NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
400008 |
1uhz   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1uhz
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 1746
_Distance_constraint_stats_list.Viol_count 2335
_Distance_constraint_stats_list.Viol_total 2935.993
_Distance_constraint_stats_list.Viol_max 0.933
_Distance_constraint_stats_list.Viol_rms 0.0306
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0042
_Distance_constraint_stats_list.Viol_average_violations_only 0.0629
_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 6 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLY 0.121 0.086 6 0 "[ . 1 . 2]"
1 8 PRO 2.105 0.610 16 1 "[ . 1 .+ 2]"
1 9 ILE 7.864 0.528 7 1 "[ . + 1 . 2]"
1 10 SER 2.482 0.151 15 0 "[ . 1 . 2]"
1 11 ARG 1.990 0.610 16 1 "[ . 1 .+ 2]"
1 12 LEU 2.214 0.088 16 0 "[ . 1 . 2]"
1 13 ALA 3.161 0.151 15 0 "[ . 1 . 2]"
1 14 GLN 0.601 0.043 5 0 "[ . 1 . 2]"
1 15 ILE 2.390 0.411 16 0 "[ . 1 . 2]"
1 16 GLN 5.358 0.134 13 0 "[ . 1 . 2]"
1 17 GLN 3.573 0.811 15 1 "[ . 1 + 2]"
1 18 ALA 2.925 0.811 15 1 "[ . 1 + 2]"
1 19 ARG 1.209 0.137 13 0 "[ . 1 . 2]"
1 20 LYS 10.836 0.511 15 1 "[ . 1 + 2]"
1 21 GLU 2.851 0.100 4 0 "[ . 1 . 2]"
1 22 LYS 3.742 0.392 3 0 "[ . 1 . 2]"
1 23 GLU 1.365 0.113 19 0 "[ . 1 . 2]"
1 24 PRO 3.352 0.135 17 0 "[ . 1 . 2]"
1 25 ASP 0.433 0.063 18 0 "[ . 1 . 2]"
1 26 TYR 16.899 0.734 16 8 "[* *** *1 - *+ 2]"
1 27 ILE 5.156 0.903 18 1 "[ . 1 . + 2]"
1 28 LEU 5.129 0.162 9 0 "[ . 1 . 2]"
1 29 LEU 4.187 0.435 14 0 "[ . 1 . 2]"
1 30 SER 0.478 0.435 14 0 "[ . 1 . 2]"
1 31 GLU 3.839 0.599 16 1 "[ . 1 .+ 2]"
1 32 ARG 0.462 0.046 16 0 "[ . 1 . 2]"
1 33 GLY 2.101 0.892 8 2 "[ - . + 1 . 2]"
1 34 MET 2.099 0.892 8 2 "[ - . + 1 . 2]"
1 35 PRO 0.240 0.181 11 0 "[ . 1 . 2]"
1 36 ARG 0.384 0.181 11 0 "[ . 1 . 2]"
1 37 ARG 0.116 0.025 8 0 "[ . 1 . 2]"
1 38 ARG 0.576 0.319 15 0 "[ . 1 . 2]"
1 39 GLU 1.626 0.124 19 0 "[ . 1 . 2]"
1 40 PHE 6.655 0.599 16 1 "[ . 1 .+ 2]"
1 41 VAL 1.383 0.056 20 0 "[ . 1 . 2]"
1 42 MET 2.685 0.348 12 0 "[ . 1 . 2]"
1 43 GLN 7.968 0.933 18 1 "[ . 1 . + 2]"
1 44 VAL 2.885 0.088 14 0 "[ . 1 . 2]"
1 45 LYS 3.913 0.933 18 1 "[ . 1 . + 2]"
1 46 VAL 0.434 0.100 18 0 "[ . 1 . 2]"
1 47 GLY 3.789 0.186 12 0 "[ . 1 . 2]"
1 48 ASN 5.642 0.516 19 1 "[ . 1 . +2]"
1 49 GLU 3.786 0.096 19 0 "[ . 1 . 2]"
1 50 VAL 4.579 0.116 18 0 "[ . 1 . 2]"
1 51 ALA 4.255 0.175 18 0 "[ . 1 . 2]"
1 52 THR 0.235 0.025 9 0 "[ . 1 . 2]"
1 53 GLY 0.144 0.018 18 0 "[ . 1 . 2]"
1 54 THR 0.973 0.076 18 0 "[ . 1 . 2]"
1 55 GLY 12.263 0.641 17 4 "[ ** .- 1 . + 2]"
1 56 PRO 6.584 0.305 10 0 "[ . 1 . 2]"
1 57 ASN 1.677 0.115 10 0 "[ . 1 . 2]"
1 58 LYS 3.640 0.492 16 0 "[ . 1 . 2]"
1 59 LYS 2.986 0.492 16 0 "[ . 1 . 2]"
1 60 ILE 1.447 0.357 17 0 "[ . 1 . 2]"
1 61 ALA 7.983 0.641 17 4 "[ ** .- 1 . + 2]"
1 62 LYS 19.268 0.734 16 8 "[* *** *1 - *+ 2]"
1 63 LYS 5.529 0.577 17 2 "[ . - 1 . + 2]"
1 64 ASN 0.583 0.363 17 0 "[ . 1 . 2]"
1 65 ALA 1.162 0.052 20 0 "[ . 1 . 2]"
1 66 ALA 0.978 0.081 20 0 "[ . 1 . 2]"
1 67 GLU 1.008 0.073 20 0 "[ . 1 . 2]"
1 68 ALA 0.394 0.081 20 0 "[ . 1 . 2]"
1 69 MET 2.269 0.126 16 0 "[ . 1 . 2]"
1 70 LEU 3.151 0.366 16 0 "[ . 1 . 2]"
1 71 LEU 1.675 0.153 20 0 "[ . 1 . 2]"
1 72 GLN 5.873 0.159 1 0 "[ . 1 . 2]"
1 73 LEU 5.800 0.222 14 0 "[ . 1 . 2]"
1 74 GLY 3.864 0.222 14 0 "[ . 1 . 2]"
1 75 TYR 3.955 0.179 8 0 "[ . 1 . 2]"
1 76 LYS 4.237 0.179 8 0 "[ . 1 . 2]"
1 77 ALA 3.013 0.522 9 2 "[ . +1 - . 2]"
1 78 SER 2.303 0.522 9 2 "[ . +1 - . 2]"
1 79 THR 0.044 0.010 14 0 "[ . 1 . 2]"
1 80 SER 2.742 0.699 12 1 "[ . 1 + . 2]"
1 81 LEU 4.055 0.699 12 1 "[ . 1 + . 2]"
1 82 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 PRO 0.004 0.004 18 0 "[ . 1 . 2]"
1 87 SER 0.004 0.004 18 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 SER QB 1 7 GLY H . . 5.050 3.484 2.683 4.098 . 0 0 "[ . 1 . 2]" 1
2 1 7 GLY H 1 8 PRO HD2 . . 5.500 4.899 4.701 5.010 . 0 0 "[ . 1 . 2]" 1
3 1 7 GLY HA2 1 8 PRO HD2 . . 3.200 2.955 2.641 3.214 0.014 16 0 "[ . 1 . 2]" 1
4 1 7 GLY HA2 1 8 PRO HD3 . . 3.250 2.170 1.972 2.386 . 0 0 "[ . 1 . 2]" 1
5 1 7 GLY HA2 1 8 PRO HG2 . . 5.500 4.841 4.592 5.068 . 0 0 "[ . 1 . 2]" 1
6 1 7 GLY HA3 1 8 PRO HD2 . . 3.220 2.581 2.369 2.879 . 0 0 "[ . 1 . 2]" 1
7 1 7 GLY HA3 1 8 PRO HD3 . . 3.140 2.917 2.652 3.226 0.086 6 0 "[ . 1 . 2]" 1
8 1 8 PRO HA 1 9 ILE HA . . 4.710 4.670 4.625 4.699 . 0 0 "[ . 1 . 2]" 1
9 1 8 PRO HA 1 11 ARG H . . 3.990 3.846 3.742 4.002 0.012 16 0 "[ . 1 . 2]" 1
10 1 8 PRO HA 1 11 ARG QB . . 3.110 2.615 2.447 2.800 . 0 0 "[ . 1 . 2]" 1
11 1 8 PRO HA 1 11 ARG QD . . 4.790 3.518 2.957 3.846 . 0 0 "[ . 1 . 2]" 1
12 1 8 PRO HA 1 11 ARG HG2 . . 4.970 4.857 4.309 5.580 0.610 16 1 "[ . 1 .+ 2]" 1
13 1 8 PRO HA 1 12 LEU H . . 4.390 3.955 3.511 4.259 . 0 0 "[ . 1 . 2]" 1
14 1 8 PRO HA 1 70 LEU MD1 . . 3.140 2.466 2.299 2.808 . 0 0 "[ . 1 . 2]" 1
15 1 8 PRO HA 1 70 LEU MD2 . . 4.140 4.165 4.141 4.197 0.057 15 0 "[ . 1 . 2]" 1
16 1 8 PRO HB2 1 9 ILE H . . 4.370 3.407 3.285 3.542 . 0 0 "[ . 1 . 2]" 1
17 1 8 PRO HB2 1 66 ALA H . . 5.070 3.744 3.585 4.019 . 0 0 "[ . 1 . 2]" 1
18 1 8 PRO HB2 1 66 ALA MB . . 3.260 1.940 1.868 2.025 . 0 0 "[ . 1 . 2]" 1
19 1 8 PRO HB2 1 67 GLU H . . 4.130 2.580 2.373 2.756 . 0 0 "[ . 1 . 2]" 1
20 1 8 PRO HB2 1 67 GLU HA . . 3.480 3.354 3.078 3.500 0.020 2 0 "[ . 1 . 2]" 1
21 1 8 PRO HB2 1 67 GLU HG3 . . 4.640 4.484 4.224 4.667 0.027 18 0 "[ . 1 . 2]" 1
22 1 8 PRO HB2 1 70 LEU MD1 . . 3.850 2.929 2.787 3.143 . 0 0 "[ . 1 . 2]" 1
23 1 8 PRO HB3 1 11 ARG QD . . 5.500 5.005 4.375 5.340 . 0 0 "[ . 1 . 2]" 1
24 1 8 PRO HB3 1 66 ALA MB . . 3.460 3.324 3.149 3.503 0.043 14 0 "[ . 1 . 2]" 1
25 1 8 PRO HB3 1 67 GLU H . . 3.510 3.346 3.044 3.532 0.022 17 0 "[ . 1 . 2]" 1
26 1 8 PRO HB3 1 70 LEU MD1 . . 3.430 2.886 2.667 3.074 . 0 0 "[ . 1 . 2]" 1
27 1 8 PRO HD2 1 9 ILE H . . 4.770 2.260 2.253 2.286 . 0 0 "[ . 1 . 2]" 1
28 1 8 PRO HD2 1 63 LYS QE . . 4.920 4.920 4.723 4.960 0.040 20 0 "[ . 1 . 2]" 1
29 1 8 PRO HD2 1 63 LYS QG . . 4.050 1.983 1.967 2.108 . 0 0 "[ . 1 . 2]" 1
30 1 8 PRO HD3 1 9 ILE H . . 5.230 3.659 3.655 3.670 . 0 0 "[ . 1 . 2]" 1
31 1 8 PRO HD3 1 63 LYS QG . . 4.140 3.110 2.925 3.297 . 0 0 "[ . 1 . 2]" 1
32 1 8 PRO HG2 1 9 ILE H . . 5.060 2.959 2.819 3.124 . 0 0 "[ . 1 . 2]" 1
33 1 8 PRO HG2 1 63 LYS HA . . 5.340 2.122 1.991 2.259 . 0 0 "[ . 1 . 2]" 1
34 1 8 PRO HG2 1 63 LYS QE . . 4.990 4.794 4.535 4.991 0.001 20 0 "[ . 1 . 2]" 1
35 1 8 PRO HG2 1 63 LYS QG . . 2.670 2.266 1.838 2.528 . 0 0 "[ . 1 . 2]" 1
36 1 8 PRO HG2 1 67 GLU H . . 5.500 3.973 3.797 4.295 . 0 0 "[ . 1 . 2]" 1
37 1 8 PRO HG3 1 9 ILE H . . 4.280 4.158 4.069 4.265 . 0 0 "[ . 1 . 2]" 1
38 1 9 ILE H 1 9 ILE HB . . 3.650 2.513 2.474 2.574 . 0 0 "[ . 1 . 2]" 1
39 1 9 ILE H 1 9 ILE MD . . 3.460 3.077 2.521 3.500 0.040 15 0 "[ . 1 . 2]" 1
40 1 9 ILE H 1 9 ILE HG12 . . 4.070 2.494 1.914 3.253 . 0 0 "[ . 1 . 2]" 1
41 1 9 ILE H 1 9 ILE HG13 . . 3.410 2.766 1.913 3.490 0.080 17 0 "[ . 1 . 2]" 1
42 1 9 ILE H 1 9 ILE MG . . 3.820 3.715 3.708 3.728 . 0 0 "[ . 1 . 2]" 1
43 1 9 ILE H 1 10 SER QB . . 4.370 4.396 4.252 4.457 0.087 20 0 "[ . 1 . 2]" 1
44 1 9 ILE H 1 11 ARG H . . 5.460 4.098 3.892 4.366 . 0 0 "[ . 1 . 2]" 1
45 1 9 ILE H 1 12 LEU H . . 5.020 4.581 4.473 4.720 . 0 0 "[ . 1 . 2]" 1
46 1 9 ILE H 1 63 LYS QG . . 4.590 3.136 2.917 3.280 . 0 0 "[ . 1 . 2]" 1
47 1 9 ILE H 1 66 ALA MB . . 3.440 3.355 3.099 3.476 0.036 18 0 "[ . 1 . 2]" 1
48 1 9 ILE HA 1 9 ILE MD . . 4.170 2.861 2.015 3.867 . 0 0 "[ . 1 . 2]" 1
49 1 9 ILE HA 1 9 ILE HG12 . . 3.960 2.962 2.560 3.374 . 0 0 "[ . 1 . 2]" 1
50 1 9 ILE HA 1 9 ILE HG13 . . 4.160 3.448 3.043 3.763 . 0 0 "[ . 1 . 2]" 1
51 1 9 ILE HA 1 9 ILE MG . . 2.870 2.384 2.208 2.434 . 0 0 "[ . 1 . 2]" 1
52 1 9 ILE HA 1 11 ARG H . . 5.500 4.681 4.321 5.008 . 0 0 "[ . 1 . 2]" 1
53 1 9 ILE HA 1 12 LEU H . . 4.680 3.512 3.277 3.755 . 0 0 "[ . 1 . 2]" 1
54 1 9 ILE HA 1 12 LEU HB2 . . 4.250 3.346 3.192 3.741 . 0 0 "[ . 1 . 2]" 1
55 1 9 ILE HA 1 12 LEU HB3 . . 5.010 3.264 2.991 3.567 . 0 0 "[ . 1 . 2]" 1
56 1 9 ILE HA 1 13 ALA H . . 5.360 3.971 3.600 4.224 . 0 0 "[ . 1 . 2]" 1
57 1 9 ILE HA 1 63 LYS HA . . 4.950 4.481 4.177 4.807 . 0 0 "[ . 1 . 2]" 1
58 1 9 ILE HA 1 66 ALA MB . . 2.950 2.306 1.976 2.464 . 0 0 "[ . 1 . 2]" 1
59 1 9 ILE HB 1 9 ILE MD . . 3.670 2.834 2.297 3.216 . 0 0 "[ . 1 . 2]" 1
60 1 9 ILE HB 1 10 SER H . . 3.260 2.089 2.033 2.209 . 0 0 "[ . 1 . 2]" 1
61 1 9 ILE HB 1 10 SER HA . . 5.500 4.129 4.053 4.196 . 0 0 "[ . 1 . 2]" 1
62 1 9 ILE HB 1 10 SER QB . . 4.680 3.865 3.822 3.941 . 0 0 "[ . 1 . 2]" 1
63 1 9 ILE MD 1 9 ILE MG . . 2.400 1.981 1.891 2.248 . 0 0 "[ . 1 . 2]" 1
64 1 9 ILE MD 1 10 SER H . . 4.640 4.279 4.008 4.557 . 0 0 "[ . 1 . 2]" 1
65 1 9 ILE MD 1 26 TYR QE . . 5.500 3.272 2.243 4.322 . 0 0 "[ . 1 . 2]" 1
66 1 9 ILE MD 1 62 LYS H . . 5.200 4.766 4.540 5.058 . 0 0 "[ . 1 . 2]" 1
67 1 9 ILE MD 1 62 LYS QB . . 2.980 2.903 2.519 3.054 0.074 20 0 "[ . 1 . 2]" 1
68 1 9 ILE MD 1 62 LYS QD . . 3.980 1.834 1.711 1.932 . 0 0 "[ . 1 . 2]" 1
69 1 9 ILE MD 1 63 LYS H . . 3.910 3.257 2.978 3.702 . 0 0 "[ . 1 . 2]" 1
70 1 9 ILE MD 1 63 LYS HA . . 3.350 2.361 1.775 3.082 . 0 0 "[ . 1 . 2]" 1
71 1 9 ILE MD 1 63 LYS QB . . 4.160 3.702 3.494 3.952 . 0 0 "[ . 1 . 2]" 1
72 1 9 ILE MD 1 63 LYS QG . . 4.710 2.304 1.925 2.976 . 0 0 "[ . 1 . 2]" 1
73 1 9 ILE MD 1 66 ALA H . . 5.080 3.876 2.363 5.122 0.042 7 0 "[ . 1 . 2]" 1
74 1 9 ILE HG12 1 26 TYR QE . . 5.500 4.494 3.472 5.489 . 0 0 "[ . 1 . 2]" 1
75 1 9 ILE HG12 1 62 LYS QD . . 5.230 2.905 2.028 3.610 . 0 0 "[ . 1 . 2]" 1
76 1 9 ILE HG12 1 63 LYS HA . . 4.230 2.700 2.115 3.032 . 0 0 "[ . 1 . 2]" 1
77 1 9 ILE HG12 1 63 LYS QB . . 4.420 4.276 3.549 4.948 0.528 7 1 "[ . + 1 . 2]" 1
78 1 9 ILE HG12 1 63 LYS QE . . 4.600 4.121 3.636 4.650 0.050 7 0 "[ . 1 . 2]" 1
79 1 9 ILE HG13 1 9 ILE MG . . 3.570 2.755 2.181 3.240 . 0 0 "[ . 1 . 2]" 1
80 1 9 ILE HG13 1 10 SER H . . 4.580 4.334 4.009 4.614 0.034 19 0 "[ . 1 . 2]" 1
81 1 9 ILE HG13 1 62 LYS QD . . 3.190 2.730 1.975 3.565 0.375 4 0 "[ . 1 . 2]" 1
82 1 9 ILE HG13 1 63 LYS HA . . 3.640 3.017 2.346 3.666 0.026 19 0 "[ . 1 . 2]" 1
83 1 9 ILE MG 1 10 SER H . . 3.590 3.088 2.977 3.301 . 0 0 "[ . 1 . 2]" 1
84 1 9 ILE MG 1 10 SER HA . . 4.480 3.432 3.275 3.691 . 0 0 "[ . 1 . 2]" 1
85 1 9 ILE MG 1 10 SER QB . . 4.630 4.355 4.119 4.585 . 0 0 "[ . 1 . 2]" 1
86 1 9 ILE MG 1 11 ARG H . . 5.270 5.070 4.844 5.265 . 0 0 "[ . 1 . 2]" 1
87 1 9 ILE MG 1 12 LEU H . . 5.500 4.648 4.453 5.014 . 0 0 "[ . 1 . 2]" 1
88 1 9 ILE MG 1 13 ALA H . . 4.530 3.806 3.413 4.056 . 0 0 "[ . 1 . 2]" 1
89 1 9 ILE MG 1 26 TYR QD . . 5.500 4.242 3.888 4.463 . 0 0 "[ . 1 . 2]" 1
90 1 9 ILE MG 1 26 TYR QE . . 3.820 2.749 2.445 3.003 . 0 0 "[ . 1 . 2]" 1
91 1 10 SER H 1 10 SER QB . . 3.160 2.062 2.006 2.204 . 0 0 "[ . 1 . 2]" 1
92 1 10 SER H 1 11 ARG H . . 3.770 3.019 2.922 3.102 . 0 0 "[ . 1 . 2]" 1
93 1 10 SER H 1 11 ARG HA . . 5.500 5.438 5.353 5.500 . 0 0 "[ . 1 . 2]" 1
94 1 10 SER H 1 12 LEU H . . 4.660 4.376 4.123 4.706 0.046 16 0 "[ . 1 . 2]" 1
95 1 10 SER H 1 13 ALA H . . 4.480 4.559 4.513 4.631 0.151 15 0 "[ . 1 . 2]" 1
96 1 10 SER HA 1 13 ALA H . . 4.520 3.278 3.046 3.506 . 0 0 "[ . 1 . 2]" 1
97 1 10 SER HA 1 13 ALA MB . . 3.170 2.417 2.235 2.567 . 0 0 "[ . 1 . 2]" 1
98 1 10 SER HA 1 14 GLN H . . 4.480 3.743 3.562 4.114 . 0 0 "[ . 1 . 2]" 1
99 1 10 SER QB 1 11 ARG H . . 3.520 2.539 2.364 2.699 . 0 0 "[ . 1 . 2]" 1
100 1 10 SER QB 1 13 ALA MB . . 5.000 4.161 3.937 4.331 . 0 0 "[ . 1 . 2]" 1
101 1 10 SER QB 1 14 GLN HE21 . . 5.220 3.643 3.142 3.936 . 0 0 "[ . 1 . 2]" 1
102 1 10 SER QB 1 14 GLN HE22 . . 5.500 5.044 4.672 5.360 . 0 0 "[ . 1 . 2]" 1
103 1 11 ARG H 1 11 ARG QB . . 3.290 2.157 2.037 2.201 . 0 0 "[ . 1 . 2]" 1
104 1 11 ARG H 1 11 ARG QD . . 5.500 4.220 3.701 4.407 . 0 0 "[ . 1 . 2]" 1
105 1 11 ARG H 1 11 ARG HG2 . . 4.640 4.536 4.299 4.619 . 0 0 "[ . 1 . 2]" 1
106 1 11 ARG H 1 11 ARG HG3 . . 4.310 4.235 3.907 4.456 0.146 16 0 "[ . 1 . 2]" 1
107 1 11 ARG H 1 12 LEU H . . 3.630 2.908 2.753 3.086 . 0 0 "[ . 1 . 2]" 1
108 1 11 ARG H 1 12 LEU HB2 . . 5.500 4.909 4.748 5.060 . 0 0 "[ . 1 . 2]" 1
109 1 11 ARG H 1 14 GLN QB . . 5.500 4.646 4.518 4.840 . 0 0 "[ . 1 . 2]" 1
110 1 11 ARG H 1 14 GLN HE21 . . 5.300 4.839 4.415 5.179 . 0 0 "[ . 1 . 2]" 1
111 1 11 ARG H 1 70 LEU MD1 . . 5.250 4.524 4.162 5.025 . 0 0 "[ . 1 . 2]" 1
112 1 11 ARG HA 1 11 ARG QD . . 4.490 3.763 3.449 4.042 . 0 0 "[ . 1 . 2]" 1
113 1 11 ARG HA 1 11 ARG HG2 . . 3.950 3.162 2.342 3.538 . 0 0 "[ . 1 . 2]" 1
114 1 11 ARG HA 1 11 ARG HG3 . . 3.870 2.393 2.048 3.361 . 0 0 "[ . 1 . 2]" 1
115 1 11 ARG HA 1 14 GLN QB . . 3.650 2.562 2.426 2.684 . 0 0 "[ . 1 . 2]" 1
116 1 11 ARG HA 1 14 GLN HG2 . . 5.500 4.994 4.702 5.232 . 0 0 "[ . 1 . 2]" 1
117 1 11 ARG HA 1 14 GLN HG3 . . 5.500 3.516 3.117 3.815 . 0 0 "[ . 1 . 2]" 1
118 1 11 ARG HA 1 15 ILE H . . 5.500 4.531 4.375 4.686 . 0 0 "[ . 1 . 2]" 1
119 1 11 ARG HA 1 70 LEU MD1 . . 5.500 4.987 4.765 5.500 0.000 20 0 "[ . 1 . 2]" 1
120 1 11 ARG QB 1 11 ARG QD . . 2.890 2.112 1.949 2.159 . 0 0 "[ . 1 . 2]" 1
121 1 11 ARG QB 1 12 LEU H . . 3.460 2.459 2.150 2.676 . 0 0 "[ . 1 . 2]" 1
122 1 11 ARG QB 1 13 ALA H . . 5.060 4.700 4.477 4.864 . 0 0 "[ . 1 . 2]" 1
123 1 11 ARG QB 1 15 ILE MD . . 5.500 3.564 3.088 4.075 . 0 0 "[ . 1 . 2]" 1
124 1 11 ARG QB 1 70 LEU MD1 . . 3.920 2.398 2.054 2.948 . 0 0 "[ . 1 . 2]" 1
125 1 11 ARG QB 1 70 LEU MD2 . . 4.560 2.555 1.968 3.066 . 0 0 "[ . 1 . 2]" 1
126 1 11 ARG QD 1 15 ILE MD . . 5.500 3.877 1.866 4.470 . 0 0 "[ . 1 . 2]" 1
127 1 11 ARG QD 1 70 LEU MD1 . . 4.210 2.792 1.895 3.403 . 0 0 "[ . 1 . 2]" 1
128 1 11 ARG QD 1 70 LEU MD2 . . 5.390 3.265 1.668 3.870 . 0 0 "[ . 1 . 2]" 1
129 1 11 ARG HG2 1 12 LEU H . . 4.590 4.087 3.747 4.615 0.025 12 0 "[ . 1 . 2]" 1
130 1 11 ARG HG2 1 15 ILE MD . . 4.580 2.274 1.972 3.281 . 0 0 "[ . 1 . 2]" 1
131 1 11 ARG HG2 1 70 LEU MD1 . . 4.290 3.254 2.318 4.656 0.366 16 0 "[ . 1 . 2]" 1
132 1 11 ARG HG2 1 70 LEU MD2 . . 4.600 2.328 1.940 3.724 . 0 0 "[ . 1 . 2]" 1
133 1 11 ARG HG3 1 12 LEU H . . 5.100 4.705 4.481 4.909 . 0 0 "[ . 1 . 2]" 1
134 1 11 ARG HG3 1 15 ILE MD . . 3.650 3.291 2.620 4.061 0.411 16 0 "[ . 1 . 2]" 1
135 1 11 ARG HG3 1 70 LEU MD2 . . 4.810 3.668 3.178 4.100 . 0 0 "[ . 1 . 2]" 1
136 1 12 LEU H 1 12 LEU HB2 . . 3.480 2.160 2.038 2.238 . 0 0 "[ . 1 . 2]" 1
137 1 12 LEU H 1 12 LEU HB3 . . 3.400 2.794 2.701 2.947 . 0 0 "[ . 1 . 2]" 1
138 1 12 LEU H 1 12 LEU MD1 . . 4.590 4.237 4.166 4.292 . 0 0 "[ . 1 . 2]" 1
139 1 12 LEU H 1 12 LEU MD2 . . 4.140 4.085 4.050 4.126 . 0 0 "[ . 1 . 2]" 1
140 1 12 LEU H 1 13 ALA H . . 3.450 2.644 2.514 2.818 . 0 0 "[ . 1 . 2]" 1
141 1 12 LEU H 1 14 GLN QB . . 4.990 4.802 4.651 4.958 . 0 0 "[ . 1 . 2]" 1
142 1 12 LEU H 1 15 ILE MD . . 5.060 3.967 3.728 4.167 . 0 0 "[ . 1 . 2]" 1
143 1 12 LEU H 1 70 LEU MD1 . . 4.420 3.257 2.715 3.603 . 0 0 "[ . 1 . 2]" 1
144 1 12 LEU H 1 70 LEU MD2 . . 4.380 3.109 2.760 3.681 . 0 0 "[ . 1 . 2]" 1
145 1 12 LEU HA 1 12 LEU MD1 . . 3.840 3.816 3.796 3.840 0.000 5 0 "[ . 1 . 2]" 1
146 1 12 LEU HA 1 12 LEU MD2 . . 2.960 1.990 1.947 2.064 . 0 0 "[ . 1 . 2]" 1
147 1 12 LEU HA 1 15 ILE H . . 4.060 3.253 3.176 3.344 . 0 0 "[ . 1 . 2]" 1
148 1 12 LEU HA 1 15 ILE HA . . 5.440 5.283 5.188 5.418 . 0 0 "[ . 1 . 2]" 1
149 1 12 LEU HA 1 15 ILE HB . . 3.540 2.613 2.493 2.791 . 0 0 "[ . 1 . 2]" 1
150 1 12 LEU HA 1 15 ILE MD . . 3.730 2.148 1.986 2.408 . 0 0 "[ . 1 . 2]" 1
151 1 12 LEU HA 1 15 ILE HG12 . . 5.500 4.613 4.514 4.754 . 0 0 "[ . 1 . 2]" 1
152 1 12 LEU HA 1 15 ILE HG13 . . 5.010 3.610 3.312 3.724 . 0 0 "[ . 1 . 2]" 1
153 1 12 LEU HA 1 15 ILE MG . . 4.500 3.979 3.885 4.135 . 0 0 "[ . 1 . 2]" 1
154 1 12 LEU HA 1 16 GLN H . . 4.260 4.303 4.270 4.343 0.083 15 0 "[ . 1 . 2]" 1
155 1 12 LEU HA 1 16 GLN QG . . 4.810 4.146 4.039 4.323 . 0 0 "[ . 1 . 2]" 1
156 1 12 LEU HA 1 70 LEU MD2 . . 3.410 2.078 1.927 2.328 . 0 0 "[ . 1 . 2]" 1
157 1 12 LEU HB2 1 12 LEU MD1 . . 3.050 2.577 2.445 2.700 . 0 0 "[ . 1 . 2]" 1
158 1 12 LEU HB2 1 13 ALA H . . 4.060 3.597 3.500 3.750 . 0 0 "[ . 1 . 2]" 1
159 1 12 LEU HB2 1 24 PRO HG3 . . 4.690 4.402 4.137 4.709 0.019 15 0 "[ . 1 . 2]" 1
160 1 12 LEU HB2 1 69 MET HG2 . . 5.020 4.965 4.474 5.067 0.047 19 0 "[ . 1 . 2]" 1
161 1 12 LEU HB2 1 70 LEU MD1 . . 3.170 2.669 2.141 3.122 . 0 0 "[ . 1 . 2]" 1
162 1 12 LEU HB2 1 70 LEU MD2 . . 3.380 2.869 2.533 3.385 0.005 20 0 "[ . 1 . 2]" 1
163 1 12 LEU HB3 1 12 LEU MD1 . . 3.220 2.109 2.017 2.206 . 0 0 "[ . 1 . 2]" 1
164 1 12 LEU HB3 1 12 LEU MD2 . . 2.990 2.649 2.530 2.732 . 0 0 "[ . 1 . 2]" 1
165 1 12 LEU HB3 1 13 ALA H . . 4.020 2.637 2.552 2.764 . 0 0 "[ . 1 . 2]" 1
166 1 12 LEU HB3 1 24 PRO HG2 . . 4.570 3.723 3.502 4.028 . 0 0 "[ . 1 . 2]" 1
167 1 12 LEU HB3 1 24 PRO HG3 . . 4.990 2.709 2.414 3.053 . 0 0 "[ . 1 . 2]" 1
168 1 12 LEU HB3 1 70 LEU MD2 . . 4.770 3.941 3.691 4.426 . 0 0 "[ . 1 . 2]" 1
169 1 12 LEU MD1 1 13 ALA H . . 5.500 4.337 4.137 4.565 . 0 0 "[ . 1 . 2]" 1
170 1 12 LEU MD1 1 24 PRO HA . . 5.400 4.236 4.063 4.612 . 0 0 "[ . 1 . 2]" 1
171 1 12 LEU MD1 1 24 PRO HB3 . . 2.980 2.238 2.005 2.607 . 0 0 "[ . 1 . 2]" 1
172 1 12 LEU MD1 1 26 TYR QE . . 5.500 3.436 3.254 3.658 . 0 0 "[ . 1 . 2]" 1
173 1 12 LEU MD1 1 44 VAL MG1 . . 3.700 3.008 2.667 3.150 . 0 0 "[ . 1 . 2]" 1
174 1 12 LEU MD1 1 44 VAL MG2 . . 2.840 2.057 1.844 2.202 . 0 0 "[ . 1 . 2]" 1
175 1 12 LEU MD1 1 66 ALA HA . . 3.160 2.002 1.885 2.120 . 0 0 "[ . 1 . 2]" 1
176 1 12 LEU MD1 1 66 ALA MB . . 3.020 2.164 1.933 2.543 . 0 0 "[ . 1 . 2]" 1
177 1 12 LEU MD1 1 69 MET H . . 5.350 4.141 3.857 4.437 . 0 0 "[ . 1 . 2]" 1
178 1 12 LEU MD1 1 69 MET HB2 . . 3.800 2.903 2.697 3.214 . 0 0 "[ . 1 . 2]" 1
179 1 12 LEU MD1 1 69 MET HG3 . . 3.470 3.039 2.732 3.426 . 0 0 "[ . 1 . 2]" 1
