5.019 . 0 0 "[ . 1]" 1
1040 1 64 PHE H 1 65 ASP H . . 3.410 2.963 2.959 2.967 . 0 0 "[ . 1]" 1
1041 1 64 PHE H 1 65 ASP QB . . 4.760 4.352 4.285 4.401 . 0 0 "[ . 1]" 1
1042 1 64 PHE HA 1 64 PHE QD . . 3.580 2.098 2.004 2.189 . 0 0 "[ . 1]" 1
1043 1 64 PHE HA 1 66 GLU H . . 4.820 4.172 4.118 4.250 . 0 0 "[ . 1]" 1
1044 1 64 PHE HA 1 67 THR H . . 4.270 3.653 3.540 3.822 . 0 0 "[ . 1]" 1
1045 1 64 PHE HA 1 68 ASP H . . 3.930 2.671 2.267 2.878 . 0 0 "[ . 1]" 1
1046 1 64 PHE HB2 1 65 ASP H . . 5.000 4.166 4.149 4.197 . 0 0 "[ . 1]" 1
1047 1 64 PHE HB2 1 72 SER H . . 4.390 3.797 3.404 4.159 . 0 0 "[ . 1]" 1
1048 1 64 PHE HB2 1 72 SER QB . . 5.060 2.809 2.264 4.131 . 0 0 "[ . 1]" 1
1049 1 64 PHE HB3 1 65 ASP H . . 5.000 4.448 4.381 4.510 . 0 0 "[ . 1]" 1
1050 1 64 PHE HB3 1 68 ASP H . . 4.640 3.321 3.053 3.770 . 0 0 "[ . 1]" 1
1051 1 64 PHE HB3 1 72 SER H . . 4.460 3.427 2.987 3.918 . 0 0 "[ . 1]" 1
1052 1 64 PHE HB3 1 72 SER HB2 . . 5.340 3.555 2.834 4.340 . 0 0 "[ . 1]" 1
1053 1 64 PHE HB3 1 72 SER QB . . 4.510 3.392 2.760 4.157 . 0 0 "[ . 1]" 1
1054 1 64 PHE HB3 1 72 SER HB3 . . 5.340 4.336 3.796 5.318 . 0 0 "[ . 1]" 1
1055 1 64 PHE QD 1 67 THR H . . 5.320 4.934 4.682 5.147 . 0 0 "[ . 1]" 1
1056 1 64 PHE QD 1 68 ASP H . . 4.450 3.554 2.741 4.128 . 0 0 "[ . 1]" 1
1057 1 64 PHE QD 1 71 LEU HB2 . . 4.670 4.067 3.662 4.519 . 0 0 "[ . 1]" 1
1058 1 64 PHE QD 1 71 LEU QD . . 4.150 3.737 3.353 4.143 . 0 0 "[ . 1]" 1
1059 1 64 PHE QE 1 71 LEU QD . . 4.130 3.873 3.560 4.133 0.003 4 0 "[ . 1]" 1
1060 1 64 PHE HZ 1 71 LEU QD . . 4.830 4.631 4.198 4.850 0.020 4 0 "[ . 1]" 1
1061 1 65 ASP H 1 65 ASP HB2 . . 3.550 2.324 2.313 2.335 . 0 0 "[ . 1]" 1
1062 1 65 ASP H 1 65 ASP QB . . 3.060 2.214 2.205 2.225 . 0 0 "[ . 1]" 1
1063 1 65 ASP H 1 65 ASP HB3 . . 3.550 2.784 2.760 2.803 . 0 0 "[ . 1]" 1
1064 1 65 ASP H 1 66 GLU H . . 3.800 2.744 2.676 2.799 . 0 0 "[ . 1]" 1
1065 1 65 ASP H 1 66 GLU HB2 . . 5.500 5.058 4.941 5.240 . 0 0 "[ . 1]" 1
1066 1 65 ASP HA 1 72 SER QB . . 4.050 3.463 3.159 3.688 . 0 0 "[ . 1]" 1
1067 1 65 ASP QB 1 67 THR H . . 4.960 4.087 4.072 4.111 . 0 0 "[ . 1]" 1
1068 1 65 ASP QB 1 72 SER QB . . 5.180 4.975 4.776 5.140 . 0 0 "[ . 1]" 1
1069 1 65 ASP HB2 1 66 GLU H . . 3.790 3.473 3.438 3.501 . 0 0 "[ . 1]" 1
1070 1 65 ASP HB3 1 66 GLU H . . 3.790 2.220 2.210 2.231 . 0 0 "[ . 1]" 1
1071 1 66 GLU H 1 66 GLU HB2 . . 3.180 2.415 2.324 2.590 . 0 0 "[ . 1]" 1
1072 1 66 GLU H 1 66 GLU HB3 . . 3.840 3.625 3.542 3.712 . 0 0 "[ . 1]" 1
1073 1 66 GLU H 1 66 GLU HG2 . . 4.440 3.605 2.802 4.268 . 0 0 "[ . 1]" 1
1074 1 66 GLU H 1 66 GLU QG . . 3.580 2.975 2.527 3.258 . 0 0 "[ . 1]" 1
1075 1 66 GLU H 1 66 GLU HG3 . . 4.440 3.581 2.563 4.297 . 0 0 "[ . 1]" 1
1076 1 66 GLU H 1 67 THR H . . 3.240 2.087 2.068 2.111 . 0 0 "[ . 1]" 1
1077 1 66 GLU H 1 67 THR MG . . 4.060 3.843 3.271 4.069 0.009 6 0 "[ . 1]" 1
1078 1 66 GLU H 1 68 ASP H . . 4.190 3.793 3.677 4.111 . 0 0 "[ . 1]" 1
1079 1 66 GLU HA 1 66 GLU HG2 . . 4.120 2.699 2.226 3.118 . 0 0 "[ . 1]" 1
1080 1 66 GLU HA 1 66 GLU HG3 . . 4.120 3.264 2.642 3.735 . 0 0 "[ . 1]" 1
1081 1 66 GLU HB2 1 67 THR H . . 3.780 2.771 2.702 2.866 . 0 0 "[ . 1]" 1
1082 1 66 GLU HB2 1 67 THR MG . . 4.180 3.740 3.386 4.003 . 0 0 "[ . 1]" 1
1083 1 66 GLU HB3 1 67 THR H . . 3.830 3.560 3.375 3.828 . 0 0 "[ . 1]" 1
1084 1 66 GLU HB3 1 67 THR MG . . 4.680 4.399 4.052 4.652 . 0 0 "[ . 1]" 1
1085 1 66 GLU QG 1 67 THR H . . 4.740 4.236 3.986 4.372 . 0 0 "[ . 1]" 1
1086 1 67 THR H 1 67 THR MG . . 3.330 2.366 1.941 2.571 . 0 0 "[ . 1]" 1
1087 1 67 THR H 1 68 ASP H . . 3.280 2.767 2.696 2.969 . 0 0 "[ . 1]" 1
1088 1 67 THR HA 1 67 THR MG . . 3.140 2.252 2.167 2.426 . 0 0 "[ . 1]" 1
1089 1 67 THR HA 1 68 ASP HA . . 4.850 4.572 4.549 4.588 . 0 0 "[ . 1]" 1
1090 1 67 THR HB 1 68 ASP H . . 4.260 3.537 3.141 3.852 . 0 0 "[ . 1]" 1
1091 1 67 THR HB 1 68 ASP HA . . 5.500 4.829 4.479 5.155 . 0 0 "[ . 1]" 1
1092 1 67 THR MG 1 68 ASP H . . 4.240 3.967 3.679 4.132 . 0 0 "[ . 1]" 1
1093 1 68 ASP H 1 68 ASP HB2 . . 4.010 3.017 2.679 3.163 . 0 0 "[ . 1]" 1
1094 1 68 ASP H 1 68 ASP HB3 . . 4.010 3.479 2.944 3.970 . 0 0 "[ . 1]" 1
1095 1 68 ASP H 1 69 PRO QD . . 4.280 2.969 2.773 3.420 . 0 0 "[ . 1]" 1
1096 1 68 ASP HA 1 69 PRO QD . . 3.460 1.972 1.943 2.004 . 0 0 "[ . 1]" 1
1097 1 68 ASP HA 1 69 PRO HG2 . . 4.450 4.170 4.152 4.190 . 0 0 "[ . 1]" 1
1098 1 68 ASP HA 1 70 GLU H . . 4.190 3.439 3.412 3.460 . 0 0 "[ . 1]" 1
1099 1 68 ASP HA 1 70 GLU HB2 . . 5.270 4.393 4.327 4.520 . 0 0 "[ . 1]" 1
1100 1 68 ASP QB 1 71 LEU H . . 4.520 3.336 2.991 3.596 . 0 0 "[ . 1]" 1
1101 1 68 ASP QB 1 71 LEU HA . . 5.340 5.113 4.735 5.358 0.018 5 0 "[ . 1]" 1
1102 1 68 ASP QB 1 71 LEU QD . . 4.460 2.688 1.916 3.770 . 0 0 "[ . 1]" 1
1103 1 68 ASP QB 1 72 SER H . . 4.610 3.957 3.635 4.273 . 0 0 "[ . 1]" 1
1104 1 68 ASP QB 1 72 SER QB . . 5.180 4.677 4.285 5.191 0.011 5 0 "[ . 1]" 1
1105 1 69 PRO HA 1 70 GLU HA . . 5.200 4.828 4.774 4.854 . 0 0 "[ . 1]" 1
1106 1 69 PRO HA 1 71 LEU H . . 4.820 4.137 4.042 4.258 . 0 0 "[ . 1]" 1
1107 1 69 PRO HA 1 72 SER H . . 3.830 3.391 3.134 3.547 . 0 0 "[ . 1]" 1
1108 1 69 PRO HA 1 72 SER HA . . 5.500 5.364 5.087 5.513 0.013 4 0 "[ . 1]" 1
1109 1 69 PRO HA 1 72 SER QB . . 3.950 2.555 2.207 2.878 . 0 0 "[ . 1]" 1
1110 1 69 PRO HA 1 73 ARG H . . 4.210 3.726 3.484 4.219 0.009 4 0 "[ . 1]" 1
1111 1 69 PRO QB 1 70 GLU H . . 3.960 3.203 3.176 3.230 . 0 0 "[ . 1]" 1
1112 1 69 PRO QB 1 72 SER QB . . 4.180 4.078 3.766 4.189 0.009 8 0 "[ . 1]" 1
1113 1 69 PRO QD 1 70 GLU H . . 4.130 2.602 2.602 2.603 . 0 0 "[ . 1]" 1
1114 1 69 PRO QD 1 71 LEU H . . 4.930 4.381 4.238 4.465 . 0 0 "[ . 1]" 1
1115 1 69 PRO HG2 1 70 GLU H . . 3.170 2.368 2.330 2.409 . 0 0 "[ . 1]" 1
1116 1 70 GLU H 1 70 GLU HB2 . . 3.370 2.211 2.129 2.366 . 0 0 "[ . 1]" 1
1117 1 70 GLU H 1 70 GLU HB3 . . 3.690 3.496 3.442 3.570 . 0 0 "[ . 1]" 1
1118 1 70 GLU H 1 70 GLU QG . . 4.170 2.887 2.435 3.335 . 0 0 "[ . 1]" 1