180 1 12 LEU MD1 1 70 LEU HG . . 3.760 3.524 2.874 3.768 0.008 6 0 "[ . 1 . 2]" 1
181 1 12 LEU MD2 1 13 ALA H . . 4.610 3.854 3.748 4.019 . 0 0 "[ . 1 . 2]" 1
182 1 12 LEU MD2 1 13 ALA HA . . 4.650 3.631 3.429 3.869 . 0 0 "[ . 1 . 2]" 1
183 1 12 LEU MD2 1 14 GLN H . . 5.060 4.949 4.853 5.050 . 0 0 "[ . 1 . 2]" 1
184 1 12 LEU MD2 1 15 ILE HB . . 2.940 2.420 2.301 2.548 . 0 0 "[ . 1 . 2]" 1
185 1 12 LEU MD2 1 15 ILE MD . . 2.560 2.554 2.492 2.606 0.046 20 0 "[ . 1 . 2]" 1
186 1 12 LEU MD2 1 16 GLN H . . 5.500 3.361 3.264 3.511 . 0 0 "[ . 1 . 2]" 1
187 1 12 LEU MD2 1 16 GLN QG . . 2.810 2.047 1.938 2.167 . 0 0 "[ . 1 . 2]" 1
188 1 12 LEU MD2 1 24 PRO HB3 . . 3.770 2.840 2.696 2.943 . 0 0 "[ . 1 . 2]" 1
189 1 12 LEU MD2 1 24 PRO HD2 . . 4.860 4.876 4.842 4.920 0.060 16 0 "[ . 1 . 2]" 1
190 1 12 LEU MD2 1 24 PRO HD3 . . 4.830 3.705 3.663 3.780 . 0 0 "[ . 1 . 2]" 1
191 1 12 LEU MD2 1 24 PRO HG3 . . 3.260 2.579 2.499 2.648 . 0 0 "[ . 1 . 2]" 1
192 1 12 LEU MD2 1 69 MET HB3 . . 4.000 4.007 3.882 4.088 0.088 16 0 "[ . 1 . 2]" 1
193 1 12 LEU MD2 1 69 MET HG2 . . 2.930 2.493 2.269 2.669 . 0 0 "[ . 1 . 2]" 1
194 1 12 LEU MD2 1 70 LEU H . . 5.500 4.962 4.732 5.136 . 0 0 "[ . 1 . 2]" 1
195 1 12 LEU MD2 1 70 LEU MD2 . . 2.880 2.593 2.382 2.883 0.003 19 0 "[ . 1 . 2]" 1
196 1 12 LEU MD2 1 70 LEU HG . . 3.950 3.786 3.412 3.977 0.027 14 0 "[ . 1 . 2]" 1
197 1 12 LEU HG 1 69 MET HG3 . . 4.230 2.845 2.397 4.028 . 0 0 "[ . 1 . 2]" 1
198 1 13 ALA H 1 13 ALA MB . . 3.130 1.972 1.934 2.012 . 0 0 "[ . 1 . 2]" 1
199 1 13 ALA H 1 14 GLN H . . 3.650 2.727 2.627 2.797 . 0 0 "[ . 1 . 2]" 1
200 1 13 ALA H 1 14 GLN QB . . 4.840 4.539 4.436 4.670 . 0 0 "[ . 1 . 2]" 1
201 1 13 ALA H 1 14 GLN HG3 . . 5.500 5.034 4.579 5.274 . 0 0 "[ . 1 . 2]" 1
202 1 13 ALA H 1 15 ILE H . . 3.960 3.960 3.904 4.002 0.042 19 0 "[ . 1 . 2]" 1
203 1 13 ALA HA 1 16 GLN HB2 . . 3.460 2.578 2.420 2.757 . 0 0 "[ . 1 . 2]" 1
204 1 13 ALA HA 1 16 GLN HB3 . . 4.250 4.164 4.051 4.266 0.016 15 0 "[ . 1 . 2]" 1
205 1 13 ALA HA 1 16 GLN QG . . 3.370 2.624 2.458 2.935 . 0 0 "[ . 1 . 2]" 1
206 1 13 ALA HA 1 17 GLN H . . 4.780 4.218 4.031 4.600 . 0 0 "[ . 1 . 2]" 1
207 1 13 ALA HA 1 23 GLU HA . . 5.500 3.544 3.444 3.690 . 0 0 "[ . 1 . 2]" 1
208 1 13 ALA HA 1 23 GLU QG . . 4.890 3.493 2.937 4.901 0.011 19 0 "[ . 1 . 2]" 1
209 1 13 ALA HA 1 24 PRO HG2 . . 4.900 3.787 3.497 3.965 . 0 0 "[ . 1 . 2]" 1
210 1 13 ALA MB 1 14 GLN H . . 3.400 2.644 2.568 2.736 . 0 0 "[ . 1 . 2]" 1
211 1 13 ALA MB 1 14 GLN HA . . 4.530 3.690 3.668 3.711 . 0 0 "[ . 1 . 2]" 1
212 1 13 ALA MB 1 14 GLN HG3 . . 4.480 3.878 3.543 4.033 . 0 0 "[ . 1 . 2]" 1
213 1 13 ALA MB 1 16 GLN H . . 4.320 4.357 4.320 4.405 0.085 14 0 "[ . 1 . 2]" 1
214 1 13 ALA MB 1 16 GLN HB2 . . 4.800 3.899 3.805 3.978 . 0 0 "[ . 1 . 2]" 1
215 1 13 ALA MB 1 17 GLN HE21 . . 5.500 4.271 2.811 5.501 0.001 9 0 "[ . 1 . 2]" 1
216 1 13 ALA MB 1 17 GLN HE22 . . 5.500 4.646 3.703 5.470 . 0 0 "[ . 1 . 2]" 1
217 1 13 ALA MB 1 23 GLU HA . . 4.180 4.205 4.129 4.228 0.048 9 0 "[ . 1 . 2]" 1
218 1 13 ALA MB 1 23 GLU QG . . 4.180 2.990 2.494 4.293 0.113 19 0 "[ . 1 . 2]" 1
219 1 14 GLN H 1 14 GLN QB . . 3.080 2.214 2.158 2.354 . 0 0 "[ . 1 . 2]" 1
220 1 14 GLN H 1 14 GLN HG2 . . 3.690 3.292 3.172 3.376 . 0 0 "[ . 1 . 2]" 1
221 1 14 GLN H 1 14 GLN HG3 . . 3.600 2.785 2.357 2.944 . 0 0 "[ . 1 . 2]" 1
222 1 14 GLN H 1 15 ILE H . . 3.360 2.651 2.597 2.692 . 0 0 "[ . 1 . 2]" 1
223 1 14 GLN H 1 15 ILE HA . . 5.500 5.201 5.156 5.237 . 0 0 "[ . 1 . 2]" 1
224 1 14 GLN H 1 15 ILE HB . . 5.140 4.769 4.704 4.862 . 0 0 "[ . 1 . 2]" 1
225 1 14 GLN H 1 15 ILE HG13 . . 4.650 4.316 4.116 4.444 . 0 0 "[ . 1 . 2]" 1
226 1 14 GLN H 1 16 GLN H . . 4.410 4.093 4.025 4.159 . 0 0 "[ . 1 . 2]" 1
227 1 14 GLN HA 1 14 GLN QB . . 2.730 2.494 2.440 2.516 . 0 0 "[ . 1 . 2]" 1
228 1 14 GLN HA 1 14 GLN HG2 . . 3.220 2.118 2.066 2.275 . 0 0 "[ . 1 . 2]" 1
229 1 14 GLN HA 1 14 GLN HG3 . . 3.890 3.220 3.184 3.258 . 0 0 "[ . 1 . 2]" 1
230 1 14 GLN HA 1 16 GLN H . . 5.260 4.317 4.221 4.413 . 0 0 "[ . 1 . 2]" 1
231 1 14 GLN HA 1 17 GLN H . . 3.620 3.395 3.319 3.452 . 0 0 "[ . 1 . 2]" 1
232 1 14 GLN HA 1 17 GLN HG2 . . 4.180 2.375 2.148 3.558 . 0 0 "[ . 1 . 2]" 1
233 1 14 GLN HA 1 17 GLN HG3 . . 4.400 3.798 1.949 4.216 . 0 0 "[ . 1 . 2]" 1
234 1 14 GLN HA 1 18 ALA H . . 3.910 3.723 3.572 3.947 0.037 15 0 "[ . 1 . 2]" 1
235 1 14 GLN QB 1 14 GLN HG2 . . 2.540 2.538 2.488 2.550 0.010 9 0 "[ . 1 . 2]" 1
236 1 14 GLN QB 1 15 ILE H . . 4.030 2.953 2.889 3.009 . 0 0 "[ . 1 . 2]" 1
237 1 14 GLN QB 1 15 ILE HA . . 5.070 3.964 3.934 3.988 . 0 0 "[ . 1 . 2]" 1
238 1 14 GLN QB 1 15 ILE MD . . 5.340 4.205 4.055 4.446 . 0 0 "[ . 1 . 2]" 1
239 1 14 GLN QB 1 15 ILE HG12 . . 5.040 4.557 4.389 4.648 . 0 0 "[ . 1 . 2]" 1
240 1 14 GLN QB 1 16 GLN H . . 4.770 4.789 4.743 4.813 0.043 5 0 "[ . 1 . 2]" 1
241 1 14 GLN QB 1 18 ALA MB . . 3.920 3.632 3.523 3.782 . 0 0 "[ . 1 . 2]" 1
242 1 14 GLN HG2 1 15 ILE H . . 5.000 5.000 4.971 5.012 0.012 4 0 "[ . 1 . 2]" 1
243 1 14 GLN HG2 1 17 GLN HE22 . . 5.500 2.853 2.241 4.299 . 0 0 "[ . 1 . 2]" 1
244 1 14 GLN HG3 1 15 ILE H . . 5.500 4.900 4.593 5.010 . 0 0 "[ . 1 . 2]" 1
245 1 15 ILE H 1 15 ILE HB . . 3.380 2.315 2.282 2.378 . 0 0 "[ . 1 . 2]" 1
246 1 15 ILE H 1 15 ILE MD . . 4.520 3.353 3.217 3.536 . 0 0 "[ . 1 . 2]" 1
247 1 15 ILE H 1 15 ILE HG12 . . 3.820 3.792 3.683 3.844 0.024 9 0 "[ . 1 . 2]" 1
248 1 15 ILE H 1 15 ILE HG13 . . 3.880 2.431 2.295 2.499 . 0 0 "[ . 1 . 2]" 1
249 1 15 ILE H 1 15 ILE MG . . 3.900 3.690 3.675 3.718 . 0 0 "[ . 1 . 2]" 1
250 1 15 ILE H 1 16 GLN H . . 4.110 2.388 2.314 2.486 . 0 0 "[ . 1 . 2]" 1
251 1 15 ILE H 1 16 GLN HA . . 5.140 4.954 4.890 5.028 . 0 0 "[ . 1 . 2]" 1
252 1 15 ILE H 1 70 LEU MD2 . . 5.500 4.436 4.321 4.622 . 0 0 "[ . 1 . 2]" 1
253 1 15 ILE HA 1 15 ILE MD . . 4.400 3.843 3.822 3.871 . 0 0 "[ . 1 . 2]" 1
254 1 15 ILE HA 1 15 ILE HG13 . . 3.710 2.700 2.642 2.855 . 0 0 "[ . 1 . 2]" 1
255 1 15 ILE HA 1 15 ILE MG . . 3.190 2.428 2.351 2.483 . 0 0 "[ . 1 . 2]" 1
256 1 15 ILE HA 1 17 GLN H . . 5.500 4.128 3.897 4.318 . 0 0 "[ . 1 . 2]" 1
257 1 15 ILE HA 1 18 ALA H . . 4.430 3.274 3.122 3.361 . 0 0 "[ . 1 . 2]" 1
258 1 15 ILE HA 1 18 ALA MB . . 3.200 2.328 2.126 2.559 . 0 0 "[ . 1 . 2]" 1
259 1 15 ILE HA 1 19 ARG H . . 5.500 3.674 3.585 3.852 . 0 0 "[ . 1 . 2]" 1
260 1 15 ILE HB 1 15 ILE MD . . 3.060 2.087 2.026 2.263 . 0 0 "[ . 1 . 2]" 1
261 1 15 ILE HB 1 16 GLN H . . 3.600 2.888 2.796 2.971 . 0 0 "[ . 1 . 2]" 1
262 1 15 ILE HB 1 16 GLN HA . . 4.430 4.440 4.353 4.472 0.042 10 0 "[ . 1 . 2]" 1
263 1 15 ILE HB 1 16 GLN QG . . 4.820 3.663 3.440 3.778 . 0 0 "[ . 1 . 2]" 1
264 1 15 ILE MD 1 15 ILE MG . . 2.990 2.258 1.924 2.410 . 0 0 "[ . 1 . 2]" 1
265 1 15 ILE MD 1 16 GLN H . . 5.500 4.540 4.364 4.713 . 0 0 "[ . 1 . 2]" 1
266 1 15 ILE MD 1 70 LEU HA . . 4.410 3.780 3.625 3.970 . 0 0 "[ . 1 . 2]" 1
267 1 15 ILE MD 1 70 LEU MD1 . . 5.260 3.596 3.488 3.812 . 0 0 "[ . 1 . 2]" 1
268 1 15 ILE MD 1 70 LEU MD2 . . 2.960 1.687 1.644 1.756 . 0 0 "[ . 1 . 2]" 1
269 1 15 ILE MD 1 75 TYR HB2 . . 5.500 3.699 3.478 3.875 . 0 0 "[ . 1 . 2]" 1
270 1 15 ILE MD 1 75 TYR HB3 . . 5.190 3.530 3.332 3.697 . 0 0 "[ . 1 . 2]" 1
271 1 15 ILE MD 1 75 TYR QD . . 4.590 2.532 2.044 3.240 . 0 0 "[ . 1 . 2]" 1
272 1 15 ILE MD 1 75 TYR QE . . 4.650 2.760 2.345 3.400 . 0 0 "[ . 1 . 2]" 1
273 1 15 ILE HG12 1 15 ILE MG . . 3.250 2.349 2.220 2.456 . 0 0 "[ . 1 . 2]" 1
274 1 15 ILE HG12 1 16 GLN H . . 5.330 5.256 5.186 5.308 . 0 0 "[ . 1 . 2]" 1
275 1 15 ILE HG12 1 70 LEU MD2 . . 4.190 3.991 3.895 4.197 0.007 16 0 "[ . 1 . 2]" 1
276 1 15 ILE HG12 1 75 TYR QE . . 4.250 2.498 1.992 4.039 . 0 0 "[ . 1 . 2]" 1
277 1 15 ILE HG13 1 70 LEU MD2 . . 3.700 3.699 3.594 3.753 0.053 15 0 "[ . 1 . 2]" 1
278 1 15 ILE MG 1 16 GLN H . . 3.820 3.542 3.415 3.669 . 0 0 "[ . 1 . 2]" 1
279 1 15 ILE MG 1 16 GLN HA . . 4.270 3.495 3.354 3.703 . 0 0 "[ . 1 . 2]" 1
280 1 15 ILE MG 1 16 GLN HE21 . . 4.810 4.644 3.811 4.876 0.066 15 0 "[ . 1 . 2]" 1
281 1 15 ILE MG 1 16 GLN QG . . 4.130 3.975 3.549 4.141 0.011 17 0 "[ . 1 . 2]" 1
282 1 15 ILE MG 1 18 ALA H . . 5.340 4.758 4.577 4.867 . 0 0 "[ . 1 . 2]" 1
283 1 15 ILE MG 1 18 ALA MB . . 4.100 3.706 3.582 3.796 . 0 0 "[ . 1 . 2]" 1
284 1 15 ILE MG 1 19 ARG H . . 5.500 3.962 3.803 4.096 . 0 0 "[ . 1 . 2]" 1
285 1 15 ILE MG 1 19 ARG HB2 . . 3.640 3.611 3.513 3.668 0.028 19 0 "[ . 1 . 2]" 1
286 1 15 ILE MG 1 19 ARG HB3 . . 4.810 4.476 4.357 4.587 . 0 0 "[ . 1 . 2]" 1
287 1 15 ILE MG 1 19 ARG HD2 . . 3.600 1.885 1.798 1.980 . 0 0 "[ . 1 . 2]" 1
288 1 15 ILE MG 1 19 ARG HD3 . . 3.460 3.282 3.100 3.430 . 0 0 "[ . 1 . 2]" 1
289 1 15 ILE MG 1 19 ARG HE . . 4.640 3.096 2.162 3.956 . 0 0 "[ . 1 . 2]" 1
290 1 15 ILE MG 1 19 ARG HG2 . . 4.310 3.575 3.289 3.782 . 0 0 "[ . 1 . 2]" 1
291 1 15 ILE MG 1 19 ARG HG3 . . 4.560 2.333 2.012 2.542 . 0 0 "[ . 1 . 2]" 1
292 1 15 ILE MG 1 75 TYR HB2 . . 5.500 5.515 5.500 5.568 0.068 20 0 "[ . 1 . 2]" 1
293 1 15 ILE MG 1 75 TYR QE . . 3.890 2.680 2.185 3.001 . 0 0 "[ . 1 . 2]" 1
294 1 16 GLN H 1 16 GLN HB2 . . 3.560 2.435 2.330 2.474 . 0 0 "[ . 1 . 2]" 1
295 1 16 GLN H 1 16 GLN HB3 . . 3.730 3.551 3.529 3.562 . 0 0 "[ . 1 . 2]" 1
296 1 16 GLN H 1 16 GLN HE22 . . 5.500 5.050 4.856 5.606 0.106 18 0 "[ . 1 . 2]" 1
297 1 16 GLN H 1 16 GLN QG . . 3.410 2.311 2.214 2.427 . 0 0 "[ . 1 . 2]" 1
298 1 16 GLN H 1 17 GLN H . . 3.510 2.567 2.487 2.657 . 0 0 "[ . 1 . 2]" 1
299 1 16 GLN H 1 17 GLN HA . . 5.140 5.122 5.056 5.190 0.050 15 0 "[ . 1 . 2]" 1
300 1 16 GLN H 1 23 GLU HA . . 5.500 4.521 4.403 4.805 . 0 0 "[ . 1 . 2]" 1
301 1 16 GLN H 1 24 PRO HD3 . . 4.260 4.037 3.895 4.259 . 0 0 "[ . 1 . 2]" 1
302 1 16 GLN HA 1 16 GLN HE21 . . 4.260 2.279 1.864 2.411 . 0 0 "[ . 1 . 2]" 1
303 1 16 GLN HA 1 16 GLN HE22 . . 4.970 2.914 2.757 3.475 . 0 0 "[ . 1 . 2]" 1
304 1 16 GLN HA 1 16 GLN QG . . 3.590 2.942 2.452 3.087 . 0 0 "[ . 1 . 2]" 1
305 1 16 GLN HA 1 18 ALA H . . 5.440 4.730 4.583 4.849 . 0 0 "[ . 1 . 2]" 1
306 1 16 GLN HA 1 19 ARG H . . 4.240 3.672 3.533 3.810 . 0 0 "[ . 1 . 2]" 1
307 1 16 GLN HA 1 19 ARG HB2 . . 3.500 2.763 2.570 2.988 . 0 0 "[ . 1 . 2]" 1
308 1 16 GLN HA 1 19 ARG HB3 . . 4.730 4.270 4.061 4.550 . 0 0 "[ . 1 . 2]" 1
309 1 16 GLN HA 1 19 ARG HD2 . . 4.770 3.762 3.151 4.138 . 0 0 "[ . 1 . 2]" 1
310 1 16 GLN HA 1 19 ARG HD3 . . 5.080 3.986 3.785 4.287 . 0 0 "[ . 1 . 2]" 1
311 1 16 GLN HA 1 21 GLU H . . 4.400 3.860 3.760 3.963 . 0 0 "[ . 1 . 2]" 1
312 1 16 GLN HA 1 21 GLU HB2 . . 4.720 3.348 3.215 3.577 . 0 0 "[ . 1 . 2]" 1
313 1 16 GLN HA 1 21 GLU HB3 . . 5.480 5.007 4.856 5.258 . 0 0 "[ . 1 . 2]" 1
314 1 16 GLN HA 1 46 VAL MG2 . . 5.500 4.541 4.286 4.825 . 0 0 "[ . 1 . 2]" 1
315 1 16 GLN HB2 1 16 GLN HE21 . . 4.300 3.690 3.489 4.019 . 0 0 "[ . 1 . 2]" 1
316 1 16 GLN HB2 1 17 GLN H . . 4.260 2.916 2.759 3.094 . 0 0 "[ . 1 . 2]" 1
317 1 16 GLN HB2 1 17 GLN HA . . 4.700 4.406 4.322 4.532 . 0 0 "[ . 1 . 2]" 1
318 1 16 GLN HB2 1 23 GLU HA . . 3.220 2.129 1.982 2.485 . 0 0 "[ . 1 . 2]" 1
319 1 16 GLN HB2 1 24 PRO HD3 . . 3.450 2.408 2.182 2.539 . 0 0 "[ . 1 . 2]" 1
320 1 16 GLN HB3 1 16 GLN HE21 . . 4.210 2.367 2.004 3.184 . 0 0 "[ . 1 . 2]" 1
321 1 16 GLN HB3 1 16 GLN HE22 . . 4.990 3.754 3.628 3.814 . 0 0 "[ . 1 . 2]" 1
322 1 16 GLN HB3 1 17 GLN H . . 4.370 3.900 3.732 4.074 . 0 0 "[ . 1 . 2]" 1
323 1 16 GLN HB3 1 21 GLU HB2 . . 4.330 4.165 4.017 4.250 . 0 0 "[ . 1 . 2]" 1
324 1 16 GLN HB3 1 23 GLU HA . . 4.670 2.074 1.997 2.357 . 0 0 "[ . 1 . 2]" 1
325 1 16 GLN HB3 1 24 PRO HD3 . . 4.070 3.160 3.041 3.238 . 0 0 "[ . 1 . 2]" 1
326 1 16 GLN HE21 1 21 GLU H . . 5.050 4.602 4.411 4.730 . 0 0 "[ . 1 . 2]" 1
327 1 16 GLN HE21 1 21 GLU HB2 . . 4.290 3.005 2.939 3.053 . 0 0 "[ . 1 . 2]" 1
328 1 16 GLN HE21 1 21 GLU HB3 . . 4.150 4.090 3.979 4.180 0.030 13 0 "[ . 1 . 2]" 1
329 1 16 GLN HE21 1 21 GLU HG2 . . 5.500 5.338 4.852 5.490 . 0 0 "[ . 1 . 2]" 1
330 1 16 GLN HE21 1 22 LYS H . . 5.340 2.862 2.522 3.594 . 0 0 "[ . 1 . 2]" 1
331 1 16 GLN HE21 1 46 VAL MG1 . . 4.030 2.838 2.335 3.154 . 0 0 "[ . 1 . 2]" 1
332 1 16 GLN HE21 1 46 VAL MG2 . . 5.500 3.288 2.744 3.717 . 0 0 "[ . 1 . 2]" 1
333 1 16 GLN HE21 1 47 GLY H . . 5.500 4.554 4.307 4.845 . 0 0 "[ . 1 . 2]" 1
334 1 16 GLN HE22 1 19 ARG HD2 . . 4.980 4.182 3.727 4.757 . 0 0 "[ . 1 . 2]" 1
335 1 16 GLN HE22 1 19 ARG HD3 . . 4.650 3.832 3.428 4.784 0.134 13 0 "[ . 1 . 2]" 1
336 1 16 GLN HE22 1 21 GLU H . . 5.500 5.131 5.022 5.215 . 0 0 "[ . 1 . 2]" 1
337 1 16 GLN HE22 1 21 GLU HB2 . . 4.110 3.131 2.968 3.243 . 0 0 "[ . 1 . 2]" 1
338 1 16 GLN HE22 1 21 GLU HB3 . . 4.160 3.962 3.452 4.164 0.004 1 0 "[ . 1 . 2]" 1
339 1 16 GLN HE22 1 21 GLU HG2 . . 5.130 5.160 5.089 5.225 0.095 13 0 "[ . 1 . 2]" 1
340 1 16 GLN HE22 1 21 GLU HG3 . . 5.220 4.033 3.978 4.100 . 0 0 "[ . 1 . 2]" 1
341 1 16 GLN HE22 1 22 LYS H . . 5.500 3.785 3.370 3.992 . 0 0 "[ . 1 . 2]" 1
342 1 16 GLN HE22 1 46 VAL HB . . 5.500 4.674 4.378 4.917 . 0 0 "[ . 1 . 2]" 1
343 1 16 GLN HE22 1 46 VAL MG1 . . 3.790 1.882 1.776 1.938 . 0 0 "[ . 1 . 2]" 1
344 1 16 GLN HE22 1 46 VAL MG2 . . 5.500 3.216 2.797 3.565 . 0 0 "[ . 1 . 2]" 1
345 1 16 GLN QG 1 17 GLN H . . 5.030 4.220 4.127 4.280 . 0 0 "[ . 1 . 2]" 1
346 1 16 GLN QG 1 23 GLU HA . . 3.790 2.693 2.511 3.142 . 0 0 "[ . 1 . 2]" 1
347 1 16 GLN QG 1 24 PRO HA . . 4.410 3.071 2.941 3.506 . 0 0 "[ . 1 . 2]" 1
348 1 16 GLN QG 1 24 PRO HD3 . . 3.380 1.968 1.900 2.112 . 0 0 "[ . 1 . 2]" 1
349 1 16 GLN QG 1 24 PRO HG2 . . 3.700 3.757 3.710 3.826 0.126 19 0 "[ . 1 . 2]" 1
350 1 16 GLN QG 1 46 VAL HB . . 5.150 5.028 4.717 5.171 0.021 1 0 "[ . 1 . 2]" 1
351 1 16 GLN QG 1 46 VAL MG2 . . 2.850 2.380 2.224 2.675 . 0 0 "[ . 1 . 2]" 1
352 1 17 GLN H 1 17 GLN HB2 . . 3.910 3.546 2.981 3.617 . 0 0 "[ . 1 . 2]" 1
353 1 17 GLN H 1 17 GLN HB3 . . 3.290 2.447 2.270 3.553 0.263 15 0 "[ . 1 . 2]" 1
354 1 17 GLN H 1 17 GLN HG2 . . 4.350 2.461 2.041 2.677 . 0 0 "[ . 1 . 2]" 1
355 1 17 GLN H 1 17 GLN HG3 . . 4.160 3.591 2.180 3.826 . 0 0 "[ . 1 . 2]" 1
356 1 17 GLN H 1 18 ALA H . . 3.690 2.368 2.285 2.465 . 0 0 "[ . 1 . 2]" 1
357 1 17 GLN H 1 18 ALA MB . . 4.520 3.987 3.812 4.102 . 0 0 "[ . 1 . 2]" 1
358 1 17 GLN H 1 19 ARG H . . 3.680 3.644 3.567 3.697 0.017 19 0 "[ . 1 . 2]" 1
359 1 17 GLN HA 1 17 GLN HB3 . . 2.930 2.615 2.290 2.676 . 0 0 "[ . 1 . 2]" 1
360 1 17 GLN HA 1 17 GLN HG2 . . 4.030 3.733 2.884 3.798 . 0 0 "[ . 1 . 2]" 1
361 1 17 GLN HA 1 17 GLN HG3 . . 4.220 3.615 3.535 3.809 . 0 0 "[ . 1 . 2]" 1
362 1 17 GLN HA 1 19 ARG H . . 5.160 4.033 3.892 4.124 . 0 0 "[ . 1 . 2]" 1
363 1 17 GLN HA 1 20 LYS H . . 3.200 3.142 2.950 3.246 0.046 13 0 "[ . 1 . 2]" 1
364 1 17 GLN HA 1 20 LYS HA . . 4.110 3.537 3.312 3.737 . 0 0 "[ . 1 . 2]" 1
365 1 17 GLN HA 1 21 GLU H . . 4.570 4.016 3.821 4.245 . 0 0 "[ . 1 . 2]" 1
366 1 17 GLN HB2 1 18 ALA HA . . 4.990 4.859 3.848 4.990 0.000 14 0 "[ . 1 . 2]" 1
367 1 17 GLN HB3 1 18 ALA H . . 3.660 3.704 3.578 4.062 0.402 15 0 "[ . 1 . 2]" 1
368 1 17 GLN HG2 1 18 ALA H . . 4.100 2.086 1.945 3.977 . 0 0 "[ . 1 . 2]" 1
369 1 17 GLN HG2 1 18 ALA HA . . 5.500 3.930 3.625 6.213 0.713 15 1 "[ . 1 + 2]" 1
370 1 17 GLN HG2 1 18 ALA MB . . 4.530 3.194 2.906 5.341 0.811 15 1 "[ . 1 + 2]" 1
371 1 17 GLN HG3 1 18 ALA H . . 5.050 2.663 2.426 3.323 . 0 0 "[ . 1 . 2]" 1
372 1 17 GLN HG3 1 18 ALA MB . . 5.140 3.329 3.162 4.513 . 0 0 "[ . 1 . 2]" 1
373 1 17 GLN HG3 1 20 LYS H . . 5.500 4.915 4.747 6.011 0.511 15 1 "[ . 1 + 2]" 1
374 1 18 ALA H 1 18 ALA MB . . 2.780 2.132 1.937 2.165 . 0 0 "[ . 1 . 2]" 1
375 1 18 ALA H 1 19 ARG H . . 3.830 2.592 2.486 2.682 . 0 0 "[ . 1 . 2]" 1
376 1 18 ALA H 1 19 ARG HB2 . . 5.090 4.579 4.452 4.709 . 0 0 "[ . 1 . 2]" 1
377 1 18 ALA H 1 20 LYS H . . 3.860 3.876 3.841 3.920 0.060 19 0 "[ . 1 . 2]" 1
378 1 18 ALA HA 1 20 LYS H . . 4.170 3.880 3.788 3.994 . 0 0 "[ . 1 . 2]" 1
379 1 18 ALA MB 1 19 ARG H . . 3.220 2.833 2.764 2.958 . 0 0 "[ . 1 . 2]" 1
380 1 18 ALA MB 1 20 LYS H . . 4.570 4.359 4.301 4.427 . 0 0 "[ . 1 . 2]" 1
381 1 19 ARG H 1 19 ARG HB2 . . 3.250 2.210 2.181 2.262 . 0 0 "[ . 1 . 2]" 1
382 1 19 ARG H 1 19 ARG HB3 . . 3.990 3.489 3.469 3.521 . 0 0 "[ . 1 . 2]" 1
383 1 19 ARG H 1 19 ARG HD2 . . 5.270 4.346 4.176 4.490 . 0 0 "[ . 1 . 2]" 1
384 1 19 ARG H 1 19 ARG HD3 . . 5.230 4.602 4.458 4.895 . 0 0 "[ . 1 . 2]" 1
385 1 19 ARG H 1 19 ARG HG2 . . 3.910 3.892 3.842 3.934 0.024 19 0 "[ . 1 . 2]" 1
386 1 19 ARG H 1 19 ARG HG3 . . 4.260 2.820 2.751 2.929 . 0 0 "[ . 1 . 2]" 1
387 1 19 ARG H 1 20 LYS H . . 3.530 2.405 2.322 2.462 . 0 0 "[ . 1 . 2]" 1
388 1 19 ARG H 1 20 LYS HA . . 4.960 4.602 4.521 4.663 . 0 0 "[ . 1 . 2]" 1
389 1 19 ARG H 1 20 LYS QG . . 4.960 4.608 4.417 4.927 . 0 0 "[ . 1 . 2]" 1
390 1 19 ARG H 1 21 GLU H . . 4.890 3.785 3.670 3.871 . 0 0 "[ . 1 . 2]" 1
391 1 19 ARG H 1 21 GLU HG2 . . 4.840 4.808 4.657 4.863 0.023 14 0 "[ . 1 . 2]" 1
392 1 19 ARG H 1 22 LYS H . . 5.500 5.492 5.400 5.541 0.041 15 0 "[ . 1 . 2]" 1
393 1 19 ARG HA 1 19 ARG HD2 . . 4.990 4.696 4.617 4.739 . 0 0 "[ . 1 . 2]" 1
394 1 19 ARG HA 1 19 ARG HD3 . . 4.860 4.376 4.338 4.409 . 0 0 "[ . 1 . 2]" 1
395 1 19 ARG HA 1 19 ARG HG2 . . 3.430 2.376 2.331 2.416 . 0 0 "[ . 1 . 2]" 1
396 1 19 ARG HA 1 19 ARG HG3 . . 3.460 2.790 2.749 2.836 . 0 0 "[ . 1 . 2]" 1
397 1 19 ARG HA 1 20 LYS QG . . 5.500 4.393 4.004 5.003 . 0 0 "[ . 1 . 2]" 1
398 1 19 ARG HA 1 21 GLU HG2 . . 5.500 4.137 4.114 4.176 . 0 0 "[ . 1 . 2]" 1
399 1 19 ARG HA 1 21 GLU HG3 . . 5.060 5.068 5.020 5.103 0.043 14 0 "[ . 1 . 2]" 1
400 1 19 ARG HB2 1 19 ARG HD2 . . 3.050 2.977 2.623 3.070 0.020 17 0 "[ . 1 . 2]" 1
401 1 19 ARG HB2 1 19 ARG HD3 . . 2.840 2.630 2.497 2.977 0.137 13 0 "[ . 1 . 2]" 1
402 1 19 ARG HB2 1 20 LYS H . . 4.240 3.265 3.223 3.345 . 0 0 "[ . 1 . 2]" 1
403 1 19 ARG HB2 1 21 GLU HG3 . . 4.440 3.418 3.116 3.650 . 0 0 "[ . 1 . 2]" 1
404 1 19 ARG HB3 1 19 ARG HD2 . . 3.960 3.498 3.174 3.613 . 0 0 "[ . 1 . 2]" 1