1119 1 70 GLU H 1 71 LEU H . . 3.410 2.680 2.569 2.722 . 0 0 "[ . 1]" 1
1120 1 70 GLU H 1 71 LEU HB2 . . 5.280 4.732 4.387 5.282 0.002 3 0 "[ . 1]" 1
1121 1 70 GLU HA 1 70 GLU HG2 . . 3.860 2.656 2.320 3.652 . 0 0 "[ . 1]" 1
1122 1 70 GLU HA 1 70 GLU HG3 . . 3.860 2.999 2.364 3.706 . 0 0 "[ . 1]" 1
1123 1 70 GLU HB2 1 71 LEU H . . 3.570 2.938 2.803 3.020 . 0 0 "[ . 1]" 1
1124 1 70 GLU HB2 1 71 LEU QD . . 3.720 3.493 2.996 3.732 0.012 5 0 "[ . 1]" 1
1125 1 70 GLU HB3 1 71 LEU H . . 3.620 3.420 3.282 3.604 . 0 0 "[ . 1]" 1
1126 1 70 GLU QG 1 71 LEU QD . . 5.280 4.689 4.410 4.885 . 0 0 "[ . 1]" 1
1127 1 71 LEU H 1 71 LEU HB2 . . 3.480 2.280 2.065 2.763 . 0 0 "[ . 1]" 1
1128 1 71 LEU H 1 71 LEU HB3 . . 3.810 3.463 3.280 3.615 . 0 0 "[ . 1]" 1
1129 1 71 LEU H 1 71 LEU MD1 . . 4.250 3.506 2.224 4.298 0.048 7 0 "[ . 1]" 1
1130 1 71 LEU H 1 71 LEU QD . . 3.730 2.757 2.214 3.137 . 0 0 "[ . 1]" 1
1131 1 71 LEU H 1 71 LEU MD2 . . 4.250 3.331 2.602 4.267 0.017 10 0 "[ . 1]" 1
1132 1 71 LEU H 1 71 LEU HG . . 4.210 3.394 2.022 4.239 0.029 4 0 "[ . 1]" 1
1133 1 71 LEU H 1 72 SER H . . 3.430 2.565 2.370 2.696 . 0 0 "[ . 1]" 1
1134 1 71 LEU H 1 72 SER QB . . 4.590 4.274 4.095 4.383 . 0 0 "[ . 1]" 1
1135 1 71 LEU HA 1 71 LEU MD1 . . 4.130 3.022 2.058 3.916 . 0 0 "[ . 1]" 1
1136 1 71 LEU HA 1 71 LEU QD . . 3.150 2.217 1.835 2.776 . 0 0 "[ . 1]" 1
1137 1 71 LEU HA 1 71 LEU MD2 . . 4.130 2.596 1.964 3.745 . 0 0 "[ . 1]" 1
1138 1 71 LEU HA 1 71 LEU HG . . 3.450 3.102 2.271 3.637 0.187 4 0 "[ . 1]" 1
1139 1 71 LEU HA 1 74 ALA H . . 3.850 3.547 3.480 3.643 . 0 0 "[ . 1]" 1
1140 1 71 LEU HA 1 74 ALA MB . . 4.080 2.870 2.598 3.099 . 0 0 "[ . 1]" 1
1141 1 71 LEU HA 1 75 LEU H . . 4.640 4.060 3.907 4.166 . 0 0 "[ . 1]" 1
1142 1 71 LEU HB2 1 72 SER H . . 4.100 2.693 2.278 2.949 . 0 0 "[ . 1]" 1
1143 1 71 LEU HB3 1 71 LEU MD1 . . 3.590 2.540 2.192 3.177 . 0 0 "[ . 1]" 1
1144 1 71 LEU HB3 1 71 LEU QD . . 3.120 2.142 2.042 2.309 . 0 0 "[ . 1]" 1
1145 1 71 LEU HB3 1 71 LEU MD2 . . 3.590 2.570 2.165 3.192 . 0 0 "[ . 1]" 1
1146 1 71 LEU HB3 1 72 SER H . . 4.180 3.195 2.758 3.953 . 0 0 "[ . 1]" 1
1147 1 71 LEU QD 1 72 SER H . . 4.140 3.934 3.838 4.124 . 0 0 "[ . 1]" 1
1148 1 71 LEU MD1 1 72 SER H . . 4.950 4.362 4.165 4.656 . 0 0 "[ . 1]" 1
1149 1 71 LEU MD2 1 72 SER H . . 4.950 4.482 4.362 4.603 . 0 0 "[ . 1]" 1
1150 1 71 LEU HG 1 72 SER H . . 5.190 4.611 3.771 5.043 . 0 0 "[ . 1]" 1
1151 1 72 SER H 1 72 SER QB . . 3.300 2.224 2.163 2.262 . 0 0 "[ . 1]" 1
1152 1 72 SER H 1 73 ARG H . . 3.710 2.794 2.651 2.999 . 0 0 "[ . 1]" 1
1153 1 72 SER H 1 75 LEU HB2 . . 5.440 4.693 4.544 4.890 . 0 0 "[ . 1]" 1
1154 1 72 SER H 1 75 LEU QD . . 4.830 4.244 3.865 4.499 . 0 0 "[ . 1]" 1
1155 1 72 SER QB 1 73 ARG H . . 3.630 2.509 2.355 2.716 . 0 0 "[ . 1]" 1
1156 1 72 SER HB2 1 73 ARG H . . 4.430 3.771 2.513 4.056 . 0 0 "[ . 1]" 1
1157 1 72 SER HB3 1 73 ARG H . . 4.430 2.616 2.378 3.212 . 0 0 "[ . 1]" 1
1158 1 73 ARG H 1 73 ARG QB . . 2.920 2.220 2.161 2.295 . 0 0 "[ . 1]" 1