405 1 19 ARG HB3 1 19 ARG HD3 . . 4.090 2.373 2.320 2.447 . 0 0 "[ . 1 . 2]" 1
406 1 19 ARG HB3 1 19 ARG HE . . 5.500 4.413 3.749 4.781 . 0 0 "[ . 1 . 2]" 1
407 1 19 ARG HB3 1 19 ARG HG2 . . 2.790 2.511 2.491 2.533 . 0 0 "[ . 1 . 2]" 1
408 1 19 ARG HB3 1 20 LYS H . . 4.710 3.899 3.826 3.964 . 0 0 "[ . 1 . 2]" 1
409 1 19 ARG HB3 1 21 GLU HG3 . . 3.850 2.427 2.389 2.463 . 0 0 "[ . 1 . 2]" 1
410 1 19 ARG HD2 1 21 GLU HG3 . . 4.950 4.378 3.948 4.583 . 0 0 "[ . 1 . 2]" 1
411 1 19 ARG HD3 1 21 GLU HG3 . . 4.910 2.744 2.613 2.859 . 0 0 "[ . 1 . 2]" 1
412 1 19 ARG HG2 1 20 LYS H . . 5.360 5.265 5.240 5.291 . 0 0 "[ . 1 . 2]" 1
413 1 19 ARG HG2 1 21 GLU HG2 . . 4.500 4.394 4.342 4.459 . 0 0 "[ . 1 . 2]" 1
414 1 19 ARG HG2 1 21 GLU HG3 . . 4.450 4.462 4.428 4.478 0.028 15 0 "[ . 1 . 2]" 1
415 1 19 ARG HG3 1 20 LYS H . . 5.500 4.826 4.737 4.877 . 0 0 "[ . 1 . 2]" 1
416 1 19 ARG HG3 1 21 GLU HG3 . . 5.500 5.051 4.904 5.143 . 0 0 "[ . 1 . 2]" 1
417 1 20 LYS H 1 20 LYS HA . . 2.770 2.208 2.206 2.210 . 0 0 "[ . 1 . 2]" 1
418 1 20 LYS H 1 20 LYS HB3 . . 3.980 4.087 4.066 4.100 0.120 16 0 "[ . 1 . 2]" 1
419 1 20 LYS H 1 20 LYS HD2 . . 5.430 5.319 4.590 5.529 0.099 13 0 "[ . 1 . 2]" 1
420 1 20 LYS H 1 20 LYS HD3 . . 5.500 5.188 4.873 5.447 . 0 0 "[ . 1 . 2]" 1
421 1 20 LYS H 1 20 LYS QE . . 5.500 5.095 4.868 5.481 . 0 0 "[ . 1 . 2]" 1
422 1 20 LYS H 1 20 LYS QG . . 3.610 2.865 2.736 3.003 . 0 0 "[ . 1 . 2]" 1
423 1 20 LYS H 1 21 GLU HG2 . . 4.670 4.239 4.121 4.349 . 0 0 "[ . 1 . 2]" 1
424 1 20 LYS H 1 22 LYS H . . 4.810 4.851 4.807 4.937 0.127 14 0 "[ . 1 . 2]" 1
425 1 20 LYS HA 1 20 LYS HB2 . . 2.900 3.012 2.973 3.031 0.131 14 0 "[ . 1 . 2]" 1
426 1 20 LYS HA 1 20 LYS HD2 . . 4.410 4.290 3.972 4.443 0.033 1 0 "[ . 1 . 2]" 1
427 1 20 LYS HA 1 20 LYS HD3 . . 4.440 3.709 3.039 4.423 . 0 0 "[ . 1 . 2]" 1
428 1 20 LYS HA 1 20 LYS QG . . 3.380 2.162 2.082 2.221 . 0 0 "[ . 1 . 2]" 1
429 1 20 LYS HA 1 22 LYS H . . 5.500 5.058 4.863 5.239 . 0 0 "[ . 1 . 2]" 1
430 1 20 LYS HB2 1 20 LYS HD2 . . 2.750 2.912 2.605 3.235 0.485 19 0 "[ . 1 . 2]" 1
431 1 20 LYS HB2 1 20 LYS QE . . 4.570 4.024 3.851 4.199 . 0 0 "[ . 1 . 2]" 1
432 1 20 LYS HB3 1 20 LYS HD3 . . 3.230 2.559 2.292 2.716 . 0 0 "[ . 1 . 2]" 1
433 1 20 LYS HB3 1 20 LYS QE . . 4.190 3.932 3.531 4.048 . 0 0 "[ . 1 . 2]" 1
434 1 20 LYS HB3 1 21 GLU H . . 4.550 4.493 4.415 4.540 . 0 0 "[ . 1 . 2]" 1
435 1 20 LYS QG 1 21 GLU H . . 5.500 4.524 4.459 4.586 . 0 0 "[ . 1 . 2]" 1
436 1 21 GLU H 1 21 GLU HB2 . . 3.500 2.421 2.379 2.474 . 0 0 "[ . 1 . 2]" 1
437 1 21 GLU H 1 21 GLU HB3 . . 3.810 3.610 3.574 3.645 . 0 0 "[ . 1 . 2]" 1
438 1 21 GLU H 1 21 GLU HG2 . . 3.950 2.609 2.508 2.657 . 0 0 "[ . 1 . 2]" 1
439 1 21 GLU H 1 21 GLU HG3 . . 4.580 3.728 3.616 3.812 . 0 0 "[ . 1 . 2]" 1
440 1 21 GLU HA 1 21 GLU HG2 . . 3.610 2.815 2.777 2.867 . 0 0 "[ . 1 . 2]" 1
441 1 21 GLU HB2 1 21 GLU HG3 . . 2.720 2.377 2.358 2.391 . 0 0 "[ . 1 . 2]" 1
442 1 21 GLU HB2 1 22 LYS H . . 3.670 2.039 1.973 2.132 . 0 0 "[ . 1 . 2]" 1
443 1 21 GLU HB3 1 21 GLU HG3 . . 2.520 2.594 2.574 2.620 0.100 4 0 "[ . 1 . 2]" 1
444 1 21 GLU HB3 1 22 LYS H . . 3.340 2.960 2.780 3.048 . 0 0 "[ . 1 . 2]" 1
445 1 21 GLU HG2 1 22 LYS H . . 4.590 4.275 4.231 4.322 . 0 0 "[ . 1 . 2]" 1
446 1 21 GLU HG3 1 22 LYS H . . 4.780 4.410 4.338 4.494 . 0 0 "[ . 1 . 2]" 1
447 1 22 LYS H 1 22 LYS QB . . 3.060 3.075 3.023 3.115 0.055 5 0 "[ . 1 . 2]" 1
448 1 22 LYS H 1 22 LYS QD . . 5.400 4.866 4.100 5.311 . 0 0 "[ . 1 . 2]" 1
449 1 22 LYS H 1 23 GLU H . . 5.220 3.987 3.918 4.025 . 0 0 "[ . 1 . 2]" 1
450 1 22 LYS HA 1 22 LYS QD . . 4.380 3.485 2.520 4.044 . 0 0 "[ . 1 . 2]" 1
451 1 22 LYS HA 1 22 LYS HG2 . . 3.500 2.821 2.000 3.892 0.392 3 0 "[ . 1 . 2]" 1
452 1 22 LYS HA 1 22 LYS HG3 . . 4.240 2.793 2.092 3.565 . 0 0 "[ . 1 . 2]" 1
453 1 22 LYS HA 1 23 GLU H . . 2.730 2.224 2.207 2.247 . 0 0 "[ . 1 . 2]" 1
454 1 22 LYS HA 1 23 GLU QB . . 4.520 4.277 4.107 4.403 . 0 0 "[ . 1 . 2]" 1
455 1 22 LYS HA 1 23 GLU QG . . 4.840 4.434 4.046 4.905 0.065 19 0 "[ . 1 . 2]" 1
456 1 22 LYS QB 1 22 LYS HG3 . . 2.430 2.358 2.179 2.562 0.132 12 0 "[ . 1 . 2]" 1
457 1 22 LYS QB 1 23 GLU H . . 3.850 3.562 3.379 3.733 . 0 0 "[ . 1 . 2]" 1
458 1 22 LYS QD 1 23 GLU H . . 4.290 4.077 2.488 4.325 0.035 13 0 "[ . 1 . 2]" 1
459 1 22 LYS QE 1 22 LYS HG2 . . 3.370 2.627 1.974 3.287 . 0 0 "[ . 1 . 2]" 1
460 1 22 LYS HG2 1 23 GLU H . . 4.350 3.315 2.274 4.264 . 0 0 "[ . 1 . 2]" 1
461 1 22 LYS HG3 1 23 GLU H . . 4.470 3.613 2.354 4.503 0.033 6 0 "[ . 1 . 2]" 1
462 1 23 GLU H 1 23 GLU QB . . 3.110 2.251 2.047 2.392 . 0 0 "[ . 1 . 2]" 1
463 1 23 GLU H 1 23 GLU QG . . 3.290 2.668 2.282 3.169 . 0 0 "[ . 1 . 2]" 1
464 1 23 GLU H 1 24 PRO HD2 . . 5.000 4.908 4.891 4.925 . 0 0 "[ . 1 . 2]" 1
465 1 23 GLU H 1 24 PRO HD3 . . 4.940 4.677 4.643 4.711 . 0 0 "[ . 1 . 2]" 1
466 1 23 GLU HA 1 24 PRO HD2 . . 3.330 2.832 2.771 2.879 . 0 0 "[ . 1 . 2]" 1
467 1 23 GLU HA 1 24 PRO HD3 . . 2.960 2.073 2.036 2.105 . 0 0 "[ . 1 . 2]" 1
468 1 23 GLU HA 1 46 VAL MG2 . . 4.890 4.713 4.420 4.990 0.100 18 0 "[ . 1 . 2]" 1
469 1 23 GLU QB 1 24 PRO HD2 . . 2.910 2.127 1.982 2.376 . 0 0 "[ . 1 . 2]" 1
470 1 23 GLU QG 1 24 PRO HD2 . . 4.370 2.741 2.076 3.331 . 0 0 "[ . 1 . 2]" 1
471 1 24 PRO HA 1 25 ASP H . . 2.890 2.253 2.228 2.286 . 0 0 "[ . 1 . 2]" 1
472 1 24 PRO HA 1 25 ASP HA . . 5.310 4.233 4.219 4.243 . 0 0 "[ . 1 . 2]" 1
473 1 24 PRO HA 1 25 ASP HB2 . . 4.850 4.057 4.007 4.158 . 0 0 "[ . 1 . 2]" 1
474 1 24 PRO HA 1 25 ASP HB3 . . 5.500 5.291 5.021 5.502 0.002 5 0 "[ . 1 . 2]" 1
475 1 24 PRO HA 1 26 TYR QD . . 5.500 5.537 5.501 5.635 0.135 17 0 "[ . 1 . 2]" 1
476 1 24 PRO HA 1 26 TYR QE . . 5.500 5.332 5.151 5.443 . 0 0 "[ . 1 . 2]" 1
477 1 24 PRO HA 1 44 VAL MG2 . . 4.530 3.796 3.619 3.948 . 0 0 "[ . 1 . 2]" 1
478 1 24 PRO HA 1 45 LYS H . . 5.220 4.434 4.341 4.520 . 0 0 "[ . 1 . 2]" 1
479 1 24 PRO HA 1 46 VAL HA . . 3.410 3.110 3.015 3.301 . 0 0 "[ . 1 . 2]" 1
480 1 24 PRO HA 1 46 VAL HB . . 5.260 4.871 4.543 5.167 . 0 0 "[ . 1 . 2]" 1
481 1 24 PRO HA 1 46 VAL MG2 . . 3.110 2.222 1.931 2.646 . 0 0 "[ . 1 . 2]" 1
482 1 24 PRO HB2 1 25 ASP H . . 4.270 3.224 3.114 3.311 . 0 0 "[ . 1 . 2]" 1
483 1 24 PRO HB2 1 26 TYR QE . . 4.720 3.151 2.996 3.322 . 0 0 "[ . 1 . 2]" 1
484 1 24 PRO HB2 1 44 VAL HA . . 4.620 4.543 4.421 4.610 . 0 0 "[ . 1 . 2]" 1
485 1 24 PRO HB2 1 44 VAL MG2 . . 2.980 2.303 2.116 2.397 . 0 0 "[ . 1 . 2]" 1
486 1 24 PRO HB2 1 45 LYS H . . 5.500 4.210 4.078 4.388 . 0 0 "[ . 1 . 2]" 1
487 1 24 PRO HB2 1 46 VAL HA . . 5.390 5.163 4.928 5.357 . 0 0 "[ . 1 . 2]" 1
488 1 24 PRO HB2 1 46 VAL MG2 . . 3.320 2.934 2.903 2.953 . 0 0 "[ . 1 . 2]" 1
489 1 24 PRO HB3 1 26 TYR QD . . 5.500 5.341 5.291 5.436 . 0 0 "[ . 1 . 2]" 1
490 1 24 PRO HB3 1 26 TYR QE . . 4.420 4.373 4.285 4.452 0.032 20 0 "[ . 1 . 2]" 1
491 1 24 PRO HB3 1 44 VAL MG2 . . 4.130 2.842 2.704 2.930 . 0 0 "[ . 1 . 2]" 1
492 1 24 PRO HB3 1 46 VAL HA . . 5.500 4.136 3.756 4.399 . 0 0 "[ . 1 . 2]" 1
493 1 24 PRO HB3 1 46 VAL MG2 . . 2.830 1.843 1.808 1.888 . 0 0 "[ . 1 . 2]" 1
494 1 24 PRO HD3 1 46 VAL MG2 . . 5.500 3.953 3.795 4.061 . 0 0 "[ . 1 . 2]" 1
495 1 24 PRO HG2 1 25 ASP H . . 5.500 5.100 5.028 5.155 . 0 0 "[ . 1 . 2]" 1
496 1 24 PRO HG2 1 26 TYR H . . 5.500 5.478 5.354 5.556 0.056 19 0 "[ . 1 . 2]" 1
497 1 24 PRO HG2 1 26 TYR QE . . 5.500 2.031 1.965 2.236 . 0 0 "[ . 1 . 2]" 1
498 1 24 PRO HG2 1 44 VAL MG2 . . 4.980 3.899 3.658 4.009 . 0 0 "[ . 1 . 2]" 1
499 1 24 PRO HG3 1 25 ASP H . . 5.500 5.517 5.457 5.563 0.063 18 0 "[ . 1 . 2]" 1
500 1 24 PRO HG3 1 26 TYR QE . . 5.070 3.569 3.463 3.681 . 0 0 "[ . 1 . 2]" 1
501 1 24 PRO HG3 1 44 VAL MG2 . . 4.060 4.053 3.885 4.110 0.050 6 0 "[ . 1 . 2]" 1
502 1 25 ASP H 1 25 ASP HB2 . . 3.450 2.289 2.158 2.468 . 0 0 "[ . 1 . 2]" 1
503 1 25 ASP H 1 25 ASP HB3 . . 3.520 3.156 2.884 3.412 . 0 0 "[ . 1 . 2]" 1
504 1 25 ASP H 1 26 TYR H . . 4.610 4.188 4.147 4.251 . 0 0 "[ . 1 . 2]" 1
505 1 25 ASP H 1 44 VAL MG2 . . 4.460 3.286 3.011 3.530 . 0 0 "[ . 1 . 2]" 1
506 1 25 ASP H 1 45 LYS H . . 4.280 2.550 2.474 2.702 . 0 0 "[ . 1 . 2]" 1
507 1 25 ASP H 1 45 LYS HB2 . . 5.200 4.323 4.011 4.551 . 0 0 "[ . 1 . 2]" 1
508 1 25 ASP H 1 45 LYS HB3 . . 4.320 3.371 3.086 3.545 . 0 0 "[ . 1 . 2]" 1
509 1 25 ASP H 1 46 VAL HA . . 4.440 3.690 3.603 3.817 . 0 0 "[ . 1 . 2]" 1
510 1 25 ASP H 1 46 VAL MG2 . . 4.880 3.102 2.835 3.506 . 0 0 "[ . 1 . 2]" 1
511 1 25 ASP HA 1 26 TYR H . . 3.140 2.274 2.269 2.285 . 0 0 "[ . 1 . 2]" 1
512 1 25 ASP HA 1 26 TYR QB . . 4.740 4.248 4.200 4.307 . 0 0 "[ . 1 . 2]" 1
513 1 25 ASP HA 1 26 TYR QD . . 4.490 3.909 3.598 4.284 . 0 0 "[ . 1 . 2]" 1
514 1 25 ASP HB2 1 26 TYR H . . 4.930 4.682 4.633 4.704 . 0 0 "[ . 1 . 2]" 1
515 1 25 ASP HB2 1 27 ILE MD . . 4.850 3.844 3.441 4.074 . 0 0 "[ . 1 . 2]" 1
516 1 25 ASP HB2 1 45 LYS H . . 4.900 3.532 2.896 3.952 . 0 0 "[ . 1 . 2]" 1
517 1 25 ASP HB2 1 45 LYS HB2 . . 4.120 3.801 3.262 4.098 . 0 0 "[ . 1 . 2]" 1
518 1 25 ASP HB2 1 45 LYS HB3 . . 4.120 2.478 2.058 2.781 . 0 0 "[ . 1 . 2]" 1
519 1 25 ASP HB3 1 26 TYR H . . 4.330 4.036 3.880 4.187 . 0 0 "[ . 1 . 2]" 1
520 1 25 ASP HB3 1 27 ILE MD . . 4.660 2.417 2.040 2.737 . 0 0 "[ . 1 . 2]" 1
521 1 25 ASP HB3 1 27 ILE HG13 . . 5.340 3.704 3.483 3.983 . 0 0 "[ . 1 . 2]" 1
522 1 25 ASP HB3 1 45 LYS H . . 4.950 3.269 2.878 3.823 . 0 0 "[ . 1 . 2]" 1
523 1 25 ASP HB3 1 45 LYS HB2 . . 4.110 3.176 2.803 3.673 . 0 0 "[ . 1 . 2]" 1
524 1 25 ASP HB3 1 45 LYS HB3 . . 4.040 2.631 2.258 3.039 . 0 0 "[ . 1 . 2]" 1
525 1 26 TYR H 1 26 TYR QB . . 3.470 2.121 2.069 2.187 . 0 0 "[ . 1 . 2]" 1
526 1 26 TYR H 1 26 TYR QD . . 3.650 2.482 2.190 2.776 . 0 0 "[ . 1 . 2]" 1
527 1 26 TYR H 1 26 TYR QE . . 5.500 4.638 4.397 4.819 . 0 0 "[ . 1 . 2]" 1
528 1 26 TYR H 1 27 ILE H . . 5.500 4.571 4.459 4.607 . 0 0 "[ . 1 . 2]" 1
529 1 26 TYR H 1 27 ILE MD . . 4.910 4.248 4.127 4.354 . 0 0 "[ . 1 . 2]" 1
530 1 26 TYR H 1 44 VAL HA . . 5.500 4.496 4.396 4.556 . 0 0 "[ . 1 . 2]" 1
531 1 26 TYR H 1 44 VAL MG2 . . 5.500 4.362 4.102 4.553 . 0 0 "[ . 1 . 2]" 1
532 1 26 TYR HA 1 26 TYR QD . . 4.120 2.901 2.643 3.039 . 0 0 "[ . 1 . 2]" 1
533 1 26 TYR HA 1 26 TYR QE . . 5.500 4.671 4.583 4.761 . 0 0 "[ . 1 . 2]" 1
534 1 26 TYR HA 1 27 ILE H . . 2.930 2.225 2.187 2.265 . 0 0 "[ . 1 . 2]" 1
535 1 26 TYR HA 1 27 ILE HA . . 4.860 4.397 4.378 4.414 . 0 0 "[ . 1 . 2]" 1
536 1 26 TYR HA 1 27 ILE HB . . 5.120 4.713 4.673 4.752 . 0 0 "[ . 1 . 2]" 1
537 1 26 TYR HA 1 27 ILE MD . . 4.980 3.000 2.820 3.202 . 0 0 "[ . 1 . 2]" 1
538 1 26 TYR HA 1 44 VAL HA . . 3.290 2.227 2.023 2.456 . 0 0 "[ . 1 . 2]" 1
539 1 26 TYR HA 1 44 VAL HB . . 4.590 3.727 3.571 3.805 . 0 0 "[ . 1 . 2]" 1
540 1 26 TYR HA 1 44 VAL MG2 . . 4.340 3.377 3.042 3.549 . 0 0 "[ . 1 . 2]" 1
541 1 26 TYR HA 1 45 LYS H . . 4.640 3.541 3.281 3.808 . 0 0 "[ . 1 . 2]" 1
542 1 26 TYR QB 1 27 ILE H . . 4.440 3.213 3.032 3.499 . 0 0 "[ . 1 . 2]" 1
543 1 26 TYR QB 1 27 ILE HA . . 5.430 4.048 4.006 4.158 . 0 0 "[ . 1 . 2]" 1
544 1 26 TYR QB 1 27 ILE MG . . 5.500 5.377 5.323 5.485 . 0 0 "[ . 1 . 2]" 1
545 1 26 TYR QB 1 42 MET ME . . 3.210 2.333 1.909 2.975 . 0 0 "[ . 1 . 2]" 1
546 1 26 TYR QB 1 62 LYS HE2 . . 5.500 4.559 4.058 5.230 . 0 0 "[ . 1 . 2]" 1
547 1 26 TYR QB 1 62 LYS HE3 . . 4.790 4.997 4.059 5.524 0.734 16 8 "[- *** *1 * *+ 2]" 1
548 1 26 TYR QB 1 62 LYS QG . . 5.500 2.819 2.333 3.010 . 0 0 "[ . 1 . 2]" 1
549 1 26 TYR QD 1 27 ILE H . . 5.500 3.938 3.727 4.120 . 0 0 "[ . 1 . 2]" 1
550 1 26 TYR QD 1 42 MET HB2 . . 5.500 5.495 5.300 5.848 0.348 12 0 "[ . 1 . 2]" 1
551 1 26 TYR QD 1 42 MET ME . . 3.900 3.412 3.024 3.903 0.003 11 0 "[ . 1 . 2]" 1
552 1 26 TYR QD 1 42 MET QG . . 4.440 3.577 2.833 4.192 . 0 0 "[ . 1 . 2]" 1
553 1 26 TYR QD 1 44 VAL HA . . 5.500 3.729 3.528 3.884 . 0 0 "[ . 1 . 2]" 1
554 1 26 TYR QD 1 44 VAL HB . . 3.250 3.073 2.822 3.214 . 0 0 "[ . 1 . 2]" 1
555 1 26 TYR QD 1 44 VAL MG1 . . 5.060 4.525 4.335 4.623 . 0 0 "[ . 1 . 2]" 1
556 1 26 TYR QD 1 44 VAL MG2 . . 4.250 3.351 2.948 3.558 . 0 0 "[ . 1 . 2]" 1
557 1 26 TYR QD 1 45 LYS H . . 5.500 5.148 4.937 5.323 . 0 0 "[ . 1 . 2]" 1
558 1 26 TYR QD 1 62 LYS HA . . 4.890 3.405 3.085 3.627 . 0 0 "[ . 1 . 2]" 1
559 1 26 TYR QD 1 62 LYS QB . . 5.060 4.042 3.722 4.255 . 0 0 "[ . 1 . 2]" 1
560 1 26 TYR QD 1 62 LYS HE2 . . 5.450 4.743 4.585 5.011 . 0 0 "[ . 1 . 2]" 1
561 1 26 TYR QD 1 62 LYS HE3 . . 4.690 5.016 4.602 5.326 0.636 9 8 "[* *** +1 - ** 2]" 1
562 1 26 TYR QD 1 62 LYS QG . . 4.410 2.153 1.962 2.347 . 0 0 "[ . 1 . 2]" 1
563 1 26 TYR QD 1 65 ALA MB . . 4.380 2.856 2.635 3.031 . 0 0 "[ . 1 . 2]" 1
564 1 26 TYR QE 1 42 MET ME . . 5.500 5.057 4.689 5.529 0.029 11 0 "[ . 1 . 2]" 1
565 1 26 TYR QE 1 44 VAL HA . . 5.290 4.768 4.652 4.880 . 0 0 "[ . 1 . 2]" 1
566 1 26 TYR QE 1 44 VAL HB . . 3.130 3.152 3.102 3.191 0.061 14 0 "[ . 1 . 2]" 1
567 1 26 TYR QE 1 44 VAL MG1 . . 4.700 4.062 3.936 4.142 . 0 0 "[ . 1 . 2]" 1
568 1 26 TYR QE 1 44 VAL MG2 . . 3.540 2.900 2.552 3.201 . 0 0 "[ . 1 . 2]" 1
569 1 26 TYR QE 1 62 LYS HA . . 4.410 3.732 3.550 4.005 . 0 0 "[ . 1 . 2]" 1
570 1 26 TYR QE 1 62 LYS HE2 . . 5.180 5.063 4.397 5.371 0.191 17 0 "[ . 1 . 2]" 1
571 1 26 TYR QE 1 62 LYS HE3 . . 5.280 5.066 4.786 5.304 0.024 20 0 "[ . 1 . 2]" 1
572 1 26 TYR QE 1 62 LYS QG . . 4.530 2.346 2.057 2.661 . 0 0 "[ . 1 . 2]" 1
573 1 26 TYR QE 1 65 ALA MB . . 3.760 2.282 1.977 2.648 . 0 0 "[ . 1 . 2]" 1
574 1 26 TYR QE 1 66 ALA H . . 4.600 2.811 2.582 3.112 . 0 0 "[ . 1 . 2]" 1
575 1 26 TYR QE 1 66 ALA HA . . 4.970 3.706 3.239 3.977 . 0 0 "[ . 1 . 2]" 1
576 1 26 TYR QE 1 66 ALA MB . . 4.000 2.804 2.160 3.088 . 0 0 "[ . 1 . 2]" 1
577 1 27 ILE H 1 27 ILE HB . . 3.540 2.827 2.708 2.885 . 0 0 "[ . 1 . 2]" 1
578 1 27 ILE H 1 27 ILE MD . . 4.240 2.321 2.217 2.441 . 0 0 "[ . 1 . 2]" 1
579 1 27 ILE H 1 27 ILE HG12 . . 4.460 4.308 4.186 4.366 . 0 0 "[ . 1 . 2]" 1
580 1 27 ILE H 1 27 ILE HG13 . . 4.800 3.178 3.079 3.268 . 0 0 "[ . 1 . 2]" 1
581 1 27 ILE H 1 27 ILE MG . . 3.830 3.922 3.875 3.943 0.113 7 0 "[ . 1 . 2]" 1
582 1 27 ILE H 1 28 LEU H . . 5.350 4.349 4.264 4.474 . 0 0 "[ . 1 . 2]" 1
583 1 27 ILE H 1 42 MET ME . . 4.560 3.801 3.515 4.394 . 0 0 "[ . 1 . 2]" 1
584 1 27 ILE H 1 42 MET QG . . 5.500 4.388 3.338 5.158 . 0 0 "[ . 1 . 2]" 1
585 1 27 ILE H 1 43 GLN H . . 4.160 2.737 2.633 2.907 . 0 0 "[ . 1 . 2]" 1
586 1 27 ILE H 1 43 GLN HB3 . . 4.660 2.811 2.603 3.049 . 0 0 "[ . 1 . 2]" 1
587 1 27 ILE H 1 44 VAL HA . . 4.660 3.431 3.387 3.516 . 0 0 "[ . 1 . 2]" 1
588 1 27 ILE H 1 44 VAL HB . . 5.480 4.811 4.671 4.886 . 0 0 "[ . 1 . 2]" 1
589 1 27 ILE H 1 44 VAL MG2 . . 5.500 4.978 4.733 5.095 . 0 0 "[ . 1 . 2]" 1
590 1 27 ILE H 1 45 LYS H . . 5.500 4.867 4.719 5.037 . 0 0 "[ . 1 . 2]" 1
591 1 27 ILE HA 1 27 ILE MD . . 4.480 3.616 3.578 3.655 . 0 0 "[ . 1 . 2]" 1
592 1 27 ILE HA 1 27 ILE MG . . 3.320 2.214 2.163 2.316 . 0 0 "[ . 1 . 2]" 1
593 1 27 ILE HA 1 28 LEU H . . 3.060 2.299 2.191 2.565 . 0 0 "[ . 1 . 2]" 1
594 1 27 ILE HA 1 28 LEU HB2 . . 5.000 4.321 4.191 4.433 . 0 0 "[ . 1 . 2]" 1
595 1 27 ILE HA 1 28 LEU HB3 . . 4.890 4.685 4.588 4.786 . 0 0 "[ . 1 . 2]" 1
596 1 27 ILE HA 1 42 MET ME . . 4.700 3.685 3.190 4.318 . 0 0 "[ . 1 . 2]" 1
597 1 27 ILE HA 1 43 GLN H . . 5.500 4.598 4.518 4.641 . 0 0 "[ . 1 . 2]" 1
598 1 27 ILE HB 1 28 LEU H . . 4.260 3.887 3.312 4.158 . 0 0 "[ . 1 . 2]" 1
599 1 27 ILE HB 1 43 GLN H . . 4.470 3.927 3.544 4.131 . 0 0 "[ . 1 . 2]" 1
600 1 27 ILE HB 1 43 GLN HB3 . . 3.680 2.188 2.152 2.220 . 0 0 "[ . 1 . 2]" 1
601 1 27 ILE MD 1 43 GLN HA . . 4.440 4.472 4.395 4.510 0.070 3 0 "[ . 1 . 2]" 1
602 1 27 ILE MD 1 43 GLN HB3 . . 3.540 2.360 2.194 2.471 . 0 0 "[ . 1 . 2]" 1
603 1 27 ILE MD 1 43 GLN HE21 . . 5.090 2.250 1.913 4.292 . 0 0 "[ . 1 . 2]" 1
604 1 27 ILE MD 1 43 GLN HE22 . . 5.500 3.378 3.069 3.748 . 0 0 "[ . 1 . 2]" 1
605 1 27 ILE MD 1 44 VAL HA . . 4.580 3.082 2.962 3.208 . 0 0 "[ . 1 . 2]" 1
606 1 27 ILE MD 1 45 LYS H . . 4.850 3.046 2.971 3.081 . 0 0 "[ . 1 . 2]" 1
607 1 27 ILE MD 1 45 LYS QD . . 4.430 3.575 3.160 4.032 . 0 0 "[ . 1 . 2]" 1
608 1 27 ILE MD 1 45 LYS QE . . 5.500 3.517 2.419 4.520 . 0 0 "[ . 1 . 2]" 1
609 1 27 ILE HG12 1 27 ILE MG . . 3.670 2.036 1.989 2.115 . 0 0 "[ . 1 . 2]" 1
610 1 27 ILE HG12 1 28 LEU H . . 5.210 5.094 4.639 5.306 0.096 15 0 "[ . 1 . 2]" 1
611 1 27 ILE HG12 1 43 GLN HE21 . . 5.500 4.095 3.784 6.403 0.903 18 1 "[ . 1 . + 2]" 1
612 1 27 ILE HG13 1 28 LEU H . . 5.250 4.662 4.550 4.731 . 0 0 "[ . 1 . 2]" 1
613 1 27 ILE HG13 1 43 GLN HB3 . . 4.590 4.503 4.395 4.617 0.027 20 0 "[ . 1 . 2]" 1
614 1 27 ILE MG 1 28 LEU H . . 3.700 2.243 1.788 2.528 . 0 0 "[ . 1 . 2]" 1
615 1 27 ILE MG 1 28 LEU HB2 . . 4.650 4.521 4.161 4.712 0.062 3 0 "[ . 1 . 2]" 1
616 1 27 ILE MG 1 28 LEU HB3 . . 4.720 4.044 3.737 4.258 . 0 0 "[ . 1 . 2]" 1
617 1 27 ILE MG 1 43 GLN HB2 . . 4.400 4.395 4.301 4.436 0.036 19 0 "[ . 1 . 2]" 1
618 1 27 ILE MG 1 43 GLN HB3 . . 3.750 3.769 3.745 3.787 0.037 13 0 "[ . 1 . 2]" 1
619 1 27 ILE MG 1 43 GLN HE21 . . 5.210 3.663 3.377 5.289 0.079 18 0 "[ . 1 . 2]" 1
620 1 27 ILE MG 1 43 GLN HE22 . . 5.500 4.044 3.675 5.020 . 0 0 "[ . 1 . 2]" 1
621 1 28 LEU H 1 28 LEU HB2 . . 3.410 2.615 2.395 2.893 . 0 0 "[ . 1 . 2]" 1
622 1 28 LEU H 1 28 LEU HB3 . . 3.300 2.503 2.395 2.602 . 0 0 "[ . 1 . 2]" 1
623 1 28 LEU H 1 28 LEU QD . . 4.480 3.667 3.592 3.889 . 0 0 "[ . 1 . 2]" 1
624 1 28 LEU H 1 28 LEU HG . . 5.100 4.561 4.383 4.793 . 0 0 "[ . 1 . 2]" 1
625 1 28 LEU H 1 29 LEU H . . 5.500 4.404 4.258 4.528 . 0 0 "[ . 1 . 2]" 1
626 1 28 LEU H 1 42 MET HA . . 5.500 5.173 5.028 5.273 . 0 0 "[ . 1 . 2]" 1
627 1 28 LEU H 1 42 MET ME . . 4.950 3.664 3.226 4.147 . 0 0 "[ . 1 . 2]" 1
628 1 28 LEU HA 1 28 LEU QD . . 3.060 2.102 1.909 2.418 . 0 0 "[ . 1 . 2]" 1
629 1 28 LEU HA 1 29 LEU HB3 . . 5.500 5.648 5.625 5.662 0.162 9 0 "[ . 1 . 2]" 1