1159 1 73 ARG H 1 73 ARG QD . . 4.610 3.924 2.079 4.545 . 0 0 "[ . 1]" 1
1160 1 73 ARG H 1 73 ARG QG . . 4.600 3.495 2.524 4.040 . 0 0 "[ . 1]" 1
1161 1 73 ARG H 1 74 ALA H . . 3.520 2.708 2.657 2.763 . 0 0 "[ . 1]" 1
1162 1 73 ARG H 1 74 ALA MB . . 4.390 4.392 4.377 4.408 0.018 7 0 "[ . 1]" 1
1163 1 73 ARG HA 1 73 ARG QD . . 4.530 3.419 2.270 4.154 . 0 0 "[ . 1]" 1
1164 1 73 ARG HA 1 73 ARG QG . . 3.620 2.393 2.137 2.670 . 0 0 "[ . 1]" 1
1165 1 73 ARG HA 1 74 ALA MB . . 5.140 5.001 4.988 5.019 . 0 0 "[ . 1]" 1
1166 1 73 ARG QB 1 74 ALA H . . 3.260 2.704 2.663 2.792 . 0 0 "[ . 1]" 1
1167 1 73 ARG QB 1 74 ALA MB . . 4.000 3.715 3.662 3.840 . 0 0 "[ . 1]" 1
1168 1 73 ARG QG 1 74 ALA H . . 5.220 4.154 3.853 4.574 . 0 0 "[ . 1]" 1
1169 1 74 ALA H 1 74 ALA MB . . 2.990 2.202 2.132 2.272 . 0 0 "[ . 1]" 1
1170 1 74 ALA H 1 75 LEU H . . 3.450 2.481 2.393 2.665 . 0 0 "[ . 1]" 1
1171 1 74 ALA H 1 75 LEU HB2 . . 4.750 4.313 4.197 4.442 . 0 0 "[ . 1]" 1
1172 1 74 ALA H 1 75 LEU QD . . 3.930 3.904 3.755 3.967 0.037 5 0 "[ . 1]" 1
1173 1 74 ALA H 1 76 LYS H . . 4.910 4.251 3.913 4.427 . 0 0 "[ . 1]" 1
1174 1 74 ALA H 1 76 LYS QG . . 5.340 4.546 4.032 5.349 0.009 9 0 "[ . 1]" 1
1175 1 74 ALA HA 1 77 ASP QB . . 4.760 2.984 2.557 4.048 . 0 0 "[ . 1]" 1
1176 1 74 ALA MB 1 75 LEU H . . 3.850 2.621 2.260 2.761 . 0 0 "[ . 1]" 1
1177 1 74 ALA MB 1 75 LEU QD . . 2.750 2.616 2.488 2.746 . 0 0 "[ . 1]" 1
1178 1 74 ALA MB 1 77 ASP H . . 5.230 4.708 4.524 4.772 . 0 0 "[ . 1]" 1
1179 1 75 LEU H 1 75 LEU HB2 . . 3.570 2.132 2.081 2.208 . 0 0 "[ . 1]" 1
1180 1 75 LEU H 1 75 LEU HB3 . . 3.780 3.443 3.375 3.510 . 0 0 "[ . 1]" 1
1181 1 75 LEU H 1 75 LEU QD . . 3.320 2.352 2.138 2.458 . 0 0 "[ . 1]" 1
1182 1 75 LEU H 1 76 LYS QG . . 5.140 4.129 3.717 4.948 . 0 0 "[ . 1]" 1
1183 1 75 LEU HA 1 75 LEU QD . . 3.030 2.080 1.889 2.867 . 0 0 "[ . 1]" 1
1184 1 75 LEU HA 1 77 ASP H . . 4.890 4.198 4.078 4.408 . 0 0 "[ . 1]" 1
1185 1 75 LEU HA 1 78 ALA MB . . 3.440 2.084 1.937 2.435 . 0 0 "[ . 1]" 1
1186 1 75 LEU HB2 1 76 LYS H . . 4.170 2.672 2.500 2.926 . 0 0 "[ . 1]" 1
1187 1 75 LEU HB2 1 76 LYS QB . . 4.730 4.556 4.367 4.751 0.021 9 0 "[ . 1]" 1
1188 1 75 LEU HB3 1 76 LYS H . . 3.830 2.930 2.643 3.282 . 0 0 "[ . 1]" 1
1189 1 75 LEU HB3 1 76 LYS QB . . 5.170 4.513 4.105 5.047 . 0 0 "[ . 1]" 1
1190 1 75 LEU QD 1 76 LYS H . . 4.290 3.850 3.779 3.943 . 0 0 "[ . 1]" 1
1191 1 75 LEU QD 1 77 ASP H . . 5.440 4.912 4.787 5.201 . 0 0 "[ . 1]" 1
1192 1 75 LEU QD 1 78 ALA MB . . 4.600 2.926 2.479 3.915 . 0 0 "[ . 1]" 1
1193 1 76 LYS H 1 76 LYS QB . . 3.280 2.382 2.224 2.597 . 0 0 "[ . 1]" 1
1194 1 76 LYS H 1 76 LYS QG . . 3.450 2.341 1.984 2.737 . 0 0 "[ . 1]" 1
1195 1 76 LYS H 1 77 ASP H . . 3.870 2.745 2.440 2.867 . 0 0 "[ . 1]" 1
1196 1 76 LYS H 1 78 ALA H . . 4.950 3.988 3.788 4.056 . 0 0 "[ . 1]" 1
1197 1 76 LYS HA 1 76 LYS QE . . 5.340 4.226 3.773 4.509 . 0 0 "[ . 1]" 1
1198 1 76 LYS HA 1 76 LYS QG . . 3.560 3.102 2.321 3.344 . 0 0 "[ . 1]" 1