630 1 28 LEU HA 1 29 LEU MD2 . . 5.500 4.375 4.033 4.650 . 0 0 "[ . 1 . 2]" 1
631 1 28 LEU HA 1 29 LEU HG . . 5.080 4.343 4.233 4.473 . 0 0 "[ . 1 . 2]" 1
632 1 28 LEU HA 1 42 MET HA . . 3.570 2.587 2.457 2.693 . 0 0 "[ . 1 . 2]" 1
633 1 28 LEU HA 1 42 MET ME . . 4.080 3.257 2.869 3.445 . 0 0 "[ . 1 . 2]" 1
634 1 28 LEU HA 1 42 MET QG . . 4.870 3.432 2.956 4.021 . 0 0 "[ . 1 . 2]" 1
635 1 28 LEU HA 1 43 GLN H . . 4.770 3.329 3.244 3.446 . 0 0 "[ . 1 . 2]" 1
636 1 28 LEU HB2 1 28 LEU QD . . 3.080 2.242 2.039 2.413 . 0 0 "[ . 1 . 2]" 1
637 1 28 LEU HB2 1 29 LEU H . . 5.430 4.457 4.337 4.516 . 0 0 "[ . 1 . 2]" 1
638 1 28 LEU HB2 1 42 MET HA . . 4.780 4.776 4.637 4.850 0.070 18 0 "[ . 1 . 2]" 1
639 1 28 LEU HB3 1 28 LEU QD . . 3.170 2.202 2.127 2.253 . 0 0 "[ . 1 . 2]" 1
640 1 28 LEU HB3 1 28 LEU HG . . 2.580 2.523 2.438 2.635 0.055 13 0 "[ . 1 . 2]" 1
641 1 28 LEU HB3 1 29 LEU H . . 5.100 4.377 4.308 4.433 . 0 0 "[ . 1 . 2]" 1
642 1 28 LEU HB3 1 30 SER H . . 5.500 5.399 5.108 5.502 0.002 5 0 "[ . 1 . 2]" 1
643 1 28 LEU HB3 1 58 LYS QE . . 5.320 4.190 3.306 4.855 . 0 0 "[ . 1 . 2]" 1
644 1 28 LEU QD 1 29 LEU H . . 3.760 2.771 2.411 3.398 . 0 0 "[ . 1 . 2]" 1
645 1 28 LEU QD 1 29 LEU HA . . 5.470 4.104 3.528 4.888 . 0 0 "[ . 1 . 2]" 1
646 1 28 LEU QD 1 29 LEU HB2 . . 5.500 3.975 3.536 4.632 . 0 0 "[ . 1 . 2]" 1
647 1 28 LEU QD 1 30 SER H . . 4.360 2.705 2.025 3.596 . 0 0 "[ . 1 . 2]" 1
648 1 28 LEU QD 1 30 SER HA . . 5.360 2.840 2.220 3.647 . 0 0 "[ . 1 . 2]" 1
649 1 28 LEU QD 1 31 GLU H . . 5.500 4.151 3.672 4.819 . 0 0 "[ . 1 . 2]" 1
650 1 28 LEU QD 1 31 GLU HB2 . . 4.790 4.081 3.203 4.437 . 0 0 "[ . 1 . 2]" 1
651 1 28 LEU QD 1 31 GLU HB3 . . 4.560 3.714 2.940 4.532 . 0 0 "[ . 1 . 2]" 1
652 1 28 LEU QD 1 31 GLU HG2 . . 4.880 3.894 2.410 4.942 0.062 9 0 "[ . 1 . 2]" 1
653 1 28 LEU QD 1 31 GLU HG3 . . 5.400 3.719 2.211 4.856 . 0 0 "[ . 1 . 2]" 1
654 1 28 LEU QD 1 40 PHE HB2 . . 4.510 4.415 4.270 4.472 . 0 0 "[ . 1 . 2]" 1
655 1 28 LEU QD 1 40 PHE HB3 . . 4.270 3.023 2.861 3.077 . 0 0 "[ . 1 . 2]" 1
656 1 28 LEU QD 1 40 PHE QD . . 3.290 2.548 2.046 2.911 . 0 0 "[ . 1 . 2]" 1
657 1 28 LEU QD 1 40 PHE QE . . 4.690 3.901 3.462 4.244 . 0 0 "[ . 1 . 2]" 1
658 1 28 LEU QD 1 41 VAL H . . 4.120 3.423 2.910 3.779 . 0 0 "[ . 1 . 2]" 1
659 1 28 LEU QD 1 41 VAL HB . . 5.500 3.980 3.550 4.558 . 0 0 "[ . 1 . 2]" 1
660 1 28 LEU QD 1 42 MET HA . . 3.990 2.888 2.548 3.294 . 0 0 "[ . 1 . 2]" 1
661 1 28 LEU QD 1 42 MET HB2 . . 5.500 3.924 3.558 4.249 . 0 0 "[ . 1 . 2]" 1
662 1 28 LEU QD 1 42 MET HB3 . . 4.930 4.736 4.386 4.890 . 0 0 "[ . 1 . 2]" 1
663 1 28 LEU QD 1 42 MET ME . . 2.930 2.690 2.371 2.918 . 0 0 "[ . 1 . 2]" 1
664 1 28 LEU QD 1 42 MET QG . . 4.380 2.933 1.998 3.860 . 0 0 "[ . 1 . 2]" 1
665 1 28 LEU QD 1 43 GLN H . . 5.500 4.329 4.015 4.641 . 0 0 "[ . 1 . 2]" 1
666 1 28 LEU QD 1 58 LYS HA . . 4.810 3.567 3.173 3.874 . 0 0 "[ . 1 . 2]" 1
667 1 28 LEU QD 1 58 LYS QE . . 4.830 2.238 1.656 2.854 . 0 0 "[ . 1 . 2]" 1
668 1 28 LEU QD 1 58 LYS HG3 . . 2.920 1.988 1.762 2.584 . 0 0 "[ . 1 . 2]" 1
669 1 28 LEU HG 1 29 LEU H . . 5.000 4.270 3.068 5.061 0.061 12 0 "[ . 1 . 2]" 1
670 1 28 LEU HG 1 30 SER H . . 5.210 4.356 3.005 5.223 0.013 14 0 "[ . 1 . 2]" 1
671 1 28 LEU HG 1 30 SER HA . . 5.500 4.401 3.410 5.136 . 0 0 "[ . 1 . 2]" 1
672 1 29 LEU H 1 29 LEU HB2 . . 3.860 2.271 2.205 2.318 . 0 0 "[ . 1 . 2]" 1
673 1 29 LEU H 1 29 LEU HB3 . . 3.760 3.510 3.485 3.525 . 0 0 "[ . 1 . 2]" 1
674 1 29 LEU H 1 29 LEU MD1 . . 4.560 3.962 3.868 4.029 . 0 0 "[ . 1 . 2]" 1
675 1 29 LEU H 1 29 LEU MD2 . . 4.540 3.225 2.860 3.463 . 0 0 "[ . 1 . 2]" 1
676 1 29 LEU H 1 29 LEU HG . . 4.130 2.683 2.534 2.829 . 0 0 "[ . 1 . 2]" 1
677 1 29 LEU H 1 30 SER H . . 3.900 2.724 2.610 2.860 . 0 0 "[ . 1 . 2]" 1
678 1 29 LEU H 1 41 VAL H . . 5.500 4.692 4.395 4.855 . 0 0 "[ . 1 . 2]" 1
679 1 29 LEU H 1 41 VAL HB . . 4.930 3.569 3.285 3.747 . 0 0 "[ . 1 . 2]" 1
680 1 29 LEU H 1 42 MET HA . . 3.960 2.580 2.329 2.688 . 0 0 "[ . 1 . 2]" 1
681 1 29 LEU H 1 42 MET HB2 . . 5.280 5.184 4.828 5.332 0.052 20 0 "[ . 1 . 2]" 1
682 1 29 LEU H 1 43 GLN H . . 4.400 3.614 3.336 3.850 . 0 0 "[ . 1 . 2]" 1
683 1 29 LEU HA 1 29 LEU MD1 . . 4.570 3.694 3.597 3.760 . 0 0 "[ . 1 . 2]" 1
684 1 29 LEU HA 1 29 LEU MD2 . . 2.940 1.890 1.861 1.937 . 0 0 "[ . 1 . 2]" 1
685 1 29 LEU HA 1 30 SER QB . . 5.500 4.394 4.190 4.744 . 0 0 "[ . 1 . 2]" 1
686 1 29 LEU HB2 1 29 LEU MD1 . . 3.170 2.566 2.489 2.652 . 0 0 "[ . 1 . 2]" 1
687 1 29 LEU HB2 1 29 LEU MD2 . . 3.300 3.192 3.156 3.205 . 0 0 "[ . 1 . 2]" 1
688 1 29 LEU HB2 1 30 SER H . . 3.710 2.400 2.318 2.562 . 0 0 "[ . 1 . 2]" 1
689 1 29 LEU HB2 1 30 SER QB . . 4.070 4.018 3.900 4.505 0.435 14 0 "[ . 1 . 2]" 1
690 1 29 LEU HB2 1 41 VAL H . . 5.500 4.176 4.078 4.299 . 0 0 "[ . 1 . 2]" 1
691 1 29 LEU HB2 1 41 VAL HA . . 5.500 4.023 3.787 4.155 . 0 0 "[ . 1 . 2]" 1
692 1 29 LEU HB2 1 41 VAL HB . . 4.020 2.001 1.962 2.093 . 0 0 "[ . 1 . 2]" 1
693 1 29 LEU HB2 1 41 VAL MG2 . . 4.440 3.617 3.560 3.695 . 0 0 "[ . 1 . 2]" 1
694 1 29 LEU HB2 1 42 MET HA . . 5.500 3.846 3.633 3.924 . 0 0 "[ . 1 . 2]" 1
695 1 29 LEU HB3 1 29 LEU MD1 . . 2.990 2.142 2.023 2.234 . 0 0 "[ . 1 . 2]" 1
696 1 29 LEU HB3 1 29 LEU MD2 . . 3.060 2.561 2.466 2.701 . 0 0 "[ . 1 . 2]" 1
697 1 29 LEU HB3 1 30 SER H . . 4.130 3.184 3.089 3.416 . 0 0 "[ . 1 . 2]" 1
698 1 29 LEU HB3 1 41 VAL H . . 5.500 5.374 5.254 5.490 . 0 0 "[ . 1 . 2]" 1
699 1 29 LEU HB3 1 41 VAL HB . . 3.330 2.944 2.814 3.034 . 0 0 "[ . 1 . 2]" 1
700 1 29 LEU HB3 1 41 VAL MG1 . . 3.220 2.317 2.125 2.724 . 0 0 "[ . 1 . 2]" 1
701 1 29 LEU HB3 1 42 MET HA . . 5.500 5.475 5.246 5.571 0.071 18 0 "[ . 1 . 2]" 1
702 1 29 LEU HB3 1 52 THR MG . . 5.500 4.972 4.630 5.152 . 0 0 "[ . 1 . 2]" 1
703 1 29 LEU MD1 1 30 SER H . . 5.500 4.486 4.388 4.713 . 0 0 "[ . 1 . 2]" 1
704 1 29 LEU MD1 1 42 MET HA . . 4.810 4.578 4.339 4.798 . 0 0 "[ . 1 . 2]" 1
705 1 29 LEU MD1 1 43 GLN H . . 4.690 4.649 4.490 4.719 0.029 16 0 "[ . 1 . 2]" 1
706 1 29 LEU MD1 1 43 GLN HA . . 5.210 3.885 3.800 3.979 . 0 0 "[ . 1 . 2]" 1
707 1 29 LEU MD1 1 43 GLN HB2 . . 3.280 2.971 2.828 3.114 . 0 0 "[ . 1 . 2]" 1
708 1 29 LEU MD1 1 43 GLN HE21 . . 4.890 4.756 3.367 4.900 0.010 10 0 "[ . 1 . 2]" 1
709 1 29 LEU MD1 1 43 GLN HE22 . . 5.500 4.582 4.275 4.883 . 0 0 "[ . 1 . 2]" 1
710 1 29 LEU MD1 1 43 GLN HG3 . . 3.390 3.293 2.942 3.394 0.004 3 0 "[ . 1 . 2]" 1
711 1 29 LEU MD1 1 52 THR HB . . 5.500 3.196 2.724 3.436 . 0 0 "[ . 1 . 2]" 1
712 1 29 LEU MD1 1 52 THR MG . . 2.870 2.128 1.864 2.270 . 0 0 "[ . 1 . 2]" 1
713 1 29 LEU MD2 1 30 SER H . . 4.560 4.523 4.446 4.565 0.005 16 0 "[ . 1 . 2]" 1
714 1 29 LEU MD2 1 30 SER QB . . 5.500 4.921 4.736 5.127 . 0 0 "[ . 1 . 2]" 1
715 1 29 LEU MD2 1 42 MET HA . . 4.870 4.640 4.267 4.846 . 0 0 "[ . 1 . 2]" 1
716 1 29 LEU MD2 1 43 GLN H . . 4.720 4.064 3.711 4.373 . 0 0 "[ . 1 . 2]" 1
717 1 29 LEU MD2 1 43 GLN HB2 . . 3.430 2.208 1.914 2.438 . 0 0 "[ . 1 . 2]" 1
718 1 29 LEU MD2 1 43 GLN HB3 . . 3.240 3.070 2.734 3.255 0.015 5 0 "[ . 1 . 2]" 1
719 1 29 LEU MD2 1 43 GLN HE21 . . 5.130 3.168 2.460 3.400 . 0 0 "[ . 1 . 2]" 1
720 1 29 LEU MD2 1 43 GLN HE22 . . 4.790 2.961 2.749 3.607 . 0 0 "[ . 1 . 2]" 1
721 1 29 LEU HG 1 30 SER H . . 5.500 4.477 4.395 4.611 . 0 0 "[ . 1 . 2]" 1
722 1 29 LEU HG 1 42 MET HA . . 4.050 3.566 3.358 3.761 . 0 0 "[ . 1 . 2]" 1
723 1 29 LEU HG 1 43 GLN H . . 4.490 3.445 3.186 3.611 . 0 0 "[ . 1 . 2]" 1
724 1 29 LEU HG 1 43 GLN HB2 . . 3.850 1.991 1.956 2.062 . 0 0 "[ . 1 . 2]" 1
725 1 29 LEU HG 1 43 GLN HB3 . . 4.360 3.631 3.572 3.729 . 0 0 "[ . 1 . 2]" 1
726 1 29 LEU HG 1 43 GLN HG3 . . 4.330 3.931 3.581 4.096 . 0 0 "[ . 1 . 2]" 1
727 1 29 LEU HG 1 52 THR MG . . 5.500 3.247 2.884 3.487 . 0 0 "[ . 1 . 2]" 1
728 1 30 SER H 1 31 GLU H . . 4.910 4.335 4.293 4.357 . 0 0 "[ . 1 . 2]" 1
729 1 30 SER H 1 41 VAL H . . 4.630 2.963 2.841 3.135 . 0 0 "[ . 1 . 2]" 1
730 1 30 SER H 1 41 VAL HB . . 4.110 2.019 1.946 2.171 . 0 0 "[ . 1 . 2]" 1
731 1 30 SER H 1 41 VAL MG1 . . 5.390 3.491 3.421 3.629 . 0 0 "[ . 1 . 2]" 1
732 1 30 SER H 1 41 VAL MG2 . . 4.390 3.379 3.218 3.558 . 0 0 "[ . 1 . 2]" 1
733 1 30 SER H 1 42 MET HA . . 5.500 4.561 4.233 4.684 . 0 0 "[ . 1 . 2]" 1
734 1 30 SER HA 1 31 GLU H . . 3.480 2.767 2.554 2.888 . 0 0 "[ . 1 . 2]" 1
735 1 30 SER QB 1 31 GLU H . . 3.690 2.289 1.931 2.954 . 0 0 "[ . 1 . 2]" 1
736 1 30 SER QB 1 32 ARG QD . . 5.500 3.186 2.465 4.679 . 0 0 "[ . 1 . 2]" 1
737 1 30 SER QB 1 32 ARG QG . . 5.500 4.466 3.427 5.344 . 0 0 "[ . 1 . 2]" 1
738 1 30 SER QB 1 41 VAL H . . 5.180 4.164 3.876 4.730 . 0 0 "[ . 1 . 2]" 1
739 1 30 SER QB 1 41 VAL HB . . 4.020 3.305 2.952 3.967 . 0 0 "[ . 1 . 2]" 1
740 1 30 SER QB 1 41 VAL MG1 . . 5.330 4.047 3.690 4.622 . 0 0 "[ . 1 . 2]" 1
741 1 30 SER QB 1 41 VAL MG2 . . 3.790 3.029 2.676 3.810 0.020 14 0 "[ . 1 . 2]" 1
742 1 31 GLU H 1 31 GLU HB2 . . 3.890 3.457 2.742 3.961 0.071 8 0 "[ . 1 . 2]" 1
743 1 31 GLU H 1 31 GLU HB3 . . 3.830 3.486 2.944 3.939 0.109 14 0 "[ . 1 . 2]" 1
744 1 31 GLU H 1 31 GLU HG3 . . 5.500 3.786 2.377 5.137 . 0 0 "[ . 1 . 2]" 1
745 1 31 GLU H 1 32 ARG QB . . 4.210 4.067 3.911 4.203 . 0 0 "[ . 1 . 2]" 1
746 1 31 GLU H 1 32 ARG QG . . 4.720 4.359 3.598 4.689 . 0 0 "[ . 1 . 2]" 1
747 1 31 GLU H 1 41 VAL H . . 5.500 4.652 4.259 4.960 . 0 0 "[ . 1 . 2]" 1
748 1 31 GLU HA 1 32 ARG H . . 3.380 2.219 2.202 2.288 . 0 0 "[ . 1 . 2]" 1
749 1 31 GLU HA 1 41 VAL H . . 4.400 2.906 2.611 3.212 . 0 0 "[ . 1 . 2]" 1
750 1 31 GLU HB2 1 32 ARG H . . 5.180 3.938 3.063 4.531 . 0 0 "[ . 1 . 2]" 1
751 1 31 GLU HB2 1 40 PHE QD . . 5.500 3.761 2.928 4.925 . 0 0 "[ . 1 . 2]" 1
752 1 31 GLU HB2 1 40 PHE QE . . 5.280 3.598 2.577 4.653 . 0 0 "[ . 1 . 2]" 1
753 1 31 GLU HB3 1 40 PHE QD . . 5.500 3.232 2.040 5.093 . 0 0 "[ . 1 . 2]" 1
754 1 31 GLU HG2 1 40 PHE QD . . 4.850 3.759 2.116 5.232 0.382 12 0 "[ . 1 . 2]" 1
755 1 31 GLU HG2 1 40 PHE QE . . 4.900 3.848 2.260 5.054 0.154 12 0 "[ . 1 . 2]" 1
756 1 31 GLU HG2 1 40 PHE HZ . . 5.500 5.032 4.010 6.099 0.599 16 1 "[ . 1 .+ 2]" 1
757 1 31 GLU HG3 1 32 ARG H . . 5.500 5.042 4.371 5.486 . 0 0 "[ . 1 . 2]" 1
758 1 31 GLU HG3 1 40 PHE QE . . 5.230 3.602 2.615 4.754 . 0 0 "[ . 1 . 2]" 1
759 1 32 ARG H 1 32 ARG QB . . 3.700 2.997 2.643 3.425 . 0 0 "[ . 1 . 2]" 1
760 1 32 ARG H 1 32 ARG QG . . 4.010 3.469 2.440 4.054 0.044 17 0 "[ . 1 . 2]" 1
761 1 32 ARG H 1 33 GLY HA3 . . 5.500 4.526 3.805 4.675 . 0 0 "[ . 1 . 2]" 1
762 1 32 ARG H 1 39 GLU H . . 3.860 3.406 2.851 3.893 0.033 11 0 "[ . 1 . 2]" 1
763 1 32 ARG HA 1 32 ARG QD . . 4.620 3.771 3.263 4.503 . 0 0 "[ . 1 . 2]" 1
764 1 32 ARG HA 1 32 ARG QG . . 3.870 2.542 1.971 3.338 . 0 0 "[ . 1 . 2]" 1
765 1 32 ARG QB 1 32 ARG QD . . 2.980 2.033 1.936 2.295 . 0 0 "[ . 1 . 2]" 1
766 1 32 ARG QB 1 33 GLY H . . 4.000 2.415 1.941 3.180 . 0 0 "[ . 1 . 2]" 1
767 1 32 ARG QB 1 41 VAL MG2 . . 5.470 4.460 3.754 5.181 . 0 0 "[ . 1 . 2]" 1
768 1 32 ARG QD 1 41 VAL MG2 . . 4.500 4.339 3.636 4.539 0.039 10 0 "[ . 1 . 2]" 1
769 1 32 ARG QG 1 33 GLY H . . 4.950 3.186 1.768 4.009 . 0 0 "[ . 1 . 2]" 1
770 1 32 ARG QG 1 33 GLY HA2 . . 5.100 4.479 3.270 5.146 0.046 16 0 "[ . 1 . 2]" 1
771 1 33 GLY H 1 34 MET H . . 4.740 4.009 2.083 4.520 . 0 0 "[ . 1 . 2]" 1
772 1 33 GLY HA2 1 34 MET H . . 3.570 2.797 2.412 3.486 . 0 0 "[ . 1 . 2]" 1
773 1 33 GLY HA2 1 34 MET HG3 . . 5.500 5.186 4.423 6.392 0.892 8 2 "[ - . + 1 . 2]" 1
774 1 33 GLY HA3 1 38 ARG HA . . 3.750 3.174 2.365 3.774 0.024 11 0 "[ . 1 . 2]" 1
775 1 33 GLY HA3 1 38 ARG QD . . 5.260 4.870 3.922 5.247 . 0 0 "[ . 1 . 2]" 1
776 1 33 GLY HA3 1 39 GLU H . . 5.040 2.569 1.949 3.051 . 0 0 "[ . 1 . 2]" 1
777 1 34 MET H 1 34 MET HB2 . . 3.940 2.452 2.070 3.554 . 0 0 "[ . 1 . 2]" 1
778 1 34 MET H 1 34 MET HG2 . . 4.390 3.299 2.168 4.134 . 0 0 "[ . 1 . 2]" 1
779 1 34 MET H 1 34 MET HG3 . . 4.440 3.315 2.627 4.156 . 0 0 "[ . 1 . 2]" 1
780 1 34 MET H 1 35 PRO HD2 . . 5.500 4.904 4.854 4.992 . 0 0 "[ . 1 . 2]" 1
781 1 34 MET H 1 35 PRO HD3 . . 5.500 4.627 4.071 4.811 . 0 0 "[ . 1 . 2]" 1
782 1 34 MET H 1 38 ARG HA . . 4.280 3.551 2.358 4.361 0.081 4 0 "[ . 1 . 2]" 1
783 1 34 MET HA 1 35 PRO HD2 . . 3.470 2.817 2.717 2.899 . 0 0 "[ . 1 . 2]" 1
784 1 34 MET HA 1 35 PRO HD3 . . 3.660 2.065 2.007 2.119 . 0 0 "[ . 1 . 2]" 1
785 1 34 MET HA 1 35 PRO HG2 . . 5.500 4.727 4.648 4.793 . 0 0 "[ . 1 . 2]" 1
786 1 34 MET HB3 1 35 PRO HD2 . . 4.690 2.289 1.996 3.664 . 0 0 "[ . 1 . 2]" 1
787 1 34 MET HB3 1 35 PRO HD3 . . 4.170 3.320 3.093 4.080 . 0 0 "[ . 1 . 2]" 1
788 1 34 MET HB3 1 36 ARG H . . 5.190 2.631 1.982 4.657 . 0 0 "[ . 1 . 2]" 1
789 1 34 MET HB3 1 37 ARG H . . 5.500 2.638 2.000 4.610 . 0 0 "[ . 1 . 2]" 1
790 1 34 MET ME 1 35 PRO HD2 . . 5.070 3.655 2.406 4.962 . 0 0 "[ . 1 . 2]" 1
791 1 34 MET ME 1 35 PRO HD3 . . 5.340 4.219 2.226 5.340 . 0 0 "[ . 1 . 2]" 1
792 1 34 MET HG2 1 35 PRO HD3 . . 5.500 3.431 2.412 4.827 . 0 0 "[ . 1 . 2]" 1
793 1 34 MET HG3 1 35 PRO HD3 . . 5.130 4.480 3.304 5.168 0.038 4 0 "[ . 1 . 2]" 1
794 1 35 PRO HA 1 37 ARG H . . 5.500 4.608 4.090 5.293 . 0 0 "[ . 1 . 2]" 1
795 1 35 PRO HA 1 38 ARG QD . . 4.600 3.755 2.514 4.598 . 0 0 "[ . 1 . 2]" 1
796 1 35 PRO HA 1 38 ARG QG . . 4.160 3.173 1.955 4.008 . 0 0 "[ . 1 . 2]" 1
797 1 35 PRO HB2 1 36 ARG QG . . 4.530 4.196 3.423 4.542 0.012 8 0 "[ . 1 . 2]" 1
798 1 35 PRO HB3 1 36 ARG H . . 4.420 4.249 3.968 4.601 0.181 11 0 "[ . 1 . 2]" 1
799 1 35 PRO HD2 1 36 ARG H . . 5.500 2.295 2.253 2.683 . 0 0 "[ . 1 . 2]" 1
800 1 35 PRO HD3 1 36 ARG H . . 5.240 3.682 3.655 3.816 . 0 0 "[ . 1 . 2]" 1
801 1 35 PRO HG2 1 36 ARG QG . . 5.500 3.798 3.234 4.915 . 0 0 "[ . 1 . 2]" 1
802 1 35 PRO HG3 1 36 ARG H . . 4.730 4.132 3.825 4.734 0.004 11 0 "[ . 1 . 2]" 1
803 1 36 ARG H 1 36 ARG HB2 . . 4.060 2.433 2.038 3.611 . 0 0 "[ . 1 . 2]" 1
804 1 36 ARG H 1 36 ARG QD . . 5.500 3.895 2.286 4.702 . 0 0 "[ . 1 . 2]" 1
805 1 36 ARG H 1 36 ARG QG . . 4.320 2.834 1.911 3.802 . 0 0 "[ . 1 . 2]" 1
806 1 36 ARG H 1 37 ARG H . . 3.860 2.553 2.077 3.090 . 0 0 "[ . 1 . 2]" 1
807 1 36 ARG HA 1 36 ARG QD . . 4.400 3.576 2.560 4.396 . 0 0 "[ . 1 . 2]" 1
808 1 36 ARG HA 1 36 ARG QG . . 3.580 2.354 2.054 3.335 . 0 0 "[ . 1 . 2]" 1
809 1 36 ARG HA 1 38 ARG H . . 5.310 5.065 4.493 5.320 0.010 15 0 "[ . 1 . 2]" 1
810 1 36 ARG HB2 1 36 ARG QD . . 3.300 2.599 1.989 3.465 0.165 3 0 "[ . 1 . 2]" 1
811 1 36 ARG QG 1 37 ARG H . . 5.500 3.991 1.891 4.567 . 0 0 "[ . 1 . 2]" 1
812 1 37 ARG H 1 37 ARG HB2 . . 3.910 2.520 2.021 3.604 . 0 0 "[ . 1 . 2]" 1
813 1 37 ARG H 1 37 ARG HB3 . . 3.880 3.488 2.857 3.787 . 0 0 "[ . 1 . 2]" 1
814 1 37 ARG H 1 37 ARG QD . . 5.500 4.251 2.782 5.110 . 0 0 "[ . 1 . 2]" 1
815 1 37 ARG H 1 37 ARG QG . . 3.910 3.492 1.891 3.922 0.012 8 0 "[ . 1 . 2]" 1
816 1 37 ARG H 1 38 ARG H . . 3.650 3.149 2.184 3.648 . 0 0 "[ . 1 . 2]" 1
817 1 37 ARG HA 1 37 ARG QD . . 5.120 3.442 2.172 4.191 . 0 0 "[ . 1 . 2]" 1
818 1 37 ARG HA 1 37 ARG QG . . 3.500 2.230 1.972 3.340 . 0 0 "[ . 1 . 2]" 1
819 1 37 ARG HB2 1 38 ARG H . . 5.240 4.115 2.569 4.702 . 0 0 "[ . 1 . 2]" 1
820 1 37 ARG HB3 1 37 ARG QG . . 2.790 2.370 2.187 2.571 . 0 0 "[ . 1 . 2]" 1
821 1 37 ARG HB3 1 38 ARG H . . 4.250 3.781 2.326 4.275 0.025 8 0 "[ . 1 . 2]" 1
822 1 38 ARG H 1 38 ARG HB2 . . 3.850 2.637 2.023 3.670 . 0 0 "[ . 1 . 2]" 1
823 1 38 ARG H 1 38 ARG QD . . 5.010 4.039 3.650 4.628 . 0 0 "[ . 1 . 2]" 1
824 1 38 ARG H 1 38 ARG QG . . 3.850 2.897 1.948 3.710 . 0 0 "[ . 1 . 2]" 1
825 1 38 ARG HA 1 38 ARG QD . . 4.120 3.029 2.107 3.977 . 0 0 "[ . 1 . 2]" 1
826 1 38 ARG HA 1 38 ARG QG . . 3.870 2.312 2.023 2.662 . 0 0 "[ . 1 . 2]" 1
827 1 38 ARG HA 1 39 GLU H . . 3.260 2.433 2.227 2.714 . 0 0 "[ . 1 . 2]" 1
828 1 38 ARG HB2 1 40 PHE QE . . 4.450 3.260 2.344 4.188 . 0 0 "[ . 1 . 2]" 1
829 1 38 ARG HB3 1 39 GLU H . . 4.020 2.999 2.249 4.014 . 0 0 "[ . 1 . 2]" 1
830 1 38 ARG HB3 1 40 PHE QD . . 4.790 3.458 2.862 4.332 . 0 0 "[ . 1 . 2]" 1
831 1 38 ARG HB3 1 40 PHE QE . . 4.700 2.602 2.013 3.811 . 0 0 "[ . 1 . 2]" 1
832 1 38 ARG HB3 1 40 PHE HZ . . 5.290 4.510 4.005 5.609 0.319 15 0 "[ . 1 . 2]" 1
833 1 38 ARG QD 1 39 GLU H . . 5.500 3.645 2.465 4.740 . 0 0 "[ . 1 . 2]" 1
834 1 38 ARG QD 1 40 PHE QE . . 4.540 3.566 2.441 4.529 . 0 0 "[ . 1 . 2]" 1
835 1 38 ARG QG 1 40 PHE QE . . 4.690 4.021 3.494 4.704 0.014 12 0 "[ . 1 . 2]" 1
836 1 39 GLU H 1 39 GLU HG2 . . 5.300 4.642 4.240 4.991 . 0 0 "[ . 1 . 2]" 1
837 1 39 GLU H 1 39 GLU HG3 . . 5.060 4.599 4.415 5.117 0.057 9 0 "[ . 1 . 2]" 1
838 1 39 GLU H 1 56 PRO HA . . 5.500 5.243 4.875 5.498 . 0 0 "[ . 1 . 2]" 1
839 1 39 GLU HA 1 40 PHE H . . 3.520 2.244 2.202 2.331 . 0 0 "[ . 1 . 2]" 1
840 1 39 GLU HA 1 40 PHE HB3 . . 5.500 5.575 5.523 5.624 0.124 19 0 "[ . 1 . 2]" 1
841 1 39 GLU HA 1 40 PHE QD . . 4.820 3.239 2.766 3.928 . 0 0 "[ . 1 . 2]" 1
842 1 39 GLU HA 1 56 PRO HA . . 4.290 3.241 2.786 3.629 . 0 0 "[ . 1 . 2]" 1
843 1 39 GLU QB 1 39 GLU HG3 . . 2.660 2.470 2.180 2.571 . 0 0 "[ . 1 . 2]" 1
844 1 39 GLU QB 1 40 PHE H . . 4.740 3.754 3.562 3.938 . 0 0 "[ . 1 . 2]" 1
845 1 39 GLU QB 1 41 VAL MG2 . . 4.920 4.110 3.583 4.666 . 0 0 "[ . 1 . 2]" 1
846 1 39 GLU QB 1 54 THR HB . . 4.780 4.491 4.021 4.799 0.019 13 0 "[ . 1 . 2]" 1
847 1 39 GLU QB 1 55 GLY H . . 5.500 4.751 4.380 5.199 . 0 0 "[ . 1 . 2]" 1
848 1 39 GLU HG2 1 40 PHE H . . 5.040 3.498 1.948 4.537 . 0 0 "[ . 1 . 2]" 1
849 1 39 GLU HG2 1 41 VAL MG2 . . 4.960 3.530 2.881 4.360 . 0 0 "[ . 1 . 2]" 1
850 1 39 GLU HG2 1 54 THR HB . . 4.310 2.891 2.135 3.429 . 0 0 "[ . 1 . 2]" 1
851 1 39 GLU HG2 1 54 THR MG . . 4.580 3.498 2.989 4.256 . 0 0 "[ . 1 . 2]" 1
852 1 39 GLU HG2 1 55 GLY H . . 5.130 3.795 2.181 4.485 . 0 0 "[ . 1 . 2]" 1
853 1 39 GLU HG3 1 40 PHE H . . 4.990 2.874 2.113 3.886 . 0 0 "[ . 1 . 2]" 1
854 1 39 GLU HG3 1 41 VAL MG2 . . 4.940 4.383 3.957 4.776 . 0 0 "[ . 1 . 2]" 1
855 1 39 GLU HG3 1 54 THR HB . . 4.360 2.730 2.329 3.164 . 0 0 "[ . 1 . 2]" 1
856 1 39 GLU HG3 1 54 THR MG . . 4.650 3.952 3.411 4.412 . 0 0 "[ . 1 . 2]" 1
857 1 39 GLU HG3 1 55 GLY H . . 5.130 2.867 2.155 4.224 . 0 0 "[ . 1 . 2]" 1
858 1 40 PHE H 1 40 PHE HB2 . . 4.060 2.260 2.114 2.406 . 0 0 "[ . 1 . 2]" 1
859 1 40 PHE H 1 40 PHE QD . . 4.330 2.640 2.157 3.296 . 0 0 "[ . 1 . 2]" 1
860 1 40 PHE H 1 40 PHE QE . . 5.500 4.953 4.558 5.422 . 0 0 "[ . 1 . 2]" 1
861 1 40 PHE H 1 41 VAL MG2 . . 5.500 4.530 4.411 4.635 . 0 0 "[ . 1 . 2]" 1
862 1 40 PHE H 1 54 THR HA . . 5.380 4.073 3.838 4.506 . 0 0 "[ . 1 . 2]" 1
863 1 40 PHE H 1 54 THR HB . . 5.500 4.363 3.722 4.871 . 0 0 "[ . 1 . 2]" 1
864 1 40 PHE H 1 54 THR MG . . 5.500 4.888 4.271 5.202 . 0 0 "[ . 1 . 2]" 1
865 1 40 PHE H 1 55 GLY H . . 4.340 2.579 2.406 2.903 . 0 0 "[ . 1 . 2]" 1
866 1 40 PHE H 1 56 PRO HA . . 5.500 4.310 4.018 4.677 . 0 0 "[ . 1 . 2]" 1
867 1 40 PHE H 1 57 ASN H . . 5.500 4.499 4.163 5.026 . 0 0 "[ . 1 . 2]" 1
868 1 40 PHE H 1 61 ALA MB . . 5.350 3.398 3.101 3.703 . 0 0 "[ . 1 . 2]" 1
869 1 40 PHE HA 1 41 VAL H . . 3.340 2.227 2.194 2.413 . 0 0 "[ . 1 . 2]" 1
870 1 40 PHE HB2 1 41 VAL H . . 4.560 4.371 3.950 4.484 . 0 0 "[ . 1 . 2]" 1
871 1 40 PHE HB2 1 55 GLY H . . 5.500 3.581 3.348 3.871 . 0 0 "[ . 1 . 2]" 1
872 1 40 PHE HB2 1 57 ASN H . . 5.130 4.038 3.680 4.376 . 0 0 "[ . 1 . 2]" 1
873 1 40 PHE HB2 1 58 LYS HA . . 4.420 2.720 2.513 2.979 . 0 0 "[ . 1 . 2]" 1
874 1 40 PHE HB2 1 58 LYS HG2 . . 5.500 5.185 4.457 5.515 0.015 12 0 "[ . 1 . 2]" 1
875 1 40 PHE HB2 1 61 ALA H . . 5.500 4.034 3.823 4.272 . 0 0 "[ . 1 . 2]" 1
876 1 40 PHE HB2 1 61 ALA MB . . 3.770 2.332 2.132 2.489 . 0 0 "[ . 1 . 2]" 1
877 1 40 PHE HB3 1 41 VAL H . . 4.340 3.394 2.689 3.594 . 0 0 "[ . 1 . 2]" 1
878 1 40 PHE HB3 1 58 LYS HA . . 4.140 2.396 2.146 2.894 . 0 0 "[ . 1 . 2]" 1
879 1 40 PHE HB3 1 58 LYS HG2 . . 5.420 4.201 3.072 4.832 . 0 0 "[ . 1 . 2]" 1
880 1 40 PHE HB3 1 61 ALA H . . 5.500 4.912 4.538 5.326 . 0 0 "[ . 1 . 2]" 1
881 1 40 PHE HB3 1 61 ALA MB . . 3.530 2.699 2.380 2.964 . 0 0 "[ . 1 . 2]" 1
882 1 40 PHE QD 1 41 VAL H . . 5.500 4.250 3.669 4.617 . 0 0 "[ . 1 . 2]" 1
883 1 40 PHE QD 1 41 VAL MG2 . . 5.500 5.374 5.082 5.511 0.011 19 0 "[ . 1 . 2]" 1
884 1 40 PHE QD 1 55 GLY H . . 5.500 4.767 4.368 5.198 . 0 0 "[ . 1 . 2]" 1
885 1 40 PHE QD 1 56 PRO HA . . 5.500 4.109 3.639 4.509 . 0 0 "[ . 1 . 2]" 1
886 1 40 PHE QD 1 57 ASN H . . 4.780 4.167 3.737 4.518 . 0 0 "[ . 1 . 2]" 1
887 1 40 PHE QD 1 57 ASN HA . . 4.220 2.686 2.027 3.172 . 0 0 "[ . 1 . 2]" 1
888 1 40 PHE QD 1 58 LYS HA . . 4.840 3.334 2.778 3.854 . 0 0 "[ . 1 . 2]" 1
889 1 40 PHE QD 1 58 LYS QE . . 5.500 3.829 3.271 4.335 . 0 0 "[ . 1 . 2]" 1
890 1 40 PHE QD 1 58 LYS HG2 . . 5.080 4.272 3.263 5.081 0.001 13 0 "[ . 1 . 2]" 1
891 1 40 PHE QD 1 58 LYS HG3 . . 5.070 3.091 2.101 3.865 . 0 0 "[ . 1 . 2]" 1
892 1 40 PHE QD 1 61 ALA H . . 5.500 5.485 5.296 5.550 0.050 2 0 "[ . 1 . 2]" 1
893 1 40 PHE QD 1 61 ALA MB . . 5.260 3.917 3.786 4.034 . 0 0 "[ . 1 . 2]" 1
894 1 40 PHE QE 1 57 ASN HA . . 3.380 3.190 2.817 3.389 0.009 14 0 "[ . 1 . 2]" 1
895 1 40 PHE QE 1 58 LYS HB3 . . 5.500 4.837 4.100 5.878 0.378 11 0 "[ . 1 . 2]" 1
896 1 40 PHE QE 1 58 LYS QE . . 4.540 4.240 3.701 4.548 0.008 18 0 "[ . 1 . 2]" 1
897 1 40 PHE QE 1 58 LYS HG3 . . 5.500 4.763 3.730 5.507 0.007 17 0 "[ . 1 . 2]" 1
898 1 40 PHE HZ 1 57 ASN HA . . 5.500 4.547 3.716 5.436 . 0 0 "[ . 1 . 2]" 1
899 1 41 VAL H 1 41 VAL HB . . 4.000 2.539 2.455 2.675 . 0 0 "[ . 1 . 2]" 1
900 1 41 VAL H 1 41 VAL MG1 . . 4.670 3.773 3.747 3.865 . 0 0 "[ . 1 . 2]" 1
901 1 41 VAL H 1 41 VAL MG2 . . 3.510 2.346 2.121 2.770 . 0 0 "[ . 1 . 2]" 1
902 1 41 VAL H 1 42 MET H . . 5.500 4.474 4.267 4.541 . 0 0 "[ . 1 . 2]" 1
903 1 41 VAL H 1 61 ALA MB . . 5.500 4.303 3.799 4.439 . 0 0 "[ . 1 . 2]" 1
904 1 41 VAL HA 1 41 VAL MG1 . . 3.150 2.344 2.206 2.426 . 0 0 "[ . 1 . 2]" 1
905 1 41 VAL HA 1 41 VAL MG2 . . 3.090 2.411 2.369 2.495 . 0 0 "[ . 1 . 2]" 1
906 1 41 VAL HA 1 42 MET H . . 3.380 2.195 2.182 2.235 . 0 0 "[ . 1 . 2]" 1
907 1 41 VAL HA 1 42 MET HB2 . . 5.270 4.115 4.004 4.239 . 0 0 "[ . 1 . 2]" 1
908 1 41 VAL HA 1 53 GLY H . . 5.470 4.387 4.253 4.466 . 0 0 "[ . 1 . 2]" 1
909 1 41 VAL HA 1 54 THR HA . . 3.310 3.084 2.857 3.226 . 0 0 "[ . 1 . 2]" 1
910 1 41 VAL HA 1 54 THR MG . . 3.280 2.372 1.935 2.746 . 0 0 "[ . 1 . 2]" 1
911 1 41 VAL HA 1 55 GLY H . . 5.140 4.709 4.526 4.874 . 0 0 "[ . 1 . 2]" 1
912 1 41 VAL HA 1 61 ALA MB . . 4.380 3.485 3.182 3.690 . 0 0 "[ . 1 . 2]" 1
913 1 41 VAL HB 1 42 MET H . . 4.970 4.209 4.028 4.306 . 0 0 "[ . 1 . 2]" 1
914 1 41 VAL HB 1 42 MET HA . . 4.730 4.684 4.579 4.762 0.032 20 0 "[ . 1 . 2]" 1
915 1 41 VAL MG1 1 42 MET H . . 3.610 2.608 2.250 2.830 . 0 0 "[ . 1 . 2]" 1
916 1 41 VAL MG1 1 42 MET HA . . 5.390 3.880 3.677 4.103 . 0 0 "[ . 1 . 2]" 1
917 1 41 VAL MG1 1 42 MET HB3 . . 5.500 5.060 4.898 5.181 . 0 0 "[ . 1 . 2]" 1
918 1 41 VAL MG1 1 52 THR HA . . 5.000 4.645 4.348 4.871 . 0 0 "[ . 1 . 2]" 1
919 1 41 VAL MG1 1 52 THR HB . . 3.420 3.352 3.117 3.445 0.025 9 0 "[ . 1 . 2]" 1
920 1 41 VAL MG1 1 52 THR MG . . 4.030 3.383 3.169 3.544 . 0 0 "[ . 1 . 2]" 1
921 1 41 VAL MG1 1 53 GLY H . . 4.470 3.753 3.538 3.960 . 0 0 "[ . 1 . 2]" 1
922 1 41 VAL MG1 1 54 THR HA . . 5.170 4.586 4.290 4.770 . 0 0 "[ . 1 . 2]" 1
923 1 41 VAL MG1 1 61 ALA MB . . 5.100 4.748 4.523 4.898 . 0 0 "[ . 1 . 2]" 1
924 1 41 VAL MG2 1 42 MET H . . 4.790 4.216 4.123 4.293 . 0 0 "[ . 1 . 2]" 1
925 1 41 VAL MG2 1 42 MET HA . . 5.500 5.533 5.503 5.556 0.056 20 0 "[ . 1 . 2]" 1
926 1 41 VAL MG2 1 54 THR HA . . 4.320 4.300 3.903 4.373 0.053 12 0 "[ . 1 . 2]" 1
927 1 41 VAL MG2 1 54 THR HB . . 4.220 4.032 3.400 4.238 0.018 19 0 "[ . 1 . 2]" 1
928 1 41 VAL MG2 1 54 THR MG . . 3.120 2.635 2.133 3.040 . 0 0 "[ . 1 . 2]" 1
929 1 41 VAL MG2 1 55 GLY H . . 5.500 5.056 4.649 5.152 . 0 0 "[ . 1 . 2]" 1
930 1 42 MET H 1 42 MET HB3 . . 4.090 3.060 2.814 3.285 . 0 0 "[ . 1 . 2]" 1
931 1 42 MET H 1 52 THR HA . . 5.500 4.507 4.412 4.626 . 0 0 "[ . 1 . 2]" 1
932 1 42 MET H 1 52 THR HB . . 5.090 4.246 4.107 4.455 . 0 0 "[ . 1 . 2]" 1
933 1 42 MET H 1 52 THR MG . . 4.700 4.616 4.495 4.716 0.016 20 0 "[ . 1 . 2]" 1
934 1 42 MET H 1 53 GLY H . . 4.470 2.607 2.527 2.704 . 0 0 "[ . 1 . 2]" 1
935 1 42 MET H 1 53 GLY HA3 . . 5.500 4.162 4.034 4.306 . 0 0 "[ . 1 . 2]" 1
936 1 42 MET H 1 54 THR HA . . 4.520 3.569 3.391 3.727 . 0 0 "[ . 1 . 2]" 1
937 1 42 MET H 1 54 THR MG . . 4.680 3.038 2.724 3.365 . 0 0 "[ . 1 . 2]" 1
938 1 42 MET H 1 61 ALA MB . . 4.150 3.153 2.793 3.478 . 0 0 "[ . 1 . 2]" 1
939 1 42 MET H 1 65 ALA MB . . 4.440 4.170 3.906 4.355 . 0 0 "[ . 1 . 2]" 1
940 1 42 MET HA 1 42 MET ME . . 3.850 3.809 3.658 3.891 0.041 18 0 "[ . 1 . 2]" 1
941 1 42 MET HA 1 43 GLN H . . 3.240 2.323 2.229 2.371 . 0 0 "[ . 1 . 2]" 1
942 1 42 MET HA 1 61 ALA MB . . 5.500 4.039 3.853 4.180 . 0 0 "[ . 1 . 2]" 1
943 1 42 MET HB2 1 43 GLN H . . 4.710 4.330 4.223 4.470 . 0 0 "[ . 1 . 2]" 1
944 1 42 MET HB2 1 53 GLY H . . 5.500 3.862 3.517 4.449 . 0 0 "[ . 1 . 2]" 1
945 1 42 MET HB2 1 61 ALA MB . . 3.930 1.980 1.818 2.148 . 0 0 "[ . 1 . 2]" 1
946 1 42 MET HB2 1 62 LYS HA . . 4.010 3.223 2.777 3.485 . 0 0 "[ . 1 . 2]" 1
947 1 42 MET HB2 1 65 ALA H . . 5.500 4.695 4.178 5.060 . 0 0 "[ . 1 . 2]" 1
948 1 42 MET HB2 1 65 ALA MB . . 3.940 3.388 3.124 3.800 . 0 0 "[ . 1 . 2]" 1
949 1 42 MET HB3 1 43 GLN H . . 4.650 3.485 3.211 3.979 . 0 0 "[ . 1 . 2]" 1
950 1 42 MET HB3 1 53 GLY H . . 5.220 3.173 2.827 3.574 . 0 0 "[ . 1 . 2]" 1
951 1 42 MET HB3 1 61 ALA HA . . 5.500 4.687 4.173 5.087 . 0 0 "[ . 1 . 2]" 1
952 1 42 MET HB3 1 61 ALA MB . . 3.800 3.362 2.935 3.627 . 0 0 "[ . 1 . 2]" 1
953 1 42 MET HB3 1 62 LYS HA . . 4.460 2.522 2.232 2.677 . 0 0 "[ . 1 . 2]" 1
954 1 42 MET HB3 1 65 ALA MB . . 3.710 2.056 1.956 2.270 . 0 0 "[ . 1 . 2]" 1
955 1 42 MET ME 1 43 GLN H . . 5.320 3.860 3.654 4.254 . 0 0 "[ . 1 . 2]" 1
956 1 42 MET ME 1 58 LYS HA . . 4.820 4.646 4.118 4.850 0.030 14 0 "[ . 1 . 2]" 1
957 1 42 MET ME 1 58 LYS HG2 . . 3.120 2.700 2.028 3.048 . 0 0 "[ . 1 . 2]" 1
958 1 42 MET ME 1 58 LYS HG3 . . 5.050 3.283 2.233 4.414 . 0 0 "[ . 1 . 2]" 1
959 1 42 MET ME 1 59 LYS HA . . 5.500 5.103 4.761 5.418 . 0 0 "[ . 1 . 2]" 1
960 1 42 MET ME 1 62 LYS H . . 4.660 4.376 3.850 4.676 0.016 10 0 "[ . 1 . 2]" 1
961 1 42 MET ME 1 62 LYS HA . . 4.110 3.767 3.609 3.932 . 0 0 "[ . 1 . 2]" 1
962 1 42 MET ME 1 62 LYS QB . . 3.100 2.710 2.259 2.984 . 0 0 "[ . 1 . 2]" 1
963 1 42 MET ME 1 62 LYS QG . . 3.040 2.392 1.944 3.013 . 0 0 "[ . 1 . 2]" 1
964 1 42 MET QG 1 43 GLN H . . 4.380 3.080 2.232 3.591 . 0 0 "[ . 1 . 2]" 1
965 1 42 MET QG 1 58 LYS HA . . 4.910 4.140 3.549 4.759 . 0 0 "[ . 1 . 2]" 1
966 1 42 MET QG 1 61 ALA MB . . 3.470 2.912 2.414 3.252 . 0 0 "[ . 1 . 2]" 1
967 1 42 MET QG 1 62 LYS H . . 4.630 3.014 2.920 3.134 . 0 0 "[ . 1 . 2]" 1
968 1 42 MET QG 1 62 LYS HA . . 3.750 2.189 1.951 2.561 . 0 0 "[ . 1 . 2]" 1
969 1 42 MET QG 1 62 LYS QB . . 3.140 2.236 2.009 2.447 . 0 0 "[ . 1 . 2]" 1
970 1 42 MET QG 1 62 LYS QG . . 4.780 2.919 2.381 3.230 . 0 0 "[ . 1 . 2]" 1
971 1 42 MET QG 1 65 ALA MB . . 5.500 3.320 2.800 3.802 . 0 0 "[ . 1 . 2]" 1
972 1 43 GLN H 1 43 GLN HB2 . . 3.990 2.803 2.584 2.896 . 0 0 "[ . 1 . 2]" 1
973 1 43 GLN H 1 43 GLN HB3 . . 3.900 2.837 2.742 2.885 . 0 0 "[ . 1 . 2]" 1
974 1 43 GLN H 1 43 GLN HG3 . . 4.430 4.553 4.490 4.583 0.153 13 0 "[ . 1 . 2]" 1
975 1 43 GLN H 1 44 VAL H . . 5.500 4.498 4.471 4.569 . 0 0 "[ . 1 . 2]" 1
976 1 43 GLN H 1 44 VAL HA . . 5.500 4.895 4.840 5.084 . 0 0 "[ . 1 . 2]" 1
977 1 43 GLN H 1 52 THR MG . . 5.500 4.455 4.178 4.738 . 0 0 "[ . 1 . 2]" 1
978 1 43 GLN H 1 65 ALA MB . . 5.500 4.011 3.852 4.156 . 0 0 "[ . 1 . 2]" 1
979 1 43 GLN HA 1 43 GLN HG3 . . 3.180 2.328 2.265 2.881 . 0 0 "[ . 1 . 2]" 1
980 1 43 GLN HA 1 44 VAL H . . 2.950 2.396 2.362 2.441 . 0 0 "[ . 1 . 2]" 1
981 1 43 GLN HA 1 44 VAL MG1 . . 4.660 3.718 3.598 3.903 . 0 0 "[ . 1 . 2]" 1
982 1 43 GLN HA 1 51 ALA H . . 4.970 4.456 4.418 4.519 . 0 0 "[ . 1 . 2]" 1
983 1 43 GLN HA 1 51 ALA MB . . 5.500 4.802 4.730 4.906 . 0 0 "[ . 1 . 2]" 1
984 1 43 GLN HA 1 52 THR HA . . 3.220 2.129 1.992 2.210 . 0 0 "[ . 1 . 2]" 1
985 1 43 GLN HA 1 52 THR HB . . 4.500 4.069 3.867 4.261 . 0 0 "[ . 1 . 2]" 1
986 1 43 GLN HA 1 52 THR MG . . 3.370 2.382 2.090 2.625 . 0 0 "[ . 1 . 2]" 1
987 1 43 GLN HA 1 53 GLY H . . 5.150 3.648 3.543 3.709 . 0 0 "[ . 1 . 2]" 1
988 1 43 GLN HA 1 65 ALA MB . . 4.280 3.309 3.113 3.515 . 0 0 "[ . 1 . 2]" 1
989 1 43 GLN HB2 1 43 GLN HE22 . . 5.500 3.939 3.825 4.387 . 0 0 "[ . 1 . 2]" 1
990 1 43 GLN HB2 1 43 GLN HG3 . . 2.770 2.551 2.302 2.599 . 0 0 "[ . 1 . 2]" 1
991 1 43 GLN HB2 1 44 VAL H . . 4.490 4.147 4.080 4.207 . 0 0 "[ . 1 . 2]" 1
992 1 43 GLN HB2 1 52 THR HA . . 5.150 4.433 4.327 4.532 . 0 0 "[ . 1 . 2]" 1
993 1 43 GLN HB2 1 52 THR MG . . 3.750 2.993 2.719 3.337 . 0 0 "[ . 1 . 2]" 1
994 1 43 GLN HB3 1 43 GLN HE21 . . 4.720 2.250 2.010 3.687 . 0 0 "[ . 1 . 2]" 1
995 1 43 GLN HB3 1 43 GLN HE22 . . 4.840 3.637 3.505 4.070 . 0 0 "[ . 1 . 2]" 1
996 1 43 GLN HB3 1 44 VAL H . . 4.400 3.580 3.504 3.627 . 0 0 "[ . 1 . 2]" 1
997 1 43 GLN HB3 1 52 THR MG . . 4.540 4.074 3.855 4.395 . 0 0 "[ . 1 . 2]" 1
998 1 43 GLN HE21 1 44 VAL H . . 5.500 4.585 4.475 5.207 . 0 0 "[ . 1 . 2]" 1
999 1 43 GLN HE21 1 45 LYS HB2 . . 5.460 4.484 4.157 6.393 0.933 18 1 "[ . 1 . + 2]" 1
1000 1 43 GLN HE21 1 45 LYS HG3 . . 5.500 5.448 5.226 6.225 0.725 18 1 "[ . 1 . + 2]" 1
1001 1 43 GLN HE21 1 50 VAL MG1 . . 5.320 5.124 3.809 5.300 . 0 0 "[ . 1 . 2]" 1
1002 1 43 GLN HE21 1 50 VAL MG2 . . 4.110 3.580 3.409 3.724 . 0 0 "[ . 1 . 2]" 1
1003 1 43 GLN HE21 1 52 THR MG . . 5.130 4.721 3.528 5.119 . 0 0 "[ . 1 . 2]" 1
1004 1 43 GLN HE22 1 50 VAL MG1 . . 5.500 5.036 3.809 5.234 . 0 0 "[ . 1 . 2]" 1
1005 1 43 GLN HE22 1 50 VAL MG2 . . 4.080 3.873 2.953 4.027 . 0 0 "[ . 1 . 2]" 1
1006 1 43 GLN HE22 1 52 THR MG . . 5.500 5.007 4.777 5.385 . 0 0 "[ . 1 . 2]" 1
1007 1 43 GLN HG2 1 44 VAL H . . 3.790 2.203 1.845 2.301 . 0 0 "[ . 1 . 2]" 1
1008 1 43 GLN HG2 1 44 VAL HA . . 5.350 4.145 4.063 4.300 . 0 0 "[ . 1 . 2]" 1
1009 1 43 GLN HG2 1 44 VAL MG1 . . 3.960 3.984 3.750 4.013 0.053 16 0 "[ . 1 . 2]" 1
1010 1 43 GLN HG2 1 45 LYS HG3 . . 5.500 5.035 4.850 5.512 0.012 18 0 "[ . 1 . 2]" 1
1011 1 43 GLN HG2 1 50 VAL HA . . 5.280 4.731 4.595 4.795 . 0 0 "[ . 1 . 2]" 1
1012 1 43 GLN HG2 1 50 VAL MG2 . . 2.920 2.364 2.252 2.430 . 0 0 "[ . 1 . 2]" 1
1013 1 43 GLN HG2 1 51 ALA H . . 4.580 3.476 3.061 3.548 . 0 0 "[ . 1 . 2]" 1
1014 1 43 GLN HG3 1 44 VAL H . . 3.930 2.841 2.624 3.523 . 0 0 "[ . 1 . 2]" 1
1015 1 43 GLN HG3 1 50 VAL MG1 . . 3.740 3.740 3.702 3.772 0.032 19 0 "[ . 1 . 2]" 1
1016 1 43 GLN HG3 1 50 VAL MG2 . . 3.200 3.219 3.203 3.235 0.035 4 0 "[ . 1 . 2]" 1
1017 1 43 GLN HG3 1 51 ALA MB . . 5.500 5.185 5.009 5.675 0.175 18 0 "[ . 1 . 2]" 1
1018 1 43 GLN HG3 1 52 THR HA . . 4.820 3.457 3.346 3.984 . 0 0 "[ . 1 . 2]" 1
1019 1 43 GLN HG3 1 52 THR MG . . 3.270 1.940 1.791 2.146 . 0 0 "[ . 1 . 2]" 1
1020 1 44 VAL H 1 44 VAL HB . . 4.140 3.194 3.128 3.233 . 0 0 "[ . 1 . 2]" 1
1021 1 44 VAL H 1 44 VAL MG1 . . 3.150 2.114 1.998 2.271 . 0 0 "[ . 1 . 2]" 1
1022 1 44 VAL H 1 44 VAL MG2 . . 4.340 3.925 3.889 3.962 . 0 0 "[ . 1 . 2]" 1
1023 1 44 VAL H 1 45 LYS H . . 4.800 4.261 4.216 4.292 . 0 0 "[ . 1 . 2]" 1
1024 1 44 VAL H 1 50 VAL MG2 . . 4.080 3.223 3.110 3.374 . 0 0 "[ . 1 . 2]" 1
1025 1 44 VAL H 1 51 ALA H . . 4.200 2.485 2.455 2.516 . 0 0 "[ . 1 . 2]" 1
1026 1 44 VAL H 1 51 ALA MB . . 4.620 3.758 3.706 3.843 . 0 0 "[ . 1 . 2]" 1
1027 1 44 VAL H 1 52 THR HA . . 4.770 3.447 3.384 3.531 . 0 0 "[ . 1 . 2]" 1
1028 1 44 VAL H 1 52 THR MG . . 5.500 3.560 3.296 3.790 . 0 0 "[ . 1 . 2]" 1
1029 1 44 VAL H 1 65 ALA MB . . 4.120 3.661 3.442 3.826 . 0 0 "[ . 1 . 2]" 1
1030 1 44 VAL H 1 69 MET ME . . 4.650 4.635 4.510 4.696 0.046 19 0 "[ . 1 . 2]" 1
1031 1 44 VAL HA 1 44 VAL MG1 . . 3.740 3.207 3.202 3.211 . 0 0 "[ . 1 . 2]" 1
1032 1 44 VAL HA 1 44 VAL MG2 . . 3.200 2.284 2.209 2.376 . 0 0 "[ . 1 . 2]" 1
1033 1 44 VAL HA 1 45 LYS H . . 3.150 2.209 2.193 2.220 . 0 0 "[ . 1 . 2]" 1
1034 1 44 VAL HA 1 46 VAL MG2 . . 5.230 4.880 4.731 4.992 . 0 0 "[ . 1 . 2]" 1
1035 1 44 VAL HA 1 65 ALA MB . . 5.080 4.125 3.890 4.319 . 0 0 "[ . 1 . 2]" 1
1036 1 44 VAL HA 1 69 MET ME . . 5.080 4.868 4.778 5.009 . 0 0 "[ . 1 . 2]" 1
1037 1 44 VAL HB 1 45 LYS H . . 4.750 4.292 4.233 4.381 . 0 0 "[ . 1 . 2]" 1
1038 1 44 VAL HB 1 51 ALA H . . 4.540 4.587 4.556 4.628 0.088 14 0 "[ . 1 . 2]" 1
1039 1 44 VAL HB 1 66 ALA HA . . 5.500 4.123 3.958 4.352 . 0 0 "[ . 1 . 2]" 1
1040 1 44 VAL MG1 1 45 LYS H . . 5.050 4.011 3.937 4.101 . 0 0 "[ . 1 . 2]" 1
1041 1 44 VAL MG1 1 50 VAL HA . . 4.630 3.515 3.440 3.609 . 0 0 "[ . 1 . 2]" 1
1042 1 44 VAL MG1 1 51 ALA H . . 3.750 2.009 1.938 2.109 . 0 0 "[ . 1 . 2]" 1
1043 1 44 VAL MG1 1 51 ALA MB . . 3.120 1.749 1.678 1.818 . 0 0 "[ . 1 . 2]" 1
1044 1 44 VAL MG1 1 52 THR H . . 5.500 3.681 3.500 4.065 . 0 0 "[ . 1 . 2]" 1
1045 1 44 VAL MG1 1 52 THR HA . . 5.500 3.594 3.433 3.881 . 0 0 "[ . 1 . 2]" 1
1046 1 44 VAL MG1 1 65 ALA H . . 5.500 5.016 4.892 5.076 . 0 0 "[ . 1 . 2]" 1
1047 1 44 VAL MG1 1 65 ALA HA . . 4.780 3.338 3.182 3.447 . 0 0 "[ . 1 . 2]" 1
1048 1 44 VAL MG1 1 65 ALA MB . . 2.570 2.553 2.401 2.588 0.018 16 0 "[ . 1 . 2]" 1
1049 1 44 VAL MG1 1 66 ALA HA . . 3.430 3.102 2.795 3.204 . 0 0 "[ . 1 . 2]" 1
1050 1 44 VAL MG1 1 68 ALA MB . . 5.090 3.736 3.491 4.031 . 0 0 "[ . 1 . 2]" 1
1051 1 44 VAL MG1 1 69 MET H . . 3.540 3.281 3.090 3.459 . 0 0 "[ . 1 . 2]" 1
1052 1 44 VAL MG1 1 69 MET HA . . 5.070 3.735 3.643 3.851 . 0 0 "[ . 1 . 2]" 1
1053 1 44 VAL MG1 1 69 MET HB2 . . 3.090 1.949 1.908 2.039 . 0 0 "[ . 1 . 2]" 1
1054 1 44 VAL MG1 1 69 MET HB3 . . 3.800 3.105 2.840 3.278 . 0 0 "[ . 1 . 2]" 1
1055 1 44 VAL MG1 1 69 MET ME . . 2.760 2.286 2.185 2.424 . 0 0 "[ . 1 . 2]" 1
1056 1 44 VAL MG1 1 69 MET HG2 . . 4.040 3.244 2.991 4.084 0.044 16 0 "[ . 1 . 2]" 1
1057 1 44 VAL MG1 1 69 MET HG3 . . 4.350 4.284 4.144 4.363 0.013 17 0 "[ . 1 . 2]" 1
1058 1 44 VAL MG2 1 45 LYS H . . 3.350 2.552 2.306 2.793 . 0 0 "[ . 1 . 2]" 1
1059 1 44 VAL MG2 1 45 LYS HA . . 5.500 3.944 3.781 4.122 . 0 0 "[ . 1 . 2]" 1
1060 1 44 VAL MG2 1 45 LYS HB2 . . 5.500 4.811 4.676 4.905 . 0 0 "[ . 1 . 2]" 1
1061 1 44 VAL MG2 1 46 VAL H . . 5.500 4.265 4.040 4.567 . 0 0 "[ . 1 . 2]" 1
1062 1 44 VAL MG2 1 46 VAL MG2 . . 2.840 2.517 2.325 2.671 . 0 0 "[ . 1 . 2]" 1
1063 1 44 VAL MG2 1 50 VAL MG2 . . 5.220 4.581 4.468 4.751 . 0 0 "[ . 1 . 2]" 1
1064 1 44 VAL MG2 1 51 ALA H . . 5.500 4.251 4.093 4.496 . 0 0 "[ . 1 . 2]" 1
1065 1 44 VAL MG2 1 51 ALA MB . . 5.500 3.626 3.439 3.967 . 0 0 "[ . 1 . 2]" 1
1066 1 44 VAL MG2 1 65 ALA MB . . 5.160 3.454 3.221 3.670 . 0 0 "[ . 1 . 2]" 1
1067 1 44 VAL MG2 1 66 ALA HA . . 5.320 3.021 2.786 3.307 . 0 0 "[ . 1 . 2]" 1
1068 1 44 VAL MG2 1 69 MET HB3 . . 5.500 3.677 3.337 3.981 . 0 0 "[ . 1 . 2]" 1
1069 1 44 VAL MG2 1 69 MET ME . . 3.420 2.719 2.463 3.225 . 0 0 "[ . 1 . 2]" 1
1070 1 45 LYS H 1 45 LYS HB2 . . 3.700 2.704 2.575 2.789 . 0 0 "[ . 1 . 2]" 1
1071 1 45 LYS H 1 45 LYS HB3 . . 3.850 2.928 2.874 2.974 . 0 0 "[ . 1 . 2]" 1
1072 1 45 LYS H 1 45 LYS HG2 . . 5.200 4.603 4.562 4.671 . 0 0 "[ . 1 . 2]" 1
1073 1 45 LYS H 1 51 ALA H . . 4.930 4.934 4.924 4.942 0.012 5 0 "[ . 1 . 2]" 1
1074 1 45 LYS HA 1 45 LYS HG2 . . 4.020 2.569 2.423 2.724 . 0 0 "[ . 1 . 2]" 1
1075 1 45 LYS HA 1 45 LYS HG3 . . 4.180 2.426 2.270 2.568 . 0 0 "[ . 1 . 2]" 1
1076 1 45 LYS HA 1 46 VAL H . . 2.820 2.178 2.176 2.191 . 0 0 "[ . 1 . 2]" 1
1077 1 45 LYS HA 1 46 VAL HA . . 5.170 4.372 4.368 4.382 . 0 0 "[ . 1 . 2]" 1
1078 1 45 LYS HA 1 46 VAL HB . . 4.920 4.269 4.220 4.357 . 0 0 "[ . 1 . 2]" 1