1199 1 76 LYS HA 1 79 TYR H . . 4.640 4.160 3.949 4.254 . 0 0 "[ . 1]" 1
1200 1 76 LYS HA 1 79 TYR HB3 . . 5.500 4.688 4.531 4.872 . 0 0 "[ . 1]" 1
1201 1 76 LYS HA 1 79 TYR QD . . 4.210 2.318 2.161 2.488 . 0 0 "[ . 1]" 1
1202 1 76 LYS HA 1 79 TYR QE . . 4.460 1.988 1.982 1.993 . 0 0 "[ . 1]" 1
1203 1 76 LYS QB 1 77 ASP H . . 3.960 3.242 2.556 3.496 . 0 0 "[ . 1]" 1
1204 1 76 LYS QG 1 77 ASP H . . 4.960 2.808 1.986 4.348 . 0 0 "[ . 1]" 1
1205 1 77 ASP H 1 77 ASP HB2 . . 4.060 2.692 2.328 3.606 . 0 0 "[ . 1]" 1
1206 1 77 ASP H 1 77 ASP QB . . 3.530 2.293 2.220 2.378 . 0 0 "[ . 1]" 1
1207 1 77 ASP H 1 77 ASP HB3 . . 4.060 2.740 2.292 3.582 . 0 0 "[ . 1]" 1
1208 1 77 ASP H 1 78 ALA H . . 3.630 2.334 2.290 2.399 . 0 0 "[ . 1]" 1
1209 1 77 ASP H 1 78 ALA MB . . 4.550 3.927 3.875 3.977 . 0 0 "[ . 1]" 1
1210 1 77 ASP H 1 80 TYR QB . . 5.100 4.354 4.301 4.427 . 0 0 "[ . 1]" 1
1211 1 77 ASP HA 1 80 TYR QB . . 3.950 2.111 1.968 2.220 . 0 0 "[ . 1]" 1
1212 1 77 ASP QB 1 78 ALA H . . 3.690 2.935 2.813 3.586 . 0 0 "[ . 1]" 1
1213 1 77 ASP QB 1 78 ALA HA . . 5.340 4.140 3.891 4.645 . 0 0 "[ . 1]" 1
1214 1 78 ALA H 1 78 ALA MB . . 3.040 2.061 2.027 2.152 . 0 0 "[ . 1]" 1
1215 1 78 ALA H 1 79 TYR H . . 3.540 2.858 2.768 2.891 . 0 0 "[ . 1]" 1
1216 1 78 ALA H 1 79 TYR HB3 . . 4.980 5.005 4.973 5.030 0.050 9 0 "[ . 1]" 1
1217 1 78 ALA H 1 79 TYR QE . . 5.500 5.530 5.522 5.537 0.037 6 0 "[ . 1]" 1
1218 1 78 ALA HA 1 81 VAL H . . 5.120 4.226 4.165 4.312 . 0 0 "[ . 1]" 1
1219 1 78 ALA HA 1 81 VAL QG . . 3.640 2.854 2.686 3.327 . 0 0 "[ . 1]" 1
1220 1 78 ALA MB 1 79 TYR H . . 3.930 2.416 2.368 2.618 . 0 0 "[ . 1]" 1
1221 1 78 ALA MB 1 79 TYR QD . . 4.810 4.020 3.934 4.052 . 0 0 "[ . 1]" 1
1222 1 78 ALA MB 1 82 GLY H . . 5.410 5.154 5.005 5.420 0.010 9 0 "[ . 1]" 1
1223 1 79 TYR H 1 79 TYR HB2 . . 3.830 3.544 3.517 3.617 . 0 0 "[ . 1]" 1
1224 1 79 TYR H 1 79 TYR HB3 . . 3.920 2.273 2.221 2.422 . 0 0 "[ . 1]" 1
1225 1 79 TYR H 1 79 TYR QD . . 4.510 2.393 2.284 2.467 . 0 0 "[ . 1]" 1
1226 1 79 TYR H 1 80 TYR H . . 4.080 2.505 2.302 2.576 . 0 0 "[ . 1]" 1
1227 1 79 TYR HA 1 79 TYR QD . . 4.020 3.673 3.661 3.685 . 0 0 "[ . 1]" 1
1228 1 79 TYR HA 1 82 GLY H . . 4.610 3.311 3.011 3.562 . 0 0 "[ . 1]" 1
1229 1 79 TYR HA 1 83 ILE H . . 5.070 4.294 3.951 4.918 . 0 0 "[ . 1]" 1
1230 1 79 TYR HB2 1 83 ILE MD . . 5.440 4.072 3.806 4.946 . 0 0 "[ . 1]" 1
1231 1 79 TYR QD 1 83 ILE MD . . 4.280 2.211 1.926 2.967 . 0 0 "[ . 1]" 1
1232 1 79 TYR QD 1 83 ILE HG13 . . 4.970 3.034 2.514 3.544 . 0 0 "[ . 1]" 1
1233 1 79 TYR QE 1 83 ILE MD . . 4.270 2.200 1.995 2.477 . 0 0 "[ . 1]" 1
1234 1 80 TYR H 1 80 TYR QB . . 3.550 2.247 2.230 2.256 . 0 0 "[ . 1]" 1
1235 1 80 TYR HA 1 80 TYR QD . . 4.070 2.783 2.626 2.950 . 0 0 "[ . 1]" 1
1236 1 80 TYR HA 1 80 TYR QE . . 4.770 4.678 4.544 4.781 0.011 8 0 "[ . 1]" 1
1237 1 80 TYR HA 1 82 GLY H . . 4.520 4.414 4.290 4.545 0.025 9 0 "[ . 1]" 1
1238 1 80 TYR HA 1 83 ILE MD . . 4.120 2.436 1.942 3.045 . 0 0 "[ . 1]" 1