1079 1 45 LYS HA 1 46 VAL MG2 . . 4.840 4.145 3.899 4.281 . 0 0 "[ . 1 . 2]" 1
1080 1 45 LYS HA 1 47 GLY H . . 5.500 5.607 5.583 5.650 0.150 18 0 "[ . 1 . 2]" 1
1081 1 45 LYS HA 1 50 VAL MG2 . . 3.660 2.004 1.970 2.166 . 0 0 "[ . 1 . 2]" 1
1082 1 45 LYS HA 1 51 ALA H . . 5.500 3.773 3.714 3.796 . 0 0 "[ . 1 . 2]" 1
1083 1 45 LYS HB2 1 45 LYS QE . . 4.260 3.052 2.156 3.814 . 0 0 "[ . 1 . 2]" 1
1084 1 45 LYS HB3 1 46 VAL H . . 4.880 4.129 4.009 4.172 . 0 0 "[ . 1 . 2]" 1
1085 1 45 LYS HB3 1 50 VAL MG2 . . 4.800 3.813 3.727 3.883 . 0 0 "[ . 1 . 2]" 1
1086 1 45 LYS QD 1 46 VAL H . . 5.270 4.866 4.712 5.061 . 0 0 "[ . 1 . 2]" 1
1087 1 45 LYS QE 1 45 LYS HG3 . . 3.600 2.109 1.967 2.311 . 0 0 "[ . 1 . 2]" 1
1088 1 45 LYS QE 1 50 VAL MG1 . . 4.680 4.346 3.954 4.683 0.003 4 0 "[ . 1 . 2]" 1
1089 1 45 LYS QE 1 50 VAL MG2 . . 3.660 2.393 2.045 2.866 . 0 0 "[ . 1 . 2]" 1
1090 1 45 LYS HG2 1 46 VAL H . . 4.340 3.099 2.940 3.336 . 0 0 "[ . 1 . 2]" 1
1091 1 45 LYS HG2 1 50 VAL MG2 . . 3.640 3.156 2.985 3.293 . 0 0 "[ . 1 . 2]" 1
1092 1 45 LYS HG3 1 46 VAL H . . 4.310 3.884 3.601 4.116 . 0 0 "[ . 1 . 2]" 1
1093 1 45 LYS HG3 1 50 VAL HA . . 4.180 3.480 3.339 3.676 . 0 0 "[ . 1 . 2]" 1
1094 1 45 LYS HG3 1 50 VAL MG2 . . 3.860 1.880 1.790 1.954 . 0 0 "[ . 1 . 2]" 1
1095 1 46 VAL H 1 46 VAL HB . . 3.450 2.489 2.433 2.599 . 0 0 "[ . 1 . 2]" 1
1096 1 46 VAL H 1 46 VAL MG2 . . 3.650 3.278 3.160 3.360 . 0 0 "[ . 1 . 2]" 1
1097 1 46 VAL H 1 47 GLY H . . 5.060 4.105 4.038 4.144 . 0 0 "[ . 1 . 2]" 1
1098 1 46 VAL H 1 50 VAL HA . . 4.540 3.061 2.970 3.215 . 0 0 "[ . 1 . 2]" 1
1099 1 46 VAL H 1 51 ALA H . . 5.500 4.985 4.878 5.179 . 0 0 "[ . 1 . 2]" 1
1100 1 46 VAL H 1 69 MET ME . . 3.050 2.447 2.273 2.718 . 0 0 "[ . 1 . 2]" 1
1101 1 46 VAL HA 1 46 VAL MG1 . . 2.990 2.617 2.507 2.701 . 0 0 "[ . 1 . 2]" 1
1102 1 46 VAL HA 1 46 VAL MG2 . . 2.900 2.219 2.147 2.266 . 0 0 "[ . 1 . 2]" 1
1103 1 46 VAL HA 1 47 GLY H . . 3.020 2.190 2.189 2.191 . 0 0 "[ . 1 . 2]" 1
1104 1 46 VAL HA 1 69 MET ME . . 5.000 4.022 3.915 4.267 . 0 0 "[ . 1 . 2]" 1
1105 1 46 VAL HB 1 47 GLY H . . 5.500 4.591 4.553 4.615 . 0 0 "[ . 1 . 2]" 1
1106 1 46 VAL HB 1 69 MET ME . . 3.610 1.828 1.769 1.934 . 0 0 "[ . 1 . 2]" 1
1107 1 46 VAL MG1 1 47 GLY H . . 3.930 3.106 2.993 3.254 . 0 0 "[ . 1 . 2]" 1
1108 1 46 VAL MG1 1 47 GLY HA2 . . 5.060 4.208 4.125 4.296 . 0 0 "[ . 1 . 2]" 1
1109 1 46 VAL MG1 1 47 GLY HA3 . . 5.080 3.323 3.256 3.425 . 0 0 "[ . 1 . 2]" 1
1110 1 46 VAL MG2 1 47 GLY H . . 5.500 3.947 3.862 4.044 . 0 0 "[ . 1 . 2]" 1
1111 1 46 VAL MG2 1 69 MET ME . . 2.640 2.502 2.148 2.697 0.057 20 0 "[ . 1 . 2]" 1
1112 1 47 GLY H 1 48 ASN H . . 4.800 4.421 4.289 4.480 . 0 0 "[ . 1 . 2]" 1
1113 1 47 GLY H 1 69 MET ME . . 5.500 5.369 5.235 5.591 0.091 16 0 "[ . 1 . 2]" 1
1114 1 47 GLY HA2 1 48 ASN HA . . 5.030 4.462 4.439 4.500 . 0 0 "[ . 1 . 2]" 1
1115 1 47 GLY HA2 1 49 GLU H . . 5.290 4.499 4.421 4.666 . 0 0 "[ . 1 . 2]" 1
1116 1 47 GLY HA3 1 48 ASN H . . 3.320 2.229 2.209 2.289 . 0 0 "[ . 1 . 2]" 1
1117 1 47 GLY HA3 1 48 ASN HA . . 4.780 4.348 4.345 4.365 . 0 0 "[ . 1 . 2]" 1
1118 1 47 GLY HA3 1 48 ASN HB3 . . 5.500 5.408 4.723 5.686 0.186 12 0 "[ . 1 . 2]" 1
1119 1 47 GLY HA3 1 49 GLU H . . 4.740 3.670 3.573 3.780 . 0 0 "[ . 1 . 2]" 1
1120 1 48 ASN H 1 48 ASN HB3 . . 4.170 3.327 2.623 3.704 . 0 0 "[ . 1 . 2]" 1
1121 1 48 ASN H 1 48 ASN HD22 . . 5.500 5.433 4.265 6.016 0.516 19 1 "[ . 1 . +2]" 1
1122 1 48 ASN H 1 49 GLU H . . 3.860 2.491 1.888 2.585 . 0 0 "[ . 1 . 2]" 1
1123 1 48 ASN H 1 49 GLU QG . . 5.500 4.686 4.269 4.800 . 0 0 "[ . 1 . 2]" 1
1124 1 48 ASN HB2 1 49 GLU H . . 5.110 4.196 3.963 4.559 . 0 0 "[ . 1 . 2]" 1
1125 1 48 ASN HB3 1 48 ASN HD22 . . 4.020 3.667 3.445 4.114 0.094 1 0 "[ . 1 . 2]" 1
1126 1 48 ASN HB3 1 49 GLU H . . 4.800 4.266 3.754 4.555 . 0 0 "[ . 1 . 2]" 1
1127 1 48 ASN HB3 1 49 GLU QG . . 5.500 4.598 4.016 5.146 . 0 0 "[ . 1 . 2]" 1
1128 1 49 GLU H 1 49 GLU HB2 . . 3.470 2.520 2.267 2.561 . 0 0 "[ . 1 . 2]" 1
1129 1 49 GLU H 1 49 GLU HB3 . . 3.870 3.611 3.477 3.653 . 0 0 "[ . 1 . 2]" 1
1130 1 49 GLU H 1 49 GLU QG . . 3.870 3.878 3.679 3.927 0.057 14 0 "[ . 1 . 2]" 1
1131 1 49 GLU H 1 50 VAL H . . 4.490 4.476 4.464 4.574 0.084 16 0 "[ . 1 . 2]" 1
1132 1 49 GLU H 1 69 MET ME . . 4.870 3.851 3.710 4.104 . 0 0 "[ . 1 . 2]" 1
1133 1 49 GLU HA 1 49 GLU QG . . 3.420 2.108 2.041 2.140 . 0 0 "[ . 1 . 2]" 1
1134 1 49 GLU HA 1 50 VAL H . . 3.240 2.424 2.397 2.480 . 0 0 "[ . 1 . 2]" 1
1135 1 49 GLU HA 1 50 VAL HB . . 4.400 3.925 3.909 3.938 . 0 0 "[ . 1 . 2]" 1
1136 1 49 GLU HA 1 50 VAL MG1 . . 4.460 4.471 4.426 4.530 0.070 19 0 "[ . 1 . 2]" 1
1137 1 49 GLU HA 1 50 VAL MG2 . . 5.120 5.048 5.009 5.071 . 0 0 "[ . 1 . 2]" 1
1138 1 49 GLU HA 1 72 GLN HE22 . . 5.220 4.484 4.090 4.770 . 0 0 "[ . 1 . 2]" 1
1139 1 49 GLU HB2 1 49 GLU QG . . 2.450 2.490 2.179 2.523 0.073 16 0 "[ . 1 . 2]" 1
1140 1 49 GLU HB2 1 50 VAL H . . 4.250 4.034 3.914 4.175 . 0 0 "[ . 1 . 2]" 1
1141 1 49 GLU HB2 1 69 MET ME . . 2.750 2.779 2.757 2.828 0.078 16 0 "[ . 1 . 2]" 1
1142 1 49 GLU HB2 1 72 GLN HE21 . . 5.500 5.258 4.538 5.518 0.018 3 0 "[ . 1 . 2]" 1
1143 1 49 GLU HB2 1 72 GLN HE22 . . 5.500 4.785 4.210 5.117 . 0 0 "[ . 1 . 2]" 1
1144 1 49 GLU HB2 1 73 LEU QD . . 4.230 3.097 2.874 3.325 . 0 0 "[ . 1 . 2]" 1
1145 1 49 GLU HB3 1 49 GLU QG . . 2.640 2.207 2.184 2.557 . 0 0 "[ . 1 . 2]" 1
1146 1 49 GLU HB3 1 50 VAL H . . 4.030 2.713 2.548 2.916 . 0 0 "[ . 1 . 2]" 1
1147 1 49 GLU HB3 1 69 MET ME . . 2.810 2.341 1.962 2.414 . 0 0 "[ . 1 . 2]" 1
1148 1 49 GLU HB3 1 72 GLN HE21 . . 5.260 3.709 3.045 3.948 . 0 0 "[ . 1 . 2]" 1
1149 1 49 GLU HB3 1 72 GLN HE22 . . 4.250 3.053 2.474 3.405 . 0 0 "[ . 1 . 2]" 1
1150 1 49 GLU HB3 1 73 LEU QD . . 4.460 3.215 2.873 3.454 . 0 0 "[ . 1 . 2]" 1
1151 1 49 GLU QG 1 50 VAL H . . 4.880 3.432 3.389 3.577 . 0 0 "[ . 1 . 2]" 1
1152 1 49 GLU QG 1 50 VAL HB . . 5.500 5.550 5.525 5.596 0.096 19 0 "[ . 1 . 2]" 1
1153 1 49 GLU QG 1 72 GLN HE21 . . 4.690 4.254 3.544 4.705 0.015 19 0 "[ . 1 . 2]" 1
1154 1 49 GLU QG 1 72 GLN HE22 . . 5.500 3.915 3.540 4.456 . 0 0 "[ . 1 . 2]" 1
1155 1 49 GLU QG 1 73 LEU HA . . 4.530 4.492 4.136 4.571 0.041 19 0 "[ . 1 . 2]" 1
1156 1 49 GLU QG 1 73 LEU QD . . 2.940 2.689 2.398 2.883 . 0 0 "[ . 1 . 2]" 1
1157 1 50 VAL H 1 50 VAL HB . . 3.800 2.856 2.807 2.905 . 0 0 "[ . 1 . 2]" 1
1158 1 50 VAL H 1 50 VAL MG1 . . 3.350 2.761 2.708 2.826 . 0 0 "[ . 1 . 2]" 1
1159 1 50 VAL H 1 51 ALA H . . 4.500 4.390 4.366 4.403 . 0 0 "[ . 1 . 2]" 1
1160 1 50 VAL H 1 69 MET ME . . 4.400 3.317 3.159 3.587 . 0 0 "[ . 1 . 2]" 1
1161 1 50 VAL H 1 72 GLN HE21 . . 5.000 4.260 3.959 4.469 . 0 0 "[ . 1 . 2]" 1
1162 1 50 VAL H 1 72 GLN HE22 . . 5.260 2.674 2.369 3.044 . 0 0 "[ . 1 . 2]" 1
1163 1 50 VAL HA 1 50 VAL MG1 . . 3.480 3.116 3.093 3.131 . 0 0 "[ . 1 . 2]" 1
1164 1 50 VAL HA 1 50 VAL MG2 . . 3.280 1.980 1.961 2.051 . 0 0 "[ . 1 . 2]" 1
1165 1 50 VAL HA 1 51 ALA H . . 3.380 2.358 2.304 2.382 . 0 0 "[ . 1 . 2]" 1
1166 1 50 VAL HA 1 51 ALA MB . . 4.730 3.723 3.698 3.824 . 0 0 "[ . 1 . 2]" 1
1167 1 50 VAL HA 1 69 MET ME . . 2.890 2.545 2.232 2.724 . 0 0 "[ . 1 . 2]" 1
1168 1 50 VAL HB 1 51 ALA HA . . 5.500 5.593 5.581 5.616 0.116 18 0 "[ . 1 . 2]" 1
1169 1 50 VAL MG1 1 51 ALA H . . 3.690 2.907 2.843 2.980 . 0 0 "[ . 1 . 2]" 1
1170 1 50 VAL MG1 1 51 ALA HA . . 5.210 3.170 3.106 3.223 . 0 0 "[ . 1 . 2]" 1
1171 1 50 VAL MG1 1 51 ALA MB . . 4.000 4.040 4.007 4.071 0.071 18 0 "[ . 1 . 2]" 1
1172 1 50 VAL MG2 1 51 ALA H . . 3.340 2.571 2.437 2.726 . 0 0 "[ . 1 . 2]" 1
1173 1 50 VAL MG2 1 51 ALA HA . . 5.110 4.444 4.355 4.533 . 0 0 "[ . 1 . 2]" 1
1174 1 51 ALA H 1 51 ALA MB . . 3.660 2.639 2.572 2.684 . 0 0 "[ . 1 . 2]" 1
1175 1 51 ALA H 1 52 THR H . . 5.500 4.386 4.372 4.399 . 0 0 "[ . 1 . 2]" 1
1176 1 51 ALA H 1 52 THR MG . . 5.500 3.950 3.782 4.125 . 0 0 "[ . 1 . 2]" 1
1177 1 51 ALA H 1 69 MET ME . . 3.210 3.057 2.795 3.238 0.028 16 0 "[ . 1 . 2]" 1
1178 1 51 ALA HA 1 52 THR H . . 3.360 2.549 2.499 2.601 . 0 0 "[ . 1 . 2]" 1
1179 1 51 ALA HA 1 52 THR HA . . 5.500 4.504 4.475 4.540 . 0 0 "[ . 1 . 2]" 1
1180 1 51 ALA HA 1 52 THR MG . . 4.480 3.525 3.478 3.590 . 0 0 "[ . 1 . 2]" 1
1181 1 51 ALA HA 1 68 ALA MB . . 5.090 3.750 3.487 3.998 . 0 0 "[ . 1 . 2]" 1
1182 1 51 ALA HA 1 69 MET ME . . 5.400 4.096 3.968 4.357 . 0 0 "[ . 1 . 2]" 1
1183 1 51 ALA HA 1 72 GLN HE22 . . 4.500 3.640 3.265 4.017 . 0 0 "[ . 1 . 2]" 1
1184 1 51 ALA MB 1 52 THR H . . 3.170 2.468 2.325 2.565 . 0 0 "[ . 1 . 2]" 1
1185 1 51 ALA MB 1 52 THR HA . . 5.500 3.882 3.813 3.982 . 0 0 "[ . 1 . 2]" 1
1186 1 51 ALA MB 1 52 THR MG . . 5.460 4.182 4.125 4.246 . 0 0 "[ . 1 . 2]" 1
1187 1 51 ALA MB 1 68 ALA H . . 5.500 4.135 3.908 4.358 . 0 0 "[ . 1 . 2]" 1
1188 1 51 ALA MB 1 68 ALA HA . . 4.740 4.350 4.036 4.716 . 0 0 "[ . 1 . 2]" 1
1189 1 51 ALA MB 1 68 ALA MB . . 2.890 2.271 2.017 2.497 . 0 0 "[ . 1 . 2]" 1
1190 1 51 ALA MB 1 69 MET H . . 4.070 2.551 2.099 2.806 . 0 0 "[ . 1 . 2]" 1
1191 1 51 ALA MB 1 69 MET HA . . 3.530 2.233 2.064 2.320 . 0 0 "[ . 1 . 2]" 1
1192 1 51 ALA MB 1 69 MET HB2 . . 3.390 2.020 1.885 2.143 . 0 0 "[ . 1 . 2]" 1
1193 1 51 ALA MB 1 69 MET HB3 . . 3.920 3.319 3.020 3.481 . 0 0 "[ . 1 . 2]" 1
1194 1 51 ALA MB 1 69 MET ME . . 2.740 2.122 1.951 2.297 . 0 0 "[ . 1 . 2]" 1
1195 1 51 ALA MB 1 70 LEU H . . 5.450 4.559 4.336 4.716 . 0 0 "[ . 1 . 2]" 1
1196 1 51 ALA MB 1 72 GLN H . . 5.500 4.565 4.376 4.935 . 0 0 "[ . 1 . 2]" 1
1197 1 51 ALA MB 1 72 GLN QB . . 4.450 3.528 3.154 3.793 . 0 0 "[ . 1 . 2]" 1
1198 1 51 ALA MB 1 72 GLN HE21 . . 4.370 2.961 2.301 4.425 0.055 18 0 "[ . 1 . 2]" 1
1199 1 51 ALA MB 1 72 GLN HE22 . . 4.810 2.995 2.728 3.627 . 0 0 "[ . 1 . 2]" 1
1200 1 51 ALA MB 1 72 GLN HG2 . . 5.500 4.347 3.885 4.529 . 0 0 "[ . 1 . 2]" 1
1201 1 51 ALA MB 1 72 GLN HG3 . . 5.500 5.335 4.686 5.543 0.043 12 0 "[ . 1 . 2]" 1
1202 1 52 THR H 1 52 THR HB . . 4.080 3.718 3.675 3.760 . 0 0 "[ . 1 . 2]" 1
1203 1 52 THR H 1 52 THR MG . . 3.850 3.222 3.154 3.317 . 0 0 "[ . 1 . 2]" 1
1204 1 52 THR H 1 53 GLY H . . 4.940 4.429 4.391 4.456 . 0 0 "[ . 1 . 2]" 1
1205 1 52 THR H 1 68 ALA MB . . 4.670 2.640 2.399 3.059 . 0 0 "[ . 1 . 2]" 1
1206 1 52 THR H 1 69 MET HA . . 5.500 5.428 5.163 5.514 0.014 15 0 "[ . 1 . 2]" 1
1207 1 52 THR HA 1 52 THR MG . . 3.240 2.326 2.288 2.350 . 0 0 "[ . 1 . 2]" 1
1208 1 52 THR HA 1 53 GLY H . . 2.970 2.370 2.320 2.400 . 0 0 "[ . 1 . 2]" 1
1209 1 52 THR HA 1 53 GLY HA3 . . 5.500 4.277 4.274 4.282 . 0 0 "[ . 1 . 2]" 1
1210 1 52 THR HA 1 65 ALA HA . . 4.870 3.426 3.194 3.652 . 0 0 "[ . 1 . 2]" 1
1211 1 52 THR HA 1 65 ALA MB . . 3.800 2.974 2.610 3.273 . 0 0 "[ . 1 . 2]" 1
1212 1 52 THR HA 1 68 ALA MB . . 5.430 4.529 4.303 5.048 . 0 0 "[ . 1 . 2]" 1
1213 1 52 THR HB 1 53 GLY H . . 3.510 2.763 2.687 2.898 . 0 0 "[ . 1 . 2]" 1
1214 1 52 THR HB 1 53 GLY HA2 . . 5.330 4.327 4.274 4.372 . 0 0 "[ . 1 . 2]" 1
1215 1 52 THR MG 1 53 GLY H . . 3.610 3.608 3.558 3.628 0.018 18 0 "[ . 1 . 2]" 1
1216 1 52 THR MG 1 53 GLY HA2 . . 5.500 5.450 5.423 5.467 . 0 0 "[ . 1 . 2]" 1
1217 1 52 THR MG 1 65 ALA MB . . 4.990 4.424 4.144 4.697 . 0 0 "[ . 1 . 2]" 1
1218 1 53 GLY H 1 54 THR H . . 5.290 4.360 4.257 4.413 . 0 0 "[ . 1 . 2]" 1
1219 1 53 GLY H 1 65 ALA H . . 5.130 4.528 4.301 4.749 . 0 0 "[ . 1 . 2]" 1
1220 1 53 GLY H 1 65 ALA HA . . 4.940 3.328 3.133 3.467 . 0 0 "[ . 1 . 2]" 1
1221 1 53 GLY H 1 65 ALA MB . . 3.290 2.963 2.718 3.155 . 0 0 "[ . 1 . 2]" 1
1222 1 53 GLY HA2 1 54 THR H . . 3.570 2.300 2.213 2.368 . 0 0 "[ . 1 . 2]" 1
1223 1 53 GLY HA2 1 54 THR HA . . 4.900 4.445 4.409 4.483 . 0 0 "[ . 1 . 2]" 1
1224 1 53 GLY HA2 1 54 THR MG . . 4.400 3.545 3.296 3.738 . 0 0 "[ . 1 . 2]" 1
1225 1 53 GLY HA2 1 65 ALA H . . 5.500 3.989 3.755 4.396 . 0 0 "[ . 1 . 2]" 1
1226 1 53 GLY HA2 1 65 ALA HA . . 4.720 3.142 2.830 3.419 . 0 0 "[ . 1 . 2]" 1
1227 1 53 GLY HA2 1 65 ALA MB . . 4.340 3.932 3.633 4.314 . 0 0 "[ . 1 . 2]" 1
1228 1 53 GLY HA2 1 68 ALA MB . . 5.040 3.828 3.618 4.101 . 0 0 "[ . 1 . 2]" 1
1229 1 53 GLY HA3 1 54 THR H . . 3.510 3.022 2.913 3.214 . 0 0 "[ . 1 . 2]" 1
1230 1 53 GLY HA3 1 64 ASN H . . 3.950 3.871 3.698 3.967 0.017 10 0 "[ . 1 . 2]" 1
1231 1 53 GLY HA3 1 64 ASN HB2 . . 4.370 2.694 2.390 2.954 . 0 0 "[ . 1 . 2]" 1
1232 1 53 GLY HA3 1 64 ASN HB3 . . 4.000 2.533 2.047 3.101 . 0 0 "[ . 1 . 2]" 1
1233 1 53 GLY HA3 1 65 ALA H . . 3.780 2.455 2.293 2.690 . 0 0 "[ . 1 . 2]" 1
1234 1 53 GLY HA3 1 65 ALA HA . . 3.240 2.441 2.278 2.584 . 0 0 "[ . 1 . 2]" 1
1235 1 53 GLY HA3 1 65 ALA MB . . 3.350 2.591 2.262 2.979 . 0 0 "[ . 1 . 2]" 1
1236 1 53 GLY HA3 1 68 ALA MB . . 4.880 4.383 3.890 4.831 . 0 0 "[ . 1 . 2]" 1
1237 1 54 THR H 1 54 THR MG . . 3.270 3.000 2.760 3.148 . 0 0 "[ . 1 . 2]" 1
1238 1 54 THR H 1 61 ALA HA . . 4.410 3.528 3.260 3.908 . 0 0 "[ . 1 . 2]" 1
1239 1 54 THR H 1 61 ALA MB . . 5.500 4.341 4.052 4.605 . 0 0 "[ . 1 . 2]" 1
1240 1 54 THR H 1 64 ASN HB2 . . 3.960 2.678 2.463 3.070 . 0 0 "[ . 1 . 2]" 1
1241 1 54 THR H 1 64 ASN HB3 . . 4.090 2.269 1.965 2.524 . 0 0 "[ . 1 . 2]" 1
1242 1 54 THR H 1 64 ASN HD21 . . 5.500 4.407 4.021 4.836 . 0 0 "[ . 1 . 2]" 1
1243 1 54 THR H 1 64 ASN HD22 . . 5.500 4.881 4.527 5.318 . 0 0 "[ . 1 . 2]" 1
1244 1 54 THR HA 1 54 THR MG . . 3.300 2.375 2.277 2.509 . 0 0 "[ . 1 . 2]" 1
1245 1 54 THR HA 1 55 GLY H . . 2.980 2.326 2.195 2.446 . 0 0 "[ . 1 . 2]" 1
1246 1 54 THR HA 1 60 ILE MG . . 5.500 5.234 4.945 5.494 . 0 0 "[ . 1 . 2]" 1
1247 1 54 THR HA 1 61 ALA HA . . 4.550 2.884 2.769 3.001 . 0 0 "[ . 1 . 2]" 1
1248 1 54 THR HA 1 61 ALA MB . . 3.640 2.463 2.146 2.853 . 0 0 "[ . 1 . 2]" 1
1249 1 54 THR HB 1 55 GLY H . . 3.310 2.862 2.568 3.277 . 0 0 "[ . 1 . 2]" 1
1250 1 54 THR HB 1 55 GLY HA3 . . 5.270 5.065 4.854 5.290 0.020 12 0 "[ . 1 . 2]" 1
1251 1 54 THR HB 1 61 ALA MB . . 5.030 4.489 4.185 4.983 . 0 0 "[ . 1 . 2]" 1
1252 1 54 THR MG 1 55 GLY H . . 4.450 3.934 3.698 4.098 . 0 0 "[ . 1 . 2]" 1
1253 1 54 THR MG 1 61 ALA HA . . 4.580 4.609 4.567 4.656 0.076 18 0 "[ . 1 . 2]" 1
1254 1 55 GLY H 1 56 PRO HD2 . . 5.500 4.760 4.581 4.888 . 0 0 "[ . 1 . 2]" 1
1255 1 55 GLY H 1 57 ASN H . . 5.500 4.424 3.977 4.837 . 0 0 "[ . 1 . 2]" 1
1256 1 55 GLY H 1 61 ALA H . . 4.490 4.378 4.035 4.498 0.008 11 0 "[ . 1 . 2]" 1
1257 1 55 GLY H 1 61 ALA HA . . 5.110 3.421 3.127 3.637 . 0 0 "[ . 1 . 2]" 1
1258 1 55 GLY H 1 61 ALA MB . . 3.690 2.782 2.429 3.120 . 0 0 "[ . 1 . 2]" 1
1259 1 55 GLY HA2 1 56 PRO HD2 . . 3.100 3.227 3.076 3.405 0.305 10 0 "[ . 1 . 2]" 1
1260 1 55 GLY HA2 1 56 PRO HD3 . . 3.310 2.400 2.257 2.585 . 0 0 "[ . 1 . 2]" 1
1261 1 55 GLY HA2 1 56 PRO HG2 . . 5.340 5.080 4.941 5.250 . 0 0 "[ . 1 . 2]" 1
1262 1 55 GLY HA2 1 56 PRO HG3 . . 5.500 4.610 4.486 4.774 . 0 0 "[ . 1 . 2]" 1
1263 1 55 GLY HA2 1 57 ASN H . . 5.010 4.331 4.089 4.739 . 0 0 "[ . 1 . 2]" 1
1264 1 55 GLY HA2 1 60 ILE HB . . 4.580 4.390 4.036 4.812 0.232 10 0 "[ . 1 . 2]" 1
1265 1 55 GLY HA2 1 60 ILE MD . . 5.500 4.505 4.311 4.736 . 0 0 "[ . 1 . 2]" 1
1266 1 55 GLY HA2 1 60 ILE MG . . 3.450 2.997 2.821 3.299 . 0 0 "[ . 1 . 2]" 1
1267 1 55 GLY HA2 1 61 ALA H . . 4.860 5.080 4.769 5.501 0.641 17 4 "[ ** .- 1 . + 2]" 1
1268 1 55 GLY HA2 1 61 ALA HA . . 5.500 4.448 4.260 4.708 . 0 0 "[ . 1 . 2]" 1
1269 1 55 GLY HA2 1 61 ALA MB . . 4.750 4.609 4.236 4.911 0.161 17 0 "[ . 1 . 2]" 1
1270 1 55 GLY HA3 1 56 PRO HB2 . . 5.440 5.640 5.559 5.715 0.275 11 0 "[ . 1 . 2]" 1
1271 1 55 GLY HA3 1 56 PRO HD2 . . 3.440 2.363 2.256 2.472 . 0 0 "[ . 1 . 2]" 1
1272 1 55 GLY HA3 1 56 PRO HD3 . . 3.200 2.639 2.448 2.796 . 0 0 "[ . 1 . 2]" 1
1273 1 55 GLY HA3 1 56 PRO HG2 . . 5.500 4.594 4.480 4.702 . 0 0 "[ . 1 . 2]" 1
1274 1 55 GLY HA3 1 56 PRO HG3 . . 5.350 4.743 4.580 4.884 . 0 0 "[ . 1 . 2]" 1
1275 1 55 GLY HA3 1 57 ASN H . . 5.370 3.175 2.989 3.526 . 0 0 "[ . 1 . 2]" 1
1276 1 55 GLY HA3 1 60 ILE HB . . 4.910 2.846 2.590 3.212 . 0 0 "[ . 1 . 2]" 1
1277 1 55 GLY HA3 1 60 ILE MD . . 5.500 3.783 3.669 3.857 . 0 0 "[ . 1 . 2]" 1
1278 1 55 GLY HA3 1 60 ILE MG . . 3.740 2.037 1.930 2.346 . 0 0 "[ . 1 . 2]" 1
1279 1 55 GLY HA3 1 61 ALA H . . 5.500 3.369 3.042 3.841 . 0 0 "[ . 1 . 2]" 1
1280 1 55 GLY HA3 1 61 ALA HA . . 4.950 3.286 3.113 3.544 . 0 0 "[ . 1 . 2]" 1
1281 1 55 GLY HA3 1 61 ALA MB . . 4.960 3.557 3.223 3.909 . 0 0 "[ . 1 . 2]" 1
1282 1 56 PRO HB2 1 60 ILE MD . . 5.500 3.773 3.521 4.090 . 0 0 "[ . 1 . 2]" 1
1283 1 56 PRO HD2 1 57 ASN H . . 4.470 2.348 2.256 2.505 . 0 0 "[ . 1 . 2]" 1
1284 1 56 PRO HD2 1 60 ILE H . . 5.500 4.237 4.158 4.309 . 0 0 "[ . 1 . 2]" 1
1285 1 56 PRO HD2 1 60 ILE HB . . 3.630 2.021 1.964 2.085 . 0 0 "[ . 1 . 2]" 1
1286 1 56 PRO HD2 1 60 ILE MD . . 3.960 1.956 1.870 2.020 . 0 0 "[ . 1 . 2]" 1
1287 1 56 PRO HD2 1 60 ILE HG12 . . 5.320 4.112 3.814 4.266 . 0 0 "[ . 1 . 2]" 1
1288 1 56 PRO HD2 1 60 ILE HG13 . . 5.150 3.836 3.611 4.085 . 0 0 "[ . 1 . 2]" 1
1289 1 56 PRO HD2 1 60 ILE MG . . 3.330 2.150 1.957 2.388 . 0 0 "[ . 1 . 2]" 1
1290 1 56 PRO HD2 1 61 ALA H . . 5.330 4.123 3.643 4.532 . 0 0 "[ . 1 . 2]" 1
1291 1 56 PRO HD3 1 57 ASN H . . 4.920 3.678 3.655 3.734 . 0 0 "[ . 1 . 2]" 1
1292 1 56 PRO HD3 1 60 ILE HB . . 4.610 3.626 3.559 3.729 . 0 0 "[ . 1 . 2]" 1
1293 1 56 PRO HD3 1 60 ILE MD . . 4.840 2.787 2.669 2.943 . 0 0 "[ . 1 . 2]" 1
1294 1 56 PRO HD3 1 60 ILE HG12 . . 5.500 5.279 4.957 5.514 0.014 17 0 "[ . 1 . 2]" 1
1295 1 56 PRO HD3 1 60 ILE HG13 . . 5.500 5.378 5.203 5.507 0.007 7 0 "[ . 1 . 2]" 1
1296 1 56 PRO HD3 1 60 ILE MG . . 4.030 2.595 2.416 2.796 . 0 0 "[ . 1 . 2]" 1
1297 1 56 PRO HG2 1 57 ASN H . . 4.700 3.257 2.821 3.583 . 0 0 "[ . 1 . 2]" 1
1298 1 56 PRO HG2 1 57 ASN QB . . 5.500 4.479 4.053 4.736 . 0 0 "[ . 1 . 2]" 1
1299 1 56 PRO HG2 1 57 ASN HD21 . . 5.120 4.263 2.166 5.096 . 0 0 "[ . 1 . 2]" 1
1300 1 56 PRO HG2 1 60 ILE HB . . 5.060 3.646 3.309 3.806 . 0 0 "[ . 1 . 2]" 1
1301 1 56 PRO HG2 1 60 ILE MD . . 3.690 1.939 1.825 2.187 . 0 0 "[ . 1 . 2]" 1
1302 1 56 PRO HG2 1 60 ILE MG . . 4.850 3.756 3.605 3.919 . 0 0 "[ . 1 . 2]" 1
1303 1 56 PRO HG3 1 57 ASN H . . 5.270 4.352 4.071 4.569 . 0 0 "[ . 1 . 2]" 1
1304 1 56 PRO HG3 1 60 ILE HB . . 5.500 4.699 4.402 4.833 . 0 0 "[ . 1 . 2]" 1
1305 1 56 PRO HG3 1 60 ILE MD . . 4.140 2.787 2.494 2.986 . 0 0 "[ . 1 . 2]" 1
1306 1 56 PRO HG3 1 60 ILE MG . . 4.950 3.970 3.841 4.115 . 0 0 "[ . 1 . 2]" 1
1307 1 57 ASN H 1 57 ASN HD22 . . 4.410 3.992 3.145 4.465 0.055 12 0 "[ . 1 . 2]" 1
1308 1 57 ASN H 1 58 LYS HA . . 5.330 4.942 4.815 5.068 . 0 0 "[ . 1 . 2]" 1
1309 1 57 ASN H 1 59 LYS H . . 5.500 5.082 4.859 5.226 . 0 0 "[ . 1 . 2]" 1
1310 1 57 ASN H 1 60 ILE H . . 4.790 3.801 3.516 3.986 . 0 0 "[ . 1 . 2]" 1
1311 1 57 ASN H 1 60 ILE HB . . 4.350 2.620 2.500 2.759 . 0 0 "[ . 1 . 2]" 1
1312 1 57 ASN H 1 60 ILE MD . . 4.790 3.300 2.878 3.715 . 0 0 "[ . 1 . 2]" 1
1313 1 57 ASN H 1 60 ILE HG12 . . 5.500 5.361 5.121 5.532 0.032 10 0 "[ . 1 . 2]" 1
1314 1 57 ASN H 1 60 ILE HG13 . . 5.500 4.339 3.944 4.705 . 0 0 "[ . 1 . 2]" 1
1315 1 57 ASN H 1 60 ILE MG . . 4.660 3.753 3.625 3.911 . 0 0 "[ . 1 . 2]" 1
1316 1 57 ASN H 1 61 ALA H . . 3.870 3.444 3.210 3.695 . 0 0 "[ . 1 . 2]" 1
1317 1 57 ASN H 1 61 ALA MB . . 5.390 3.907 3.692 4.126 . 0 0 "[ . 1 . 2]" 1
1318 1 57 ASN HA 1 58 LYS HA . . 4.280 4.337 4.334 4.348 0.068 10 0 "[ . 1 . 2]" 1
1319 1 57 ASN HA 1 59 LYS H . . 5.500 4.554 4.221 4.798 . 0 0 "[ . 1 . 2]" 1
1320 1 57 ASN HA 1 59 LYS QB . . 5.380 5.321 5.088 5.495 0.115 10 0 "[ . 1 . 2]" 1
1321 1 57 ASN QB 1 58 LYS H . . 4.570 2.606 2.144 2.907 . 0 0 "[ . 1 . 2]" 1
1322 1 57 ASN QB 1 59 LYS H . . 4.670 2.744 2.359 3.305 . 0 0 "[ . 1 . 2]" 1
1323 1 57 ASN QB 1 59 LYS QB . . 5.500 2.976 2.581 3.511 . 0 0 "[ . 1 . 2]" 1
1324 1 57 ASN QB 1 60 ILE H . . 5.500 3.556 3.061 4.087 . 0 0 "[ . 1 . 2]" 1
1325 1 57 ASN HD21 1 60 ILE H . . 4.010 2.998 1.818 4.037 0.027 8 0 "[ . 1 . 2]" 1
1326 1 57 ASN HD21 1 60 ILE MD . . 4.340 3.179 2.431 4.127 . 0 0 "[ . 1 . 2]" 1
1327 1 57 ASN HD22 1 59 LYS H . . 5.500 4.922 4.024 5.506 0.006 6 0 "[ . 1 . 2]" 1
1328 1 57 ASN HD22 1 60 ILE H . . 5.500 3.006 1.888 3.773 . 0 0 "[ . 1 . 2]" 1
1329 1 57 ASN HD22 1 60 ILE MD . . 4.080 2.071 1.816 2.861 . 0 0 "[ . 1 . 2]" 1
1330 1 57 ASN HD22 1 60 ILE HG12 . . 4.870 3.635 3.431 4.152 . 0 0 "[ . 1 . 2]" 1
1331 1 57 ASN HD22 1 60 ILE HG13 . . 4.680 2.136 1.936 2.710 . 0 0 "[ . 1 . 2]" 1
1332 1 57 ASN HD22 1 60 ILE MG . . 5.500 4.454 3.652 5.045 . 0 0 "[ . 1 . 2]" 1
1333 1 58 LYS H 1 58 LYS HG2 . . 5.120 4.359 4.094 4.546 . 0 0 "[ . 1 . 2]" 1
1334 1 58 LYS H 1 58 LYS HG3 . . 4.910 4.120 2.877 4.568 . 0 0 "[ . 1 . 2]" 1
1335 1 58 LYS H 1 59 LYS H . . 4.310 2.897 2.744 3.013 . 0 0 "[ . 1 . 2]" 1
1336 1 58 LYS H 1 59 LYS QB . . 5.110 4.529 4.361 4.742 . 0 0 "[ . 1 . 2]" 1
1337 1 58 LYS HA 1 58 LYS QE . . 5.200 4.441 4.119 4.700 . 0 0 "[ . 1 . 2]" 1
1338 1 58 LYS HA 1 58 LYS HG3 . . 3.640 2.652 1.926 3.208 . 0 0 "[ . 1 . 2]" 1
1339 1 58 LYS HA 1 60 ILE H . . 5.500 5.058 4.750 5.233 . 0 0 "[ . 1 . 2]" 1
1340 1 58 LYS HA 1 61 ALA H . . 4.370 3.429 3.137 3.652 . 0 0 "[ . 1 . 2]" 1
1341 1 58 LYS HA 1 61 ALA MB . . 3.280 2.015 1.896 2.230 . 0 0 "[ . 1 . 2]" 1
1342 1 58 LYS HA 1 62 LYS H . . 4.470 3.922 3.617 4.321 . 0 0 "[ . 1 . 2]" 1
1343 1 58 LYS HA 1 62 LYS QB . . 4.840 4.645 4.305 4.865 0.025 18 0 "[ . 1 . 2]" 1
1344 1 58 LYS HB2 1 59 LYS H . . 3.980 3.643 2.799 4.029 0.049 12 0 "[ . 1 . 2]" 1
1345 1 58 LYS HB3 1 59 LYS H . . 4.000 2.687 2.411 3.163 . 0 0 "[ . 1 . 2]" 1
1346 1 58 LYS HB3 1 59 LYS QE . . 4.960 3.978 2.422 5.452 0.492 16 0 "[ . 1 . 2]" 1
1347 1 58 LYS HG2 1 59 LYS H . . 5.500 4.231 3.605 5.119 . 0 0 "[ . 1 . 2]" 1
1348 1 59 LYS H 1 59 LYS QB . . 3.390 2.177 2.055 2.288 . 0 0 "[ . 1 . 2]" 1
1349 1 59 LYS H 1 59 LYS QD . . 4.240 3.000 1.925 4.251 0.011 14 0 "[ . 1 . 2]" 1
1350 1 59 LYS H 1 59 LYS HG2 . . 4.210 3.769 2.557 4.231 0.021 17 0 "[ . 1 . 2]" 1
1351 1 59 LYS H 1 59 LYS HG3 . . 4.010 3.383 2.697 3.962 . 0 0 "[ . 1 . 2]" 1
1352 1 59 LYS H 1 60 ILE H . . 3.890 3.277 3.124 3.414 . 0 0 "[ . 1 . 2]" 1
1353 1 59 LYS H 1 60 ILE HB . . 5.500 5.174 5.043 5.235 . 0 0 "[ . 1 . 2]" 1
1354 1 59 LYS H 1 61 ALA H . . 4.510 4.179 3.909 4.400 . 0 0 "[ . 1 . 2]" 1
1355 1 59 LYS HA 1 59 LYS QE . . 5.500 3.409 2.008 4.236 . 0 0 "[ . 1 . 2]" 1
1356 1 59 LYS HA 1 59 LYS HG2 . . 4.000 3.018 2.383 3.512 . 0 0 "[ . 1 . 2]" 1
1357 1 59 LYS HA 1 59 LYS HG3 . . 3.690 2.477 2.058 3.579 . 0 0 "[ . 1 . 2]" 1
1358 1 59 LYS HA 1 62 LYS H . . 4.340 3.603 3.466 3.780 . 0 0 "[ . 1 . 2]" 1
1359 1 59 LYS HA 1 62 LYS QB . . 3.510 3.050 2.844 3.335 . 0 0 "[ . 1 . 2]" 1
1360 1 59 LYS QB 1 59 LYS QE . . 4.260 3.125 2.182 3.789 . 0 0 "[ . 1 . 2]" 1
1361 1 59 LYS QB 1 60 ILE H . . 3.470 2.279 2.178 2.421 . 0 0 "[ . 1 . 2]" 1
1362 1 59 LYS QD 1 59 LYS HG3 . . 2.400 2.431 2.193 2.570 0.170 4 0 "[ . 1 . 2]" 1
1363 1 59 LYS QE 1 59 LYS HG2 . . 3.680 2.771 2.007 3.263 . 0 0 "[ . 1 . 2]" 1
1364 1 60 ILE H 1 60 ILE HB . . 3.260 2.388 2.279 2.477 . 0 0 "[ . 1 . 2]" 1
1365 1 60 ILE H 1 60 ILE MD . . 4.510 3.421 3.121 3.733 . 0 0 "[ . 1 . 2]" 1
1366 1 60 ILE H 1 60 ILE HG12 . . 3.620 3.379 3.087 3.635 0.015 8 0 "[ . 1 . 2]" 1
1367 1 60 ILE H 1 60 ILE HG13 . . 3.430 2.087 1.943 2.285 . 0 0 "[ . 1 . 2]" 1
1368 1 60 ILE H 1 60 ILE MG . . 4.260 3.698 3.669 3.713 . 0 0 "[ . 1 . 2]" 1
1369 1 60 ILE H 1 61 ALA H . . 3.740 2.864 2.656 3.024 . 0 0 "[ . 1 . 2]" 1
1370 1 60 ILE H 1 62 LYS H . . 4.620 4.318 4.060 4.644 0.024 11 0 "[ . 1 . 2]" 1
1371 1 60 ILE HA 1 60 ILE MD . . 3.830 3.797 3.707 3.857 0.027 15 0 "[ . 1 . 2]" 1
1372 1 60 ILE HA 1 60 ILE HG12 . . 3.430 2.512 2.337 2.687 . 0 0 "[ . 1 . 2]" 1
1373 1 60 ILE HA 1 60 ILE HG13 . . 3.600 2.859 2.589 3.062 . 0 0 "[ . 1 . 2]" 1
1374 1 60 ILE HA 1 60 ILE MG . . 3.120 2.467 2.380 2.583 . 0 0 "[ . 1 . 2]" 1
1375 1 60 ILE HA 1 62 LYS H . . 5.500 4.253 3.818 4.726 . 0 0 "[ . 1 . 2]" 1
1376 1 60 ILE HA 1 63 LYS H . . 3.730 3.092 2.868 3.381 . 0 0 "[ . 1 . 2]" 1
1377 1 60 ILE HA 1 63 LYS QB . . 2.890 2.167 1.979 2.365 . 0 0 "[ . 1 . 2]" 1
1378 1 60 ILE HA 1 63 LYS HD2 . . 4.350 2.691 2.077 4.707 0.357 17 0 "[ . 1 . 2]" 1
1379 1 60 ILE HA 1 63 LYS QE . . 4.940 2.388 2.047 2.546 . 0 0 "[ . 1 . 2]" 1
1380 1 60 ILE HA 1 64 ASN H . . 4.350 3.960 3.715 4.267 . 0 0 "[ . 1 . 2]" 1
1381 1 60 ILE HB 1 60 ILE MD . . 3.720 2.334 2.218 2.442 . 0 0 "[ . 1 . 2]" 1
1382 1 60 ILE HB 1 61 ALA H . . 3.930 2.666 2.481 2.928 . 0 0 "[ . 1 . 2]" 1
1383 1 60 ILE MD 1 60 ILE MG . . 3.040 1.979 1.861 2.132 . 0 0 "[ . 1 . 2]" 1
1384 1 60 ILE MD 1 61 ALA H . . 5.500 4.560 4.293 4.875 . 0 0 "[ . 1 . 2]" 1
1385 1 60 ILE MD 1 63 LYS QE . . 4.820 4.810 4.636 4.882 0.062 20 0 "[ . 1 . 2]" 1
1386 1 60 ILE MD 1 64 ASN HD22 . . 5.500 4.756 4.304 5.146 . 0 0 "[ . 1 . 2]" 1
1387 1 60 ILE HG12 1 60 ILE MG . . 3.100 2.405 2.272 2.548 . 0 0 "[ . 1 . 2]" 1
1388 1 60 ILE HG12 1 61 ALA H . . 5.340 5.086 4.982 5.203 . 0 0 "[ . 1 . 2]" 1
1389 1 60 ILE HG12 1 63 LYS QB . . 4.320 4.034 3.863 4.333 0.013 11 0 "[ . 1 . 2]" 1
1390 1 60 ILE HG13 1 60 ILE MG . . 3.590 3.223 3.207 3.240 . 0 0 "[ . 1 . 2]" 1
1391 1 60 ILE MG 1 61 ALA H . . 4.280 3.326 2.892 3.544 . 0 0 "[ . 1 . 2]" 1
1392 1 60 ILE MG 1 61 ALA HA . . 4.650 3.459 3.051 3.638 . 0 0 "[ . 1 . 2]" 1
1393 1 60 ILE MG 1 61 ALA MB . . 4.810 4.127 3.786 4.288 . 0 0 "[ . 1 . 2]" 1
1394 1 60 ILE MG 1 63 LYS H . . 5.500 4.289 4.051 4.616 . 0 0 "[ . 1 . 2]" 1
1395 1 60 ILE MG 1 63 LYS QB . . 4.310 3.169 2.884 3.477 . 0 0 "[ . 1 . 2]" 1
1396 1 60 ILE MG 1 63 LYS QE . . 4.320 4.295 4.097 4.351 0.031 16 0 "[ . 1 . 2]" 1
1397 1 60 ILE MG 1 64 ASN H . . 4.370 3.485 3.305 3.723 . 0 0 "[ . 1 . 2]" 1
1398 1 60 ILE MG 1 64 ASN HD21 . . 3.780 1.972 1.810 2.206 . 0 0 "[ . 1 . 2]" 1
1399 1 60 ILE MG 1 64 ASN HD22 . . 3.660 2.240 1.971 2.593 . 0 0 "[ . 1 . 2]" 1
1400 1 61 ALA H 1 61 ALA MB . . 3.330 2.050 1.940 2.144 . 0 0 "[ . 1 . 2]" 1
1401 1 61 ALA H 1 62 LYS H . . 3.880 2.892 2.817 3.039 . 0 0 "[ . 1 . 2]" 1
1402 1 61 ALA H 1 62 LYS QB . . 4.520 4.585 4.545 4.645 0.125 11 0 "[ . 1 . 2]" 1
1403 1 61 ALA H 1 63 LYS H . . 5.160 4.258 3.929 4.408 . 0 0 "[ . 1 . 2]" 1
1404 1 61 ALA H 1 64 ASN HD21 . . 4.560 4.500 3.973 4.569 0.009 8 0 "[ . 1 . 2]" 1
1405 1 61 ALA HA 1 64 ASN H . . 3.990 3.459 3.241 3.652 . 0 0 "[ . 1 . 2]" 1
1406 1 61 ALA HA 1 64 ASN HB2 . . 3.550 2.579 2.401 2.833 . 0 0 "[ . 1 . 2]" 1
1407 1 61 ALA HA 1 64 ASN HB3 . . 4.500 4.080 3.878 4.365 . 0 0 "[ . 1 . 2]" 1
1408 1 61 ALA HA 1 64 ASN HD21 . . 4.720 3.399 2.756 3.748 . 0 0 "[ . 1 . 2]" 1
1409 1 61 ALA HA 1 64 ASN HD22 . . 5.250 4.685 4.264 5.059 . 0 0 "[ . 1 . 2]" 1
1410 1 61 ALA HA 1 65 ALA H . . 4.350 4.371 4.328 4.401 0.051 16 0 "[ . 1 . 2]" 1
1411 1 61 ALA MB 1 62 LYS H . . 3.780 2.565 2.194 2.893 . 0 0 "[ . 1 . 2]" 1
1412 1 61 ALA MB 1 63 LYS H . . 5.410 4.572 4.231 4.775 . 0 0 "[ . 1 . 2]" 1
1413 1 61 ALA MB 1 64 ASN H . . 5.250 4.590 4.386 4.767 . 0 0 "[ . 1 . 2]" 1
1414 1 61 ALA MB 1 64 ASN HB3 . . 5.500 5.211 4.924 5.511 0.011 15 0 "[ . 1 . 2]" 1
1415 1 62 LYS H 1 62 LYS QB . . 3.080 2.188 2.094 2.235 . 0 0 "[ . 1 . 2]" 1
1416 1 62 LYS H 1 62 LYS QG . . 5.140 3.913 3.777 3.950 . 0 0 "[ . 1 . 2]" 1
1417 1 62 LYS H 1 63 LYS H . . 3.760 2.665 2.444 2.924 . 0 0 "[ . 1 . 2]" 1
1418 1 62 LYS H 1 63 LYS QB . . 5.500 4.381 4.159 4.618 . 0 0 "[ . 1 . 2]" 1
1419 1 62 LYS H 1 64 ASN H . . 5.120 4.065 3.797 4.290 . 0 0 "[ . 1 . 2]" 1
1420 1 62 LYS H 1 65 ALA H . . 5.460 4.535 4.421 4.594 . 0 0 "[ . 1 . 2]" 1
1421 1 62 LYS HA 1 62 LYS QD . . 4.890 3.823 3.577 4.159 . 0 0 "[ . 1 . 2]" 1
1422 1 62 LYS HA 1 62 LYS QG . . 3.550 2.262 2.095 2.505 . 0 0 "[ . 1 . 2]" 1
1423 1 62 LYS HA 1 65 ALA H . . 3.930 3.119 2.979 3.224 . 0 0 "[ . 1 . 2]" 1
1424 1 62 LYS HA 1 65 ALA MB . . 3.260 2.307 2.073 2.567 . 0 0 "[ . 1 . 2]" 1
1425 1 62 LYS HA 1 66 ALA H . . 5.280 4.273 3.992 4.535 . 0 0 "[ . 1 . 2]" 1
1426 1 62 LYS QB 1 62 LYS QD . . 3.110 2.231 2.062 2.420 . 0 0 "[ . 1 . 2]" 1
1427 1 62 LYS QB 1 62 LYS HE3 . . 4.790 2.980 2.169 3.378 . 0 0 "[ . 1 . 2]" 1
1428 1 62 LYS QB 1 63 LYS H . . 3.590 2.600 2.443 2.866 . 0 0 "[ . 1 . 2]" 1
1429 1 62 LYS QD 1 63 LYS QG . . 4.440 3.444 3.053 4.046 . 0 0 "[ . 1 . 2]" 1
1430 1 62 LYS QD 1 66 ALA MB . . 5.500 3.885 3.435 4.457 . 0 0 "[ . 1 . 2]" 1
1431 1 62 LYS HE2 1 63 LYS QE . . 4.740 4.649 4.332 4.786 0.046 20 0 "[ . 1 . 2]" 1
1432 1 62 LYS HE3 1 62 LYS QG . . 3.670 3.107 2.132 3.551 . 0 0 "[ . 1 . 2]" 1
1433 1 62 LYS HE3 1 63 LYS QE . . 4.620 4.361 3.807 4.678 0.058 7 0 "[ . 1 . 2]" 1
1434 1 62 LYS QG 1 63 LYS H . . 4.520 4.107 3.734 4.263 . 0 0 "[ . 1 . 2]" 1
1435 1 62 LYS QG 1 66 ALA H . . 5.050 4.080 3.584 4.576 . 0 0 "[ . 1 . 2]" 1
1436 1 63 LYS H 1 63 LYS QB . . 3.050 2.139 2.056 2.226 . 0 0 "[ . 1 . 2]" 1
1437 1 63 LYS H 1 63 LYS QG . . 4.520 2.906 2.657 3.493 . 0 0 "[ . 1 . 2]" 1
1438 1 63 LYS H 1 64 ASN H . . 4.010 2.749 2.592 2.866 . 0 0 "[ . 1 . 2]" 1
1439 1 63 LYS H 1 65 ALA H . . 4.370 3.904 3.785 4.034 . 0 0 "[ . 1 . 2]" 1
1440 1 63 LYS HA 1 63 LYS QE . . 5.500 3.742 3.263 4.383 . 0 0 "[ . 1 . 2]" 1
1441 1 63 LYS HA 1 63 LYS QG . . 3.710 2.128 1.998 2.219 . 0 0 "[ . 1 . 2]" 1
1442 1 63 LYS HA 1 65 ALA H . . 4.550 4.052 3.942 4.242 . 0 0 "[ . 1 . 2]" 1
1443 1 63 LYS HA 1 66 ALA H . . 3.950 3.456 3.323 3.635 . 0 0 "[ . 1 . 2]" 1
1444 1 63 LYS HA 1 66 ALA MB . . 3.430 2.941 2.626 3.183 . 0 0 "[ . 1 . 2]" 1
1445 1 63 LYS QB 1 63 LYS HD2 . . 2.880 2.220 2.005 3.457 0.577 17 1 "[ . 1 . + 2]" 1
1446 1 63 LYS QB 1 63 LYS QE . . 3.810 2.683 2.294 3.059 . 0 0 "[ . 1 . 2]" 1
1447 1 63 LYS QB 1 64 ASN H . . 3.410 2.761 2.622 2.877 . 0 0 "[ . 1 . 2]" 1
1448 1 63 LYS QB 1 64 ASN HA . . 4.480 3.879 3.832 3.927 . 0 0 "[ . 1 . 2]" 1
1449 1 63 LYS QB 1 65 ALA H . . 5.500 4.533 4.404 4.642 . 0 0 "[ . 1 . 2]" 1
1450 1 63 LYS HD2 1 64 ASN H . . 5.470 5.152 4.833 5.833 0.363 17 0 "[ . 1 . 2]" 1
1451 1 63 LYS QE 1 63 LYS QG . . 3.170 2.044 1.961 2.204 . 0 0 "[ . 1 . 2]" 1
1452 1 63 LYS QG 1 64 ASN H . . 5.330 4.483 4.410 4.627 . 0 0 "[ . 1 . 2]" 1
1453 1 64 ASN H 1 64 ASN HB2 . . 3.310 2.145 2.079 2.213 . 0 0 "[ . 1 . 2]" 1
1454 1 64 ASN H 1 64 ASN HB3 . . 3.860 3.440 3.381 3.486 . 0 0 "[ . 1 . 2]" 1
1455 1 64 ASN H 1 64 ASN HD21 . . 5.500 2.302 1.919 2.709 . 0 0 "[ . 1 . 2]" 1
1456 1 64 ASN H 1 64 ASN HD22 . . 5.500 3.906 3.602 4.211 . 0 0 "[ . 1 . 2]" 1
1457 1 64 ASN H 1 65 ALA H . . 2.910 2.554 2.424 2.635 . 0 0 "[ . 1 . 2]" 1
1458 1 64 ASN H 1 65 ALA HA . . 5.160 5.094 4.967 5.174 0.014 20 0 "[ . 1 . 2]" 1
1459 1 64 ASN H 1 65 ALA MB . . 4.930 4.147 4.024 4.239 . 0 0 "[ . 1 . 2]" 1
1460 1 64 ASN H 1 66 ALA H . . 4.540 4.438 4.263 4.548 0.008 1 0 "[ . 1 . 2]" 1
1461 1 64 ASN HA 1 64 ASN HD22 . . 5.500 3.872 3.735 4.108 . 0 0 "[ . 1 . 2]" 1
1462 1 64 ASN HA 1 67 GLU H . . 4.500 3.340 3.184 3.474 . 0 0 "[ . 1 . 2]" 1
1463 1 64 ASN HA 1 67 GLU HA . . 5.330 5.064 4.952 5.206 . 0 0 "[ . 1 . 2]" 1
1464 1 64 ASN HA 1 67 GLU HB2 . . 4.240 2.662 2.454 3.047 . 0 0 "[ . 1 . 2]" 1
1465 1 64 ASN HA 1 67 GLU HB3 . . 4.060 2.789 2.583 3.177 . 0 0 "[ . 1 . 2]" 1
1466 1 64 ASN HA 1 67 GLU HG2 . . 5.090 5.003 4.810 5.108 0.018 20 0 "[ . 1 . 2]" 1
1467 1 64 ASN HA 1 67 GLU HG3 . . 5.000 4.922 4.726 5.013 0.013 15 0 "[ . 1 . 2]" 1
1468 1 64 ASN HA 1 68 ALA H . . 5.330 4.079 3.894 4.333 . 0 0 "[ . 1 . 2]" 1
1469 1 64 ASN HB2 1 65 ALA H . . 4.050 3.033 2.861 3.201 . 0 0 "[ . 1 . 2]" 1
1470 1 64 ASN HB2 1 65 ALA MB . . 5.500 4.259 4.134 4.396 . 0 0 "[ . 1 . 2]" 1
1471 1 64 ASN HB3 1 65 ALA H . . 4.250 3.550 3.394 3.743 . 0 0 "[ . 1 . 2]" 1
1472 1 65 ALA H 1 65 ALA MB . . 2.990 2.120 2.052 2.175 . 0 0 "[ . 1 . 2]" 1
1473 1 65 ALA H 1 66 ALA H . . 3.480 2.724 2.573 2.805 . 0 0 "[ . 1 . 2]" 1
1474 1 65 ALA H 1 66 ALA MB . . 4.210 4.213 4.136 4.262 0.052 10 0 "[ . 1 . 2]" 1
1475 1 65 ALA H 1 68 ALA H . . 5.500 4.867 4.658 5.098 . 0 0 "[ . 1 . 2]" 1
1476 1 65 ALA HA 1 68 ALA H . . 4.340 3.694 3.534 3.904 . 0 0 "[ . 1 . 2]" 1
1477 1 65 ALA HA 1 68 ALA MB . . 3.470 3.047 2.813 3.373 . 0 0 "[ . 1 . 2]" 1
1478 1 65 ALA MB 1 66 ALA H . . 3.220 2.353 2.247 2.458 . 0 0 "[ . 1 . 2]" 1
1479 1 65 ALA MB 1 67 GLU H . . 4.420 4.395 4.275 4.472 0.052 20 0 "[ . 1 . 2]" 1
1480 1 65 ALA MB 1 68 ALA H . . 4.970 4.833 4.663 5.005 0.035 15 0 "[ . 1 . 2]" 1
1481 1 66 ALA H 1 66 ALA MB . . 2.950 1.978 1.932 2.161 . 0 0 "[ . 1 . 2]" 1
1482 1 66 ALA H 1 67 GLU H . . 3.730 2.693 2.597 2.773 . 0 0 "[ . 1 . 2]" 1
1483 1 66 ALA H 1 67 GLU HB2 . . 5.500 4.712 4.601 4.893 . 0 0 "[ . 1 . 2]" 1
1484 1 66 ALA H 1 68 ALA H . . 4.710 4.561 4.278 4.791 0.081 20 0 "[ . 1 . 2]" 1
1485 1 66 ALA HA 1 69 MET H . . 3.810 3.399 3.120 3.773 . 0 0 "[ . 1 . 2]" 1
1486 1 66 ALA HA 1 69 MET HB2 . . 3.630 3.263 3.032 3.647 0.017 20 0 "[ . 1 . 2]" 1
1487 1 66 ALA HA 1 69 MET HB3 . . 4.100 2.364 2.011 2.657 . 0 0 "[ . 1 . 2]" 1
1488 1 66 ALA HA 1 69 MET ME . . 5.220 4.850 4.671 5.040 . 0 0 "[ . 1 . 2]" 1
1489 1 66 ALA HA 1 69 MET HG2 . . 4.900 3.976 3.750 4.180 . 0 0 "[ . 1 . 2]" 1
1490 1 66 ALA HA 1 69 MET HG3 . . 5.430 4.552 4.077 5.216 . 0 0 "[ . 1 . 2]" 1
1491 1 66 ALA MB 1 67 GLU H . . 3.550 2.712 2.636 2.831 . 0 0 "[ . 1 . 2]" 1
1492 1 67 GLU H 1 67 GLU HB2 . . 3.240 2.213 2.106 2.428 . 0 0 "[ . 1 . 2]" 1
1493 1 67 GLU H 1 67 GLU HB3 . . 3.400 2.785 2.525 2.945 . 0 0 "[ . 1 . 2]" 1
1494 1 67 GLU H 1 68 ALA H . . 3.820 2.965 2.801 3.179 . 0 0 "[ . 1 . 2]" 1
1495 1 67 GLU H 1 68 ALA MB . . 4.760 4.426 4.270 4.592 . 0 0 "[ . 1 . 2]" 1
1496 1 67 GLU H 1 70 LEU MD1 . . 5.500 3.544 3.317 3.749 . 0 0 "[ . 1 . 2]" 1
1497 1 67 GLU HA 1 67 GLU HB2 . . 2.850 2.605 2.500 2.682 . 0 0 "[ . 1 . 2]" 1
1498 1 67 GLU HA 1 67 GLU HG2 . . 3.080 2.858 2.707 2.974 . 0 0 "[ . 1 . 2]" 1
1499 1 67 GLU HA 1 67 GLU HG3 . . 3.960 2.415 2.211 2.694 . 0 0 "[ . 1 . 2]" 1
1500 1 67 GLU HA 1 69 MET H . . 5.500 4.505 4.262 4.921 . 0 0 "[ . 1 . 2]" 1
1501 1 67 GLU HA 1 70 LEU H . . 4.420 3.462 3.320 3.638 . 0 0 "[ . 1 . 2]" 1
1502 1 67 GLU HA 1 70 LEU HB2 . . 4.280 3.028 2.967 3.126 . 0 0 "[ . 1 . 2]" 1
1503 1 67 GLU HA 1 70 LEU HB3 . . 4.630 4.648 4.615 4.703 0.073 20 0 "[ . 1 . 2]" 1
1504 1 67 GLU HA 1 70 LEU MD1 . . 3.120 1.963 1.878 2.064 . 0 0 "[ . 1 . 2]" 1
1505 1 67 GLU HA 1 70 LEU MD2 . . 5.500 4.692 4.472 4.810 . 0 0 "[ . 1 . 2]" 1
1506 1 67 GLU HA 1 70 LEU HG . . 4.430 3.902 3.621 4.465 0.035 19 0 "[ . 1 . 2]" 1
1507 1 67 GLU HA 1 71 LEU H . . 4.840 4.100 3.873 4.381 . 0 0 "[ . 1 . 2]" 1
1508 1 67 GLU HA 1 71 LEU QD . . 4.920 3.499 2.868 3.915 . 0 0 "[ . 1 . 2]" 1
1509 1 67 GLU HB2 1 68 ALA H . . 3.720 3.553 3.319 3.728 0.008 12 0 "[ . 1 . 2]" 1
1510 1 67 GLU HB2 1 70 LEU MD1 . . 4.310 4.003 3.773 4.162 . 0 0 "[ . 1 . 2]" 1
1511 1 67 GLU HB3 1 67 GLU HG2 . . 2.620 2.510 2.412 2.628 0.008 17 0 "[ . 1 . 2]" 1
1512 1 67 GLU HB3 1 68 ALA H . . 3.710 2.300 2.097 2.505 . 0 0 "[ . 1 . 2]" 1
1513 1 67 GLU HB3 1 68 ALA HA . . 5.170 3.981 3.817 4.140 . 0 0 "[ . 1 . 2]" 1
1514 1 67 GLU HB3 1 68 ALA MB . . 4.760 3.721 3.556 3.832 . 0 0 "[ . 1 . 2]" 1
1515 1 67 GLU HB3 1 70 LEU MD1 . . 5.390 4.629 4.423 4.732 . 0 0 "[ . 1 . 2]" 1
1516 1 67 GLU HG2 1 68 ALA H . . 4.080 3.962 3.492 4.093 0.013 16 0 "[ . 1 . 2]" 1
1517 1 67 GLU HG2 1 71 LEU HB2 . . 4.370 4.220 3.798 4.405 0.035 18 0 "[ . 1 . 2]" 1
1518 1 67 GLU HG2 1 71 LEU QD . . 4.490 2.035 1.767 2.432 . 0 0 "[ . 1 . 2]" 1
1519 1 67 GLU HG3 1 68 ALA H . . 5.330 4.795 4.573 4.988 . 0 0 "[ . 1 . 2]" 1
1520 1 67 GLU HG3 1 70 LEU MD1 . . 4.530 3.548 3.297 3.904 . 0 0 "[ . 1 . 2]" 1
1521 1 67 GLU HG3 1 71 LEU QD . . 4.310 3.165 2.587 3.525 . 0 0 "[ . 1 . 2]" 1
1522 1 68 ALA H 1 68 ALA MB . . 3.130 2.047 1.934 2.172 . 0 0 "[ . 1 . 2]" 1
1523 1 68 ALA H 1 69 MET H . . 3.480 2.823 2.625 3.105 . 0 0 "[ . 1 . 2]" 1
1524 1 68 ALA H 1 69 MET HA . . 5.500 5.301 5.147 5.502 0.002 20 0 "[ . 1 . 2]" 1