1239 1 80 TYR HA 1 83 ILE HG13 . . 4.000 3.670 2.378 3.985 . 0 0 "[ . 1]" 1
1240 1 80 TYR QD 1 83 ILE MD . . 4.700 3.829 2.721 4.206 . 0 0 "[ . 1]" 1
1241 1 80 TYR QD 1 91 VAL QG . . 4.090 3.944 3.563 4.097 0.007 9 0 "[ . 1]" 1
1242 1 80 TYR QD 1 93 LEU MD1 . . 4.440 3.129 2.203 4.439 . 0 0 "[ . 1]" 1
1243 1 80 TYR QD 1 93 LEU MD2 . . 4.440 3.620 2.518 4.417 . 0 0 "[ . 1]" 1
1244 1 80 TYR QD 1 93 LEU HG . . 4.740 4.422 3.159 4.741 0.001 4 0 "[ . 1]" 1
1245 1 80 TYR QE 1 83 ILE MD . . 5.370 5.013 3.410 5.372 0.002 8 0 "[ . 1]" 1
1246 1 80 TYR QE 1 91 VAL HA . . 4.770 4.155 3.608 4.657 . 0 0 "[ . 1]" 1
1247 1 80 TYR QE 1 91 VAL QG . . 4.330 3.214 1.918 3.739 . 0 0 "[ . 1]" 1
1248 1 80 TYR QE 1 92 ASP H . . 4.200 3.844 2.790 4.199 . 0 0 "[ . 1]" 1
1249 1 80 TYR QE 1 93 LEU MD1 . . 4.580 2.502 1.918 3.855 . 0 0 "[ . 1]" 1
1250 1 80 TYR QE 1 93 LEU QD . . 3.870 1.991 1.793 2.366 . 0 0 "[ . 1]" 1
1251 1 80 TYR QE 1 93 LEU MD2 . . 4.580 2.883 1.881 4.050 . 0 0 "[ . 1]" 1
1252 1 80 TYR QE 1 93 LEU HG . . 3.790 3.190 2.718 3.798 0.008 9 0 "[ . 1]" 1
1253 1 81 VAL H 1 81 VAL HB . . 4.040 3.016 2.572 3.614 . 0 0 "[ . 1]" 1
1254 1 81 VAL H 1 81 VAL MG1 . . 4.240 2.275 1.920 3.766 . 0 0 "[ . 1]" 1
1255 1 81 VAL H 1 81 VAL QG . . 3.360 1.922 1.821 2.124 . 0 0 "[ . 1]" 1
1256 1 81 VAL H 1 81 VAL MG2 . . 4.240 2.880 1.921 3.779 . 0 0 "[ . 1]" 1
1257 1 81 VAL H 1 82 GLY H . . 3.920 2.662 2.446 2.888 . 0 0 "[ . 1]" 1
1258 1 81 VAL HA 1 84 ARG QB . . 4.980 3.118 2.618 3.982 . 0 0 "[ . 1]" 1
1259 1 81 VAL HA 1 85 THR H . . 5.070 4.418 3.686 5.090 0.020 9 0 "[ . 1]" 1
1260 1 81 VAL HA 1 91 VAL QG . . 3.900 3.459 2.851 3.909 0.009 10 0 "[ . 1]" 1
1261 1 81 VAL HB 1 82 GLY H . . 4.290 3.753 2.454 4.036 . 0 0 "[ . 1]" 1
1262 1 81 VAL QG 1 82 GLY H . . 3.040 2.200 1.912 3.079 0.039 9 0 "[ . 1]" 1
1263 1 81 VAL QG 1 82 GLY QA . . 3.280 2.913 2.800 3.162 . 0 0 "[ . 1]" 1
1264 1 81 VAL MG1 1 82 GLY H . . 4.150 2.965 1.918 4.031 . 0 0 "[ . 1]" 1
1265 1 81 VAL MG2 1 82 GLY H . . 4.150 3.042 2.116 3.814 . 0 0 "[ . 1]" 1
1266 1 82 GLY H 1 83 ILE HG13 . . 4.480 4.347 4.112 4.463 . 0 0 "[ . 1]" 1
1267 1 83 ILE H 1 83 ILE HB . . 4.050 2.571 2.511 2.622 . 0 0 "[ . 1]" 1
1268 1 83 ILE H 1 83 ILE MD . . 4.370 3.325 2.951 3.581 . 0 0 "[ . 1]" 1
1269 1 83 ILE H 1 83 ILE HG13 . . 4.130 2.057 1.958 2.223 . 0 0 "[ . 1]" 1
1270 1 83 ILE H 1 83 ILE MG . . 3.950 3.767 3.763 3.771 . 0 0 "[ . 1]" 1
1271 1 83 ILE H 1 84 ARG H . . 4.070 2.753 2.554 2.936 . 0 0 "[ . 1]" 1
1272 1 83 ILE HA 1 83 ILE MD . . 4.200 3.869 3.831 3.884 . 0 0 "[ . 1]" 1
1273 1 83 ILE HA 1 83 ILE MG . . 3.400 2.354 2.319 2.398 . 0 0 "[ . 1]" 1
1274 1 83 ILE HG12 1 83 ILE MG . . 3.700 2.305 2.206 2.403 . 0 0 "[ . 1]" 1
1275 1 83 ILE HG13 1 83 ILE MG . . 3.750 3.177 3.115 3.203 . 0 0 "[ . 1]" 1
1276 1 83 ILE HG13 1 84 ARG H . . 5.160 4.184 4.021 4.307 . 0 0 "[ . 1]" 1
1277 1 84 ARG H 1 84 ARG QG . . 4.730 2.812 1.963 4.023 . 0 0 "[ . 1]" 1