1525 1 68 ALA H 1 69 MET HB3 . . 4.980 4.769 4.587 4.981 0.001 14 0 "[ . 1 . 2]" 1
1526 1 68 ALA H 1 70 LEU H . . 4.610 4.351 4.093 4.529 . 0 0 "[ . 1 . 2]" 1
1527 1 68 ALA H 1 70 LEU MD1 . . 5.500 4.809 4.506 4.937 . 0 0 "[ . 1 . 2]" 1
1528 1 68 ALA HA 1 70 LEU H . . 5.090 4.530 4.083 4.846 . 0 0 "[ . 1 . 2]" 1
1529 1 68 ALA HA 1 71 LEU H . . 4.620 3.308 3.169 3.524 . 0 0 "[ . 1 . 2]" 1
1530 1 68 ALA HA 1 71 LEU HB2 . . 3.990 2.250 2.049 2.517 . 0 0 "[ . 1 . 2]" 1
1531 1 68 ALA HA 1 71 LEU QD . . 3.550 2.772 2.039 3.507 . 0 0 "[ . 1 . 2]" 1
1532 1 68 ALA HA 1 72 GLN QB . . 5.040 4.537 4.190 4.933 . 0 0 "[ . 1 . 2]" 1
1533 1 68 ALA MB 1 69 MET H . . 3.380 2.578 2.258 2.762 . 0 0 "[ . 1 . 2]" 1
1534 1 68 ALA MB 1 69 MET HA . . 4.910 3.729 3.592 3.805 . 0 0 "[ . 1 . 2]" 1
1535 1 68 ALA MB 1 69 MET HB2 . . 4.810 4.211 4.069 4.309 . 0 0 "[ . 1 . 2]" 1
1536 1 68 ALA MB 1 71 LEU QD . . 4.710 3.896 3.402 4.471 . 0 0 "[ . 1 . 2]" 1
1537 1 68 ALA MB 1 72 GLN QB . . 4.830 3.989 3.610 4.402 . 0 0 "[ . 1 . 2]" 1
1538 1 69 MET H 1 69 MET HB2 . . 3.720 2.552 2.444 2.727 . 0 0 "[ . 1 . 2]" 1
1539 1 69 MET H 1 69 MET HB3 . . 3.410 2.332 2.172 2.432 . 0 0 "[ . 1 . 2]" 1
1540 1 69 MET H 1 69 MET HG3 . . 5.340 4.341 4.288 4.410 . 0 0 "[ . 1 . 2]" 1
1541 1 69 MET H 1 70 LEU H . . 3.690 2.848 2.643 3.103 . 0 0 "[ . 1 . 2]" 1
1542 1 69 MET HA 1 69 MET ME . . 3.600 3.135 2.472 3.497 . 0 0 "[ . 1 . 2]" 1
1543 1 69 MET HA 1 71 LEU H . . 5.350 4.382 4.013 4.930 . 0 0 "[ . 1 . 2]" 1
1544 1 69 MET HA 1 72 GLN H . . 3.920 3.398 3.199 3.780 . 0 0 "[ . 1 . 2]" 1
1545 1 69 MET HA 1 72 GLN QB . . 3.210 2.905 2.683 3.134 . 0 0 "[ . 1 . 2]" 1
1546 1 69 MET HA 1 72 GLN HE22 . . 5.500 3.650 3.252 4.796 . 0 0 "[ . 1 . 2]" 1
1547 1 69 MET HA 1 72 GLN HG2 . . 4.970 3.093 2.530 3.283 . 0 0 "[ . 1 . 2]" 1
1548 1 69 MET HA 1 72 GLN HG3 . . 4.790 4.638 4.065 4.810 0.020 14 0 "[ . 1 . 2]" 1
1549 1 69 MET HA 1 73 LEU H . . 4.790 4.039 3.832 4.263 . 0 0 "[ . 1 . 2]" 1
1550 1 69 MET HA 1 73 LEU QD . . 5.500 3.883 3.190 4.268 . 0 0 "[ . 1 . 2]" 1
1551 1 69 MET HB3 1 70 LEU H . . 4.630 2.532 2.356 2.763 . 0 0 "[ . 1 . 2]" 1
1552 1 69 MET ME 1 72 GLN HE21 . . 4.680 3.296 2.144 4.696 0.016 10 0 "[ . 1 . 2]" 1
1553 1 69 MET ME 1 72 GLN HE22 . . 4.920 3.003 2.537 3.836 . 0 0 "[ . 1 . 2]" 1
1554 1 69 MET HG3 1 70 LEU H . . 3.510 3.383 2.978 3.542 0.032 12 0 "[ . 1 . 2]" 1
1555 1 69 MET HG3 1 70 LEU HG . . 3.700 3.396 3.079 3.826 0.126 16 0 "[ . 1 . 2]" 1
1556 1 69 MET HG3 1 73 LEU QD . . 2.990 2.260 1.970 2.583 . 0 0 "[ . 1 . 2]" 1
1557 1 70 LEU H 1 70 LEU HB2 . . 3.440 2.547 2.391 2.656 . 0 0 "[ . 1 . 2]" 1
1558 1 70 LEU H 1 70 LEU HB3 . . 4.160 3.544 3.531 3.559 . 0 0 "[ . 1 . 2]" 1
1559 1 70 LEU H 1 70 LEU MD1 . . 4.340 2.942 2.658 3.150 . 0 0 "[ . 1 . 2]" 1
1560 1 70 LEU H 1 70 LEU MD2 . . 4.730 3.641 3.473 4.037 . 0 0 "[ . 1 . 2]" 1
1561 1 70 LEU H 1 70 LEU HG . . 3.490 2.109 1.930 2.656 . 0 0 "[ . 1 . 2]" 1
1562 1 70 LEU H 1 71 LEU H . . 4.030 2.606 2.452 2.801 . 0 0 "[ . 1 . 2]" 1
1563 1 70 LEU H 1 72 GLN H . . 4.050 4.077 3.927 4.119 0.069 12 0 "[ . 1 . 2]" 1
1564 1 70 LEU H 1 72 GLN QB . . 5.500 5.172 4.925 5.330 . 0 0 "[ . 1 . 2]" 1
1565 1 70 LEU HA 1 70 LEU MD1 . . 4.400 3.931 3.806 3.957 . 0 0 "[ . 1 . 2]" 1
1566 1 70 LEU HA 1 70 LEU MD2 . . 3.120 2.688 2.545 2.878 . 0 0 "[ . 1 . 2]" 1
1567 1 70 LEU HA 1 70 LEU HG . . 3.300 2.819 2.552 2.902 . 0 0 "[ . 1 . 2]" 1
1568 1 70 LEU HA 1 71 LEU HA . . 5.110 4.768 4.721 4.844 . 0 0 "[ . 1 . 2]" 1
1569 1 70 LEU HA 1 72 GLN H . . 5.500 4.327 4.226 4.658 . 0 0 "[ . 1 . 2]" 1
1570 1 70 LEU HA 1 73 LEU H . . 4.430 3.209 3.065 3.449 . 0 0 "[ . 1 . 2]" 1
1571 1 70 LEU HA 1 73 LEU HB2 . . 3.970 2.287 2.060 2.566 . 0 0 "[ . 1 . 2]" 1
1572 1 70 LEU HA 1 73 LEU HB3 . . 3.900 3.749 3.402 3.966 0.066 10 0 "[ . 1 . 2]" 1
1573 1 70 LEU HA 1 73 LEU QD . . 3.600 2.589 2.257 2.775 . 0 0 "[ . 1 . 2]" 1
1574 1 70 LEU HA 1 73 LEU HG . . 5.370 4.161 3.235 5.211 . 0 0 "[ . 1 . 2]" 1
1575 1 70 LEU HA 1 74 GLY H . . 4.760 4.050 3.813 4.293 . 0 0 "[ . 1 . 2]" 1
1576 1 70 LEU HA 1 75 TYR H . . 4.850 3.871 3.623 4.068 . 0 0 "[ . 1 . 2]" 1
1577 1 70 LEU HA 1 75 TYR HB2 . . 4.810 3.082 2.819 3.522 . 0 0 "[ . 1 . 2]" 1
1578 1 70 LEU HA 1 75 TYR HB3 . . 5.500 4.599 4.350 5.066 . 0 0 "[ . 1 . 2]" 1
1579 1 70 LEU HA 1 75 TYR QD . . 4.060 3.435 2.229 4.023 . 0 0 "[ . 1 . 2]" 1
1580 1 70 LEU HA 1 75 TYR QE . . 5.500 4.848 3.981 5.261 . 0 0 "[ . 1 . 2]" 1
1581 1 70 LEU HB2 1 70 LEU MD1 . . 3.320 2.032 1.930 2.209 . 0 0 "[ . 1 . 2]" 1
1582 1 70 LEU HB2 1 70 LEU MD2 . . 3.600 3.112 3.046 3.154 . 0 0 "[ . 1 . 2]" 1
1583 1 70 LEU HB2 1 71 LEU H . . 3.990 2.804 2.466 3.126 . 0 0 "[ . 1 . 2]" 1
1584 1 70 LEU HB2 1 75 TYR HB2 . . 5.410 3.694 3.386 4.088 . 0 0 "[ . 1 . 2]" 1
1585 1 70 LEU HB2 1 75 TYR HB3 . . 5.310 4.719 4.249 5.314 0.004 20 0 "[ . 1 . 2]" 1
1586 1 70 LEU HB2 1 75 TYR QD . . 5.500 5.185 4.537 5.500 . 0 0 "[ . 1 . 2]" 1
1587 1 70 LEU HB2 1 76 LYS H . . 5.500 4.733 4.264 5.145 . 0 0 "[ . 1 . 2]" 1
1588 1 70 LEU HB3 1 70 LEU MD1 . . 3.230 2.762 2.624 2.898 . 0 0 "[ . 1 . 2]" 1
1589 1 70 LEU HB3 1 70 LEU MD2 . . 3.400 2.031 1.983 2.081 . 0 0 "[ . 1 . 2]" 1
1590 1 70 LEU HB3 1 71 LEU H . . 4.550 3.921 3.527 4.166 . 0 0 "[ . 1 . 2]" 1
1591 1 70 LEU HB3 1 75 TYR HB2 . . 4.520 2.207 1.995 2.459 . 0 0 "[ . 1 . 2]" 1
1592 1 70 LEU HB3 1 75 TYR HB3 . . 4.830 3.152 2.793 3.682 . 0 0 "[ . 1 . 2]" 1
1593 1 70 LEU HB3 1 75 TYR QD . . 5.250 3.818 3.206 4.121 . 0 0 "[ . 1 . 2]" 1
1594 1 70 LEU HB3 1 76 LYS H . . 5.060 4.255 3.706 4.605 . 0 0 "[ . 1 . 2]" 1
1595 1 70 LEU MD1 1 71 LEU H . . 5.500 4.111 3.715 4.321 . 0 0 "[ . 1 . 2]" 1
1596 1 70 LEU MD1 1 75 TYR HB2 . . 5.500 4.538 4.228 4.858 . 0 0 "[ . 1 . 2]" 1
1597 1 70 LEU MD1 1 75 TYR QD . . 5.210 5.176 4.901 5.242 0.032 17 0 "[ . 1 . 2]" 1
1598 1 70 LEU MD2 1 71 LEU H . . 5.500 4.966 4.866 5.110 . 0 0 "[ . 1 . 2]" 1
1599 1 70 LEU MD2 1 73 LEU QD . . 5.500 3.052 2.794 3.354 . 0 0 "[ . 1 . 2]" 1
1600 1 70 LEU MD2 1 75 TYR HB2 . . 4.360 3.031 2.702 3.298 . 0 0 "[ . 1 . 2]" 1
1601 1 70 LEU MD2 1 75 TYR HB3 . . 4.370 3.364 3.060 3.662 . 0 0 "[ . 1 . 2]" 1
1602 1 70 LEU MD2 1 75 TYR QD . . 4.180 3.271 2.911 3.490 . 0 0 "[ . 1 . 2]" 1
1603 1 70 LEU MD2 1 75 TYR QE . . 5.320 4.270 3.839 4.437 . 0 0 "[ . 1 . 2]" 1
1604 1 71 LEU H 1 71 LEU HB2 . . 3.260 2.133 2.051 2.297 . 0 0 "[ . 1 . 2]" 1
1605 1 71 LEU H 1 71 LEU HB3 . . 3.480 3.416 3.359 3.507 0.027 14 0 "[ . 1 . 2]" 1
1606 1 71 LEU H 1 71 LEU QD . . 4.510 2.702 1.900 3.118 . 0 0 "[ . 1 . 2]" 1
1607 1 71 LEU H 1 71 LEU HG . . 3.310 3.345 3.300 3.463 0.153 20 0 "[ . 1 . 2]" 1
1608 1 71 LEU H 1 72 GLN H . . 3.740 2.624 2.480 2.873 . 0 0 "[ . 1 . 2]" 1
1609 1 71 LEU H 1 72 GLN QB . . 5.110 4.367 4.228 4.610 . 0 0 "[ . 1 . 2]" 1
1610 1 71 LEU H 1 73 LEU QD . . 5.500 5.078 4.739 5.256 . 0 0 "[ . 1 . 2]" 1
1611 1 71 LEU HA 1 71 LEU QD . . 3.170 2.469 1.900 2.784 . 0 0 "[ . 1 . 2]" 1
1612 1 71 LEU HA 1 71 LEU HG . . 3.820 2.677 2.218 3.714 . 0 0 "[ . 1 . 2]" 1
1613 1 71 LEU HA 1 75 TYR H . . 3.850 3.413 3.042 3.752 . 0 0 "[ . 1 . 2]" 1
1614 1 71 LEU HA 1 75 TYR HB2 . . 5.500 4.494 4.166 4.733 . 0 0 "[ . 1 . 2]" 1
1615 1 71 LEU HA 1 76 LYS H . . 3.470 2.632 2.478 2.922 . 0 0 "[ . 1 . 2]" 1
1616 1 71 LEU HB2 1 72 GLN H . . 3.710 2.941 2.730 3.069 . 0 0 "[ . 1 . 2]" 1
1617 1 71 LEU HB2 1 72 GLN HA . . 4.980 4.765 4.528 4.906 . 0 0 "[ . 1 . 2]" 1
1618 1 71 LEU HB2 1 72 GLN QB . . 5.370 4.303 4.105 4.408 . 0 0 "[ . 1 . 2]" 1
1619 1 71 LEU HB3 1 71 LEU QD . . 3.190 1.991 1.956 2.165 . 0 0 "[ . 1 . 2]" 1
1620 1 71 LEU HB3 1 72 GLN H . . 3.660 3.416 3.227 3.615 . 0 0 "[ . 1 . 2]" 1
1621 1 71 LEU HB3 1 72 GLN HA . . 4.890 4.123 4.017 4.278 . 0 0 "[ . 1 . 2]" 1
1622 1 71 LEU HB3 1 72 GLN QB . . 5.500 4.522 4.374 4.752 . 0 0 "[ . 1 . 2]" 1
1623 1 71 LEU QD 1 72 GLN H . . 5.270 4.110 3.893 4.233 . 0 0 "[ . 1 . 2]" 1
1624 1 71 LEU QD 1 76 LYS H . . 4.980 3.626 2.865 3.979 . 0 0 "[ . 1 . 2]" 1
1625 1 71 LEU QD 1 76 LYS HA . . 4.390 4.106 3.611 4.246 . 0 0 "[ . 1 . 2]" 1
1626 1 71 LEU QD 1 76 LYS HB2 . . 4.820 3.040 2.056 3.510 . 0 0 "[ . 1 . 2]" 1
1627 1 71 LEU QD 1 76 LYS HB3 . . 3.060 2.485 1.820 2.737 . 0 0 "[ . 1 . 2]" 1
1628 1 71 LEU QD 1 76 LYS QD . . 4.340 3.179 2.556 3.638 . 0 0 "[ . 1 . 2]" 1
1629 1 71 LEU QD 1 77 ALA H . . 5.000 3.839 3.536 3.968 . 0 0 "[ . 1 . 2]" 1
1630 1 71 LEU QD 1 77 ALA HA . . 4.200 2.392 2.043 2.528 . 0 0 "[ . 1 . 2]" 1
1631 1 71 LEU QD 1 77 ALA MB . . 3.490 3.398 3.235 3.468 . 0 0 "[ . 1 . 2]" 1
1632 1 71 LEU QD 1 78 SER H . . 5.500 5.141 4.957 5.329 . 0 0 "[ . 1 . 2]" 1
1633 1 71 LEU HG 1 72 GLN H . . 4.940 4.973 4.921 4.998 0.058 16 0 "[ . 1 . 2]" 1
1634 1 72 GLN H 1 72 GLN QB . . 2.880 2.061 2.023 2.094 . 0 0 "[ . 1 . 2]" 1
1635 1 72 GLN H 1 72 GLN HE21 . . 5.500 4.250 3.592 5.511 0.011 11 0 "[ . 1 . 2]" 1
1636 1 72 GLN H 1 72 GLN HG2 . . 3.330 3.197 2.992 3.356 0.026 14 0 "[ . 1 . 2]" 1
1637 1 72 GLN H 1 72 GLN HG3 . . 4.070 4.114 4.014 4.183 0.113 19 0 "[ . 1 . 2]" 1
1638 1 72 GLN H 1 73 LEU QD . . 5.500 4.414 3.849 4.746 . 0 0 "[ . 1 . 2]" 1
1639 1 72 GLN HA 1 72 GLN QB . . 2.790 2.171 2.170 2.176 . 0 0 "[ . 1 . 2]" 1
1640 1 72 GLN HA 1 72 GLN HG2 . . 3.740 3.769 3.708 3.796 0.056 12 0 "[ . 1 . 2]" 1
1641 1 72 GLN HA 1 72 GLN HG3 . . 3.340 3.342 3.251 3.499 0.159 1 0 "[ . 1 . 2]" 1
1642 1 72 GLN HA 1 74 GLY H . . 4.750 4.208 3.833 4.640 . 0 0 "[ . 1 . 2]" 1
1643 1 72 GLN QB 1 72 GLN HE22 . . 3.630 3.487 3.285 3.729 0.099 20 0 "[ . 1 . 2]" 1
1644 1 72 GLN QB 1 73 LEU H . . 3.880 3.304 3.124 3.515 . 0 0 "[ . 1 . 2]" 1
1645 1 72 GLN QB 1 73 LEU HA . . 4.630 4.698 4.654 4.755 0.125 11 0 "[ . 1 . 2]" 1
1646 1 72 GLN QB 1 73 LEU QD . . 4.470 4.013 3.546 4.330 . 0 0 "[ . 1 . 2]" 1
1647 1 72 GLN QB 1 74 GLY H . . 5.500 5.028 4.737 5.296 . 0 0 "[ . 1 . 2]" 1
1648 1 72 GLN HG2 1 73 LEU H . . 3.970 2.345 2.044 2.643 . 0 0 "[ . 1 . 2]" 1
1649 1 72 GLN HG2 1 73 LEU HA . . 4.970 3.281 3.068 3.589 . 0 0 "[ . 1 . 2]" 1
1650 1 72 GLN HG2 1 73 LEU HB2 . . 4.880 3.863 3.458 4.183 . 0 0 "[ . 1 . 2]" 1
1651 1 72 GLN HG2 1 73 LEU QD . . 5.100 2.331 1.853 2.834 . 0 0 "[ . 1 . 2]" 1
1652 1 72 GLN HG3 1 73 LEU HA . . 5.240 3.159 3.031 3.353 . 0 0 "[ . 1 . 2]" 1
1653 1 72 GLN HG3 1 73 LEU HB3 . . 5.500 5.445 5.271 5.558 0.058 7 0 "[ . 1 . 2]" 1
1654 1 72 GLN HG3 1 73 LEU QD . . 5.040 2.807 2.141 3.124 . 0 0 "[ . 1 . 2]" 1
1655 1 72 GLN HG3 1 73 LEU HG . . 5.500 4.524 3.599 5.474 . 0 0 "[ . 1 . 2]" 1
1656 1 73 LEU H 1 73 LEU HB2 . . 3.410 2.169 2.007 2.322 . 0 0 "[ . 1 . 2]" 1
1657 1 73 LEU H 1 73 LEU HB3 . . 3.800 3.429 3.304 3.525 . 0 0 "[ . 1 . 2]" 1
1658 1 73 LEU H 1 73 LEU QD . . 3.660 2.828 2.351 3.259 . 0 0 "[ . 1 . 2]" 1
1659 1 73 LEU H 1 74 GLY H . . 3.410 2.637 2.390 3.025 . 0 0 "[ . 1 . 2]" 1
1660 1 73 LEU H 1 75 TYR QD . . 5.500 4.112 3.812 4.396 . 0 0 "[ . 1 . 2]" 1
1661 1 73 LEU HA 1 73 LEU QD . . 2.750 2.003 1.887 2.134 . 0 0 "[ . 1 . 2]" 1
1662 1 73 LEU HA 1 73 LEU HG . . 3.510 2.889 2.634 3.035 . 0 0 "[ . 1 . 2]" 1
1663 1 73 LEU HA 1 74 GLY HA2 . . 4.950 5.143 5.120 5.172 0.222 14 0 "[ . 1 . 2]" 1
1664 1 73 LEU HA 1 75 TYR QD . . 4.850 4.276 4.035 4.534 . 0 0 "[ . 1 . 2]" 1
1665 1 73 LEU HA 1 75 TYR QE . . 5.310 4.273 3.931 4.465 . 0 0 "[ . 1 . 2]" 1
1666 1 73 LEU HB2 1 73 LEU QD . . 3.250 2.174 1.979 2.354 . 0 0 "[ . 1 . 2]" 1
1667 1 73 LEU HB2 1 74 GLY H . . 4.680 3.018 2.806 3.239 . 0 0 "[ . 1 . 2]" 1
1668 1 73 LEU HB2 1 75 TYR H . . 4.180 3.627 3.370 3.962 . 0 0 "[ . 1 . 2]" 1
1669 1 73 LEU HB2 1 75 TYR QD . . 3.640 2.546 2.124 3.154 . 0 0 "[ . 1 . 2]" 1
1670 1 73 LEU HB2 1 75 TYR QE . . 3.990 3.473 3.023 3.864 . 0 0 "[ . 1 . 2]" 1
1671 1 73 LEU HB3 1 73 LEU QD . . 2.950 2.285 2.065 2.510 . 0 0 "[ . 1 . 2]" 1
1672 1 73 LEU HB3 1 74 GLY H . . 5.000 3.499 2.825 4.025 . 0 0 "[ . 1 . 2]" 1
1673 1 73 LEU HB3 1 75 TYR QD . . 4.010 2.278 1.984 2.673 . 0 0 "[ . 1 . 2]" 1
1674 1 73 LEU HB3 1 75 TYR QE . . 3.850 2.129 1.986 2.460 . 0 0 "[ . 1 . 2]" 1
1675 1 73 LEU QD 1 74 GLY H . . 5.450 4.167 3.952 4.370 . 0 0 "[ . 1 . 2]" 1
1676 1 73 LEU QD 1 75 TYR QD . . 4.010 3.339 2.568 3.734 . 0 0 "[ . 1 . 2]" 1
1677 1 73 LEU QD 1 75 TYR QE . . 3.480 2.742 1.914 3.240 . 0 0 "[ . 1 . 2]" 1
1678 1 73 LEU HG 1 74 GLY H . . 5.500 4.887 4.579 5.299 . 0 0 "[ . 1 . 2]" 1
1679 1 73 LEU HG 1 75 TYR QD . . 5.500 4.478 3.897 5.003 . 0 0 "[ . 1 . 2]" 1
1680 1 73 LEU HG 1 75 TYR QE . . 5.500 3.884 2.211 5.352 . 0 0 "[ . 1 . 2]" 1
1681 1 74 GLY H 1 75 TYR H . . 3.420 2.033 1.854 2.350 . 0 0 "[ . 1 . 2]" 1
1682 1 74 GLY H 1 75 TYR HA . . 5.500 4.681 4.468 4.941 . 0 0 "[ . 1 . 2]" 1
1683 1 74 GLY H 1 75 TYR HB2 . . 5.500 3.853 3.655 4.128 . 0 0 "[ . 1 . 2]" 1
1684 1 74 GLY H 1 75 TYR QD . . 5.430 3.029 2.813 3.321 . 0 0 "[ . 1 . 2]" 1
1685 1 74 GLY HA2 1 75 TYR QD . . 5.500 4.372 4.034 5.134 . 0 0 "[ . 1 . 2]" 1
1686 1 75 TYR H 1 75 TYR HB2 . . 3.730 2.196 2.162 2.250 . 0 0 "[ . 1 . 2]" 1
1687 1 75 TYR H 1 75 TYR HB3 . . 3.860 3.479 3.458 3.513 . 0 0 "[ . 1 . 2]" 1
1688 1 75 TYR H 1 75 TYR QD . . 3.720 2.515 2.294 2.854 . 0 0 "[ . 1 . 2]" 1
1689 1 75 TYR HA 1 75 TYR QD . . 3.840 2.973 2.709 3.157 . 0 0 "[ . 1 . 2]" 1
1690 1 75 TYR HA 1 75 TYR QE . . 5.400 4.686 4.634 4.733 . 0 0 "[ . 1 . 2]" 1
1691 1 75 TYR HA 1 76 LYS H . . 3.370 3.473 3.432 3.549 0.179 8 0 "[ . 1 . 2]" 1
1692 1 75 TYR HB3 1 76 LYS H . . 3.920 3.910 3.748 3.976 0.056 16 0 "[ . 1 . 2]" 1
1693 1 75 TYR QD 1 76 LYS H . . 4.250 4.298 4.264 4.354 0.104 20 0 "[ . 1 . 2]" 1
1694 1 75 TYR QD 1 76 LYS QG . . 5.500 5.457 5.264 5.506 0.006 15 0 "[ . 1 . 2]" 1
1695 1 76 LYS H 1 76 LYS HB2 . . 3.510 2.673 2.450 2.885 . 0 0 "[ . 1 . 2]" 1
1696 1 76 LYS H 1 76 LYS HB3 . . 3.570 3.506 3.437 3.587 0.017 11 0 "[ . 1 . 2]" 1
1697 1 76 LYS H 1 76 LYS QD . . 5.420 4.836 4.491 5.076 . 0 0 "[ . 1 . 2]" 1
1698 1 76 LYS H 1 76 LYS QG . . 4.170 3.832 3.649 3.976 . 0 0 "[ . 1 . 2]" 1
1699 1 76 LYS H 1 77 ALA H . . 2.660 2.134 1.886 2.468 . 0 0 "[ . 1 . 2]" 1
1700 1 76 LYS H 1 77 ALA MB . . 4.890 3.425 3.275 3.602 . 0 0 "[ . 1 . 2]" 1
1701 1 76 LYS HA 1 76 LYS HB2 . . 2.990 2.914 2.893 2.948 . 0 0 "[ . 1 . 2]" 1
1702 1 76 LYS HA 1 76 LYS QD . . 4.220 3.035 2.086 3.818 . 0 0 "[ . 1 . 2]" 1
1703 1 76 LYS HA 1 76 LYS QG . . 3.540 2.063 1.954 2.370 . 0 0 "[ . 1 . 2]" 1
1704 1 76 LYS HA 1 77 ALA H . . 3.010 3.029 2.771 3.095 0.085 7 0 "[ . 1 . 2]" 1
1705 1 76 LYS HB2 1 77 ALA H . . 4.500 4.267 4.183 4.517 0.017 18 0 "[ . 1 . 2]" 1
1706 1 76 LYS HB3 1 77 ALA H . . 4.620 4.322 4.257 4.432 . 0 0 "[ . 1 . 2]" 1
1707 1 76 LYS QD 1 76 LYS QG . . 2.400 2.102 2.060 2.135 . 0 0 "[ . 1 . 2]" 1
1708 1 76 LYS QE 1 76 LYS QG . . 3.130 2.100 1.955 2.289 . 0 0 "[ . 1 . 2]" 1
1709 1 77 ALA H 1 77 ALA MB . . 3.180 2.029 1.993 2.092 . 0 0 "[ . 1 . 2]" 1
1710 1 77 ALA H 1 78 SER H . . 5.030 2.518 2.199 2.639 . 0 0 "[ . 1 . 2]" 1
1711 1 77 ALA H 1 78 SER HA . . 5.500 5.025 4.804 5.126 . 0 0 "[ . 1 . 2]" 1
1712 1 77 ALA H 1 79 THR H . . 4.720 4.211 4.032 4.387 . 0 0 "[ . 1 . 2]" 1
1713 1 77 ALA HA 1 78 SER H . . 3.570 3.634 3.601 3.642 0.072 11 0 "[ . 1 . 2]" 1
1714 1 77 ALA MB 1 78 SER H . . 4.490 2.503 2.379 2.718 . 0 0 "[ . 1 . 2]" 1
1715 1 77 ALA MB 1 78 SER HA . . 5.500 3.684 3.612 3.791 . 0 0 "[ . 1 . 2]" 1
1716 1 77 ALA MB 1 78 SER HB2 . . 4.810 4.381 3.998 5.332 0.522 9 2 "[ . +1 - . 2]" 1
1717 1 77 ALA MB 1 79 THR H . . 5.500 4.723 4.586 5.011 . 0 0 "[ . 1 . 2]" 1
1718 1 78 SER H 1 78 SER HB3 . . 4.160 3.174 2.459 3.565 . 0 0 "[ . 1 . 2]" 1
1719 1 78 SER H 1 79 THR H . . 5.310 3.056 2.831 3.163 . 0 0 "[ . 1 . 2]" 1
1720 1 78 SER HB2 1 79 THR H . . 4.610 2.930 2.207 3.754 . 0 0 "[ . 1 . 2]" 1
1721 1 78 SER HB3 1 79 THR H . . 4.590 2.832 2.095 3.802 . 0 0 "[ . 1 . 2]" 1
1722 1 79 THR H 1 80 SER H . . 2.850 2.841 2.731 2.860 0.010 14 0 "[ . 1 . 2]" 1
1723 1 79 THR HA 1 79 THR MG . . 3.710 2.512 2.330 3.225 . 0 0 "[ . 1 . 2]" 1
1724 1 79 THR HB 1 80 SER H . . 3.980 2.737 2.406 3.983 0.003 18 0 "[ . 1 . 2]" 1
1725 1 79 THR MG 1 80 SER H . . 5.500 3.250 2.310 3.986 . 0 0 "[ . 1 . 2]" 1
1726 1 80 SER H 1 80 SER QB . . 3.680 2.198 2.075 2.404 . 0 0 "[ . 1 . 2]" 1
1727 1 80 SER QB 1 81 LEU H . . 4.860 2.258 2.078 3.186 . 0 0 "[ . 1 . 2]" 1
1728 1 80 SER QB 1 81 LEU MD2 . . 5.500 5.405 4.104 6.199 0.699 12 1 "[ . 1 + . 2]" 1
1729 1 81 LEU H 1 81 LEU HB2 . . 3.680 2.134 1.982 2.622 . 0 0 "[ . 1 . 2]" 1
1730 1 81 LEU H 1 81 LEU MD2 . . 5.500 4.164 3.659 4.412 . 0 0 "[ . 1 . 2]" 1
1731 1 81 LEU H 1 81 LEU HG . . 4.300 3.650 2.091 4.319 0.019 2 0 "[ . 1 . 2]" 1
1732 1 81 LEU HA 1 81 LEU MD1 . . 4.790 3.176 2.262 3.897 . 0 0 "[ . 1 . 2]" 1
1733 1 81 LEU HA 1 81 LEU MD2 . . 3.540 3.205 2.164 4.015 0.475 2 0 "[ . 1 . 2]" 1
1734 1 81 LEU HA 1 81 LEU HG . . 3.230 2.348 2.098 3.052 . 0 0 "[ . 1 . 2]" 1
1735 1 81 LEU HB2 1 81 LEU MD1 . . 3.660 2.122 1.937 2.449 . 0 0 "[ . 1 . 2]" 1
1736 1 82 GLN H 1 82 GLN HB3 . . 4.120 3.366 2.698 3.567 . 0 0 "[ . 1 . 2]" 1
1737 1 82 GLN HB2 1 83 ASP H . . 5.500 2.803 2.208 3.666 . 0 0 "[ . 1 . 2]" 1
1738 1 82 GLN HB3 1 83 ASP H . . 4.430 2.688 2.224 3.275 . 0 0 "[ . 1 . 2]" 1
1739 1 82 GLN QG 1 83 ASP H . . 4.830 4.193 3.456 4.430 . 0 0 "[ . 1 . 2]" 1
1740 1 83 ASP HB2 1 84 SER H . . 5.250 3.375 2.401 3.890 . 0 0 "[ . 1 . 2]" 1
1741 1 84 SER QB 1 85 GLY H . . 5.360 2.522 2.407 2.810 . 0 0 "[ . 1 . 2]" 1
1742 1 85 GLY QA 1 86 PRO QD . . 2.910 1.921 1.838 2.016 . 0 0 "[ . 1 . 2]" 1
1743 1 85 GLY QA 1 86 PRO QG . . 5.340 3.743 3.698 3.818 . 0 0 "[ . 1 . 2]" 1
1744 1 86 PRO HB2 1 87 SER H . . 3.800 2.865 2.397 3.386 . 0 0 "[ . 1 . 2]" 1
1745 1 86 PRO HB2 1 87 SER HA . . 4.610 4.257 3.906 4.614 0.004 18 0 "[ . 1 . 2]" 1
1746 1 86 PRO QD 1 87 SER H . . 5.500 4.098 2.304 5.035 . 0 0 "[ . 1 . 2]" 1
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