1278 1 84 ARG H 1 85 THR H . . 4.110 2.763 2.577 2.947 . 0 0 "[ . 1]" 1
1279 1 84 ARG HA 1 88 GLY H . . 4.980 3.955 3.455 4.356 . 0 0 "[ . 1]" 1
1280 1 84 ARG HA 1 89 LEU H . . 4.360 3.061 2.206 3.788 . 0 0 "[ . 1]" 1
1281 1 84 ARG HA 1 89 LEU HB2 . . 4.590 2.437 2.009 2.931 . 0 0 "[ . 1]" 1
1282 1 84 ARG HA 1 89 LEU QD . . 4.930 3.367 2.275 4.217 . 0 0 "[ . 1]" 1
1283 1 84 ARG HA 1 89 LEU HG . . 4.790 4.571 3.985 4.802 0.012 4 0 "[ . 1]" 1
1284 1 84 ARG QB 1 89 LEU H . . 4.100 3.546 3.214 4.170 0.070 10 0 "[ . 1]" 1
1285 1 84 ARG QB 1 89 LEU HB3 . . 3.430 3.008 2.606 3.430 0.000 10 0 "[ . 1]" 1
1286 1 84 ARG QG 1 85 THR H . . 4.770 3.627 2.122 4.425 . 0 0 "[ . 1]" 1
1287 1 85 THR H 1 85 THR HB . . 3.630 2.953 2.525 3.606 . 0 0 "[ . 1]" 1
1288 1 85 THR H 1 85 THR MG . . 3.900 3.241 1.921 3.796 . 0 0 "[ . 1]" 1
1289 1 85 THR H 1 86 GLY H . . 3.800 2.541 2.249 2.761 . 0 0 "[ . 1]" 1
1290 1 85 THR HA 1 85 THR MG . . 3.480 2.345 2.045 3.207 . 0 0 "[ . 1]" 1
1291 1 85 THR HA 1 86 GLY QA . . 4.790 4.476 4.430 4.515 . 0 0 "[ . 1]" 1
1292 1 85 THR HA 1 87 ARG H . . 4.880 4.177 3.905 4.428 . 0 0 "[ . 1]" 1
1293 1 85 THR HB 1 86 GLY H . . 4.050 3.135 2.746 3.998 . 0 0 "[ . 1]" 1
1294 1 85 THR MG 1 86 GLY H . . 4.480 3.685 2.157 4.252 . 0 0 "[ . 1]" 1
1295 1 85 THR MG 1 88 GLY H . . 5.230 4.689 4.260 5.002 . 0 0 "[ . 1]" 1
1296 1 86 GLY H 1 87 ARG H . . 3.870 2.684 2.530 2.819 . 0 0 "[ . 1]" 1
1297 1 86 GLY H 1 88 GLY H . . 4.860 3.835 3.678 3.986 . 0 0 "[ . 1]" 1
1298 1 87 ARG H 1 87 ARG HB2 . . 3.940 2.855 2.584 3.052 . 0 0 "[ . 1]" 1
1299 1 87 ARG H 1 87 ARG QB . . 3.390 2.348 2.299 2.417 . 0 0 "[ . 1]" 1
1300 1 87 ARG H 1 87 ARG HB3 . . 3.940 2.514 2.417 2.653 . 0 0 "[ . 1]" 1
1301 1 87 ARG H 1 87 ARG QG . . 4.330 4.004 3.948 4.093 . 0 0 "[ . 1]" 1
1302 1 87 ARG H 1 88 GLY H . . 3.490 2.114 1.931 2.334 . 0 0 "[ . 1]" 1
1303 1 87 ARG H 1 88 GLY QA . . 5.260 4.110 3.944 4.309 . 0 0 "[ . 1]" 1
1304 1 87 ARG H 1 89 LEU H . . 4.770 3.655 3.515 3.788 . 0 0 "[ . 1]" 1
1305 1 87 ARG H 1 89 LEU QD . . 5.290 4.268 3.371 5.179 . 0 0 "[ . 1]" 1
1306 1 87 ARG HA 1 87 ARG QD . . 4.660 3.613 2.158 4.188 . 0 0 "[ . 1]" 1
1307 1 87 ARG HA 1 87 ARG HG2 . . 3.890 3.452 3.121 3.796 . 0 0 "[ . 1]" 1
1308 1 87 ARG HA 1 87 ARG HG3 . . 3.890 2.617 2.450 3.262 . 0 0 "[ . 1]" 1
1309 1 87 ARG QB 1 88 GLY H . . 4.010 2.931 2.913 2.958 . 0 0 "[ . 1]" 1
1310 1 87 ARG QB 1 89 LEU QD . . 4.500 2.493 1.988 3.489 . 0 0 "[ . 1]" 1
1311 1 87 ARG HB2 1 88 GLY H . . 4.630 4.093 3.992 4.171 . 0 0 "[ . 1]" 1
1312 1 87 ARG HB3 1 88 GLY H . . 4.630 3.002 2.990 3.025 . 0 0 "[ . 1]" 1
1313 1 87 ARG QD 1 89 LEU QD . . 4.190 2.830 2.017 4.135 . 0 0 "[ . 1]" 1
1314 1 87 ARG QG 1 88 GLY H . . 4.430 3.909 3.740 4.097 . 0 0 "[ . 1]" 1
1315 1 87 ARG QG 1 89 LEU QD . . 3.990 2.423 1.856 3.009 . 0 0 "[ . 1]" 1
1316 1 87 ARG HG2 1 88 GLY H . . 5.030 4.362 3.911 5.032 0.002 9 0 "[ . 1]" 1
1317 1 87 ARG HG3 1 88 GLY H . . 5.030 4.612 3.927 4.986 . 0 0 "[ . 1]" 1
1318 1 88 GLY H 1 89 LEU H . . 3.620 2.193 2.081 2.317 . 0 0 "[ . 1]" 1
1319 1 88 GLY H 1 89 LEU HB2 . . 4.630 4.007 3.961 4.140 . 0 0 "[ . 1]" 1
1320 1 88 GLY H 1 89 LEU HB3 . . 5.500 5.438 5.085 5.531 0.031 4 0 "[ . 1]" 1
1321 1 88 GLY H 1 89 LEU QD . . 4.890 3.847 3.228 4.760 . 0 0 "[ . 1]" 1
1322 1 89 LEU H 1 89 LEU HB2 . . 3.260 2.196 2.089 2.326 . 0 0 "[ . 1]" 1
1323 1 89 LEU H 1 89 LEU QD . . 3.350 2.870 2.551 3.357 0.007 4 0 "[ . 1]" 1
1324 1 89 LEU H 1 90 LYS H . . 4.750 4.542 4.472 4.615 . 0 0 "[ . 1]" 1
1325 1 89 LEU HA 1 89 LEU QD . . 3.230 2.266 1.842 2.981 . 0 0 "[ . 1]" 1
1326 1 89 LEU HA 1 90 LYS H . . 3.010 2.493 2.315 2.600 . 0 0 "[ . 1]" 1
1327 1 89 LEU HB2 1 90 LYS H . . 4.130 3.793 3.622 4.080 . 0 0 "[ . 1]" 1
1328 1 89 LEU HB3 1 90 LYS H . . 3.650 2.438 2.133 3.275 . 0 0 "[ . 1]" 1
1329 1 89 LEU QD 1 90 LYS H . . 4.720 2.554 1.928 3.535 . 0 0 "[ . 1]" 1
1330 1 89 LEU HG 1 90 LYS H . . 4.260 3.613 2.237 4.223 . 0 0 "[ . 1]" 1
1331 1 90 LYS H 1 90 LYS HB2 . . 3.420 2.890 2.350 3.580 0.160 10 0 "[ . 1]" 1
1332 1 90 LYS H 1 90 LYS QB . . 2.900 2.394 2.227 2.497 . 0 0 "[ . 1]" 1
1333 1 90 LYS H 1 90 LYS HB3 . . 3.420 2.715 2.291 3.377 . 0 0 "[ . 1]" 1
1334 1 90 LYS H 1 90 LYS QG . . 4.520 3.816 2.365 4.196 . 0 0 "[ . 1]" 1
1335 1 90 LYS H 1 91 VAL H . . 4.840 4.425 4.023 4.633 . 0 0 "[ . 1]" 1
1336 1 90 LYS HB2 1 91 VAL H . . 5.270 3.983 2.711 4.588 . 0 0 "[ . 1]" 1
1337 1 90 LYS HB3 1 91 VAL H . . 5.270 3.926 3.355 4.408 . 0 0 "[ . 1]" 1
1338 1 90 LYS QE 1 90 LYS QG . . 3.320 2.229 2.070 2.753 . 0 0 "[ . 1]" 1
1339 1 90 LYS QG 1 91 VAL H . . 5.130 2.865 1.953 3.897 . 0 0 "[ . 1]" 1
1340 1 91 VAL H 1 91 VAL MG1 . . 4.650 2.797 2.142 3.897 . 0 0 "[ . 1]" 1
1341 1 91 VAL H 1 91 VAL QG . . 3.620 2.176 1.831 2.822 . 0 0 "[ . 1]" 1
1342 1 91 VAL H 1 91 VAL MG2 . . 4.650 2.567 1.938 3.764 . 0 0 "[ . 1]" 1
1343 1 91 VAL HA 1 92 ASP H . . 3.550 2.213 2.142 2.337 . 0 0 "[ . 1]" 1
1344 1 91 VAL HA 1 93 LEU QD . . 4.020 3.717 3.293 3.992 . 0 0 "[ . 1]" 1
1345 1 91 VAL HB 1 92 ASP H . . 5.060 3.486 2.537 4.180 . 0 0 "[ . 1]" 1
1346 1 91 VAL QG 1 92 ASP H . . 3.860 2.870 2.080 3.583 . 0 0 "[ . 1]" 1
1347 1 91 VAL QG 1 93 LEU H . . 4.960 3.324 1.926 4.259 . 0 0 "[ . 1]" 1
1348 1 91 VAL QG 1 93 LEU QD . . 3.650 2.609 1.872 3.014 . 0 0 "[ . 1]" 1
1349 1 91 VAL MG1 1 92 ASP H . . 4.670 3.332 2.087 4.036 . 0 0 "[ . 1]" 1
1350 1 91 VAL MG2 1 92 ASP H . . 4.670 3.648 2.443 4.195 . 0 0 "[ . 1]" 1
1351 1 92 ASP H 1 93 LEU HG . . 4.900 4.082 2.589 4.929 0.029 9 0 "[ . 1]" 1
1352 1 93 LEU H 1 93 LEU QD . . 5.120 2.740 1.941 3.274 . 0 0 "[ . 1]" 1
1353 1 93 LEU H 1 93 LEU HG . . 4.310 3.384 1.956 4.311 0.001 8 0 "[ . 1]" 1
1354 1 93 LEU HA 1 93 LEU MD1 . . 4.780 3.243 1.965 3.974 . 0 0 "[ . 1]" 1
1355 1 93 LEU HA 1 93 LEU QD . . 3.380 2.569 1.900 3.316 . 0 0 "[ . 1]" 1
1356 1 93 LEU HA 1 93 LEU MD2 . . 4.780 2.961 2.192 4.109 . 0 0 "[ . 1]" 1
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