NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
399726 |
1ufm   |
5849 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1ufm
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 1333
_Distance_constraint_stats_list.Viol_count 1336
_Distance_constraint_stats_list.Viol_total 1985.683
_Distance_constraint_stats_list.Viol_max 0.951
_Distance_constraint_stats_list.Viol_rms 0.0319
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0037
_Distance_constraint_stats_list.Viol_average_violations_only 0.0743
_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 10 SER 0.640 0.111 17 0 "[ . 1 . 2]"
1 11 ILE 1.458 0.112 10 0 "[ . 1 . 2]"
1 12 LEU 3.098 0.231 17 0 "[ . 1 . 2]"
1 13 ASP 1.653 0.325 6 0 "[ . 1 . 2]"
1 14 ARG 0.841 0.242 16 0 "[ . 1 . 2]"
1 15 ALA 0.143 0.033 17 0 "[ . 1 . 2]"
1 16 VAL 0.367 0.128 19 0 "[ . 1 . 2]"
1 17 ILE 7.558 0.783 8 4 "[ -. + 1* . * 2]"
1 18 GLU 0.155 0.033 17 0 "[ . 1 . 2]"
1 19 HIS 0.876 0.073 17 0 "[ . 1 . 2]"
1 20 ASN 4.109 0.471 16 0 "[ . 1 . 2]"
1 21 LEU 0.356 0.066 16 0 "[ . 1 . 2]"
1 22 LEU 3.676 0.192 14 0 "[ . 1 . 2]"
1 23 SER 1.783 0.489 3 0 "[ . 1 . 2]"
1 24 ALA 0.827 0.489 3 0 "[ . 1 . 2]"
1 25 SER 1.146 0.163 1 0 "[ . 1 . 2]"
1 26 LYS 6.587 0.858 6 3 "[ .+* 1 -. 2]"
1 27 LEU 2.463 0.270 19 0 "[ . 1 . 2]"
1 28 TYR 4.881 0.825 13 5 "[ -* . 1 + .** 2]"
1 29 ASN 1.906 0.610 1 1 "[+ . 1 . 2]"
1 30 ASN 2.386 0.610 1 1 "[+ . 1 . 2]"
1 31 ILE 6.113 0.825 13 5 "[ -* . 1 + .** 2]"
1 32 THR 3.869 0.331 19 0 "[ . 1 . 2]"
1 33 PHE 6.234 0.379 5 0 "[ . 1 . 2]"
1 34 GLU 1.586 0.294 6 0 "[ . 1 . 2]"
1 35 GLU 8.665 0.331 19 0 "[ . 1 . 2]"
1 36 LEU 6.824 0.235 20 0 "[ . 1 . 2]"
1 37 GLY 4.523 0.235 20 0 "[ . 1 . 2]"
1 38 ALA 4.016 0.232 13 0 "[ . 1 . 2]"
1 39 LEU 0.127 0.026 11 0 "[ . 1 . 2]"
1 40 LEU 4.519 0.783 8 4 "[ -. + 1* . * 2]"
1 41 GLU 0.503 0.071 7 0 "[ . 1 . 2]"
1 42 ILE 2.804 0.194 4 0 "[ . 1 . 2]"
1 43 PRO 5.493 0.519 13 1 "[ . 1 + . 2]"
1 44 ALA 0.258 0.158 6 0 "[ . 1 . 2]"
1 45 ALA 0.968 0.080 6 0 "[ . 1 . 2]"
1 46 LYS 9.573 0.597 1 3 "[+ . 1 *- . 2]"
1 47 ALA 4.396 0.561 1 1 "[+ . 1 . 2]"
1 48 GLU 2.678 0.379 5 0 "[ . 1 . 2]"
1 49 LYS 2.376 0.359 12 0 "[ . 1 . 2]"
1 50 ILE 0.865 0.242 16 0 "[ . 1 . 2]"
1 51 ALA 0.470 0.051 16 0 "[ . 1 . 2]"
1 52 SER 0.494 0.063 18 0 "[ . 1 . 2]"
1 53 GLN 3.603 0.828 6 1 "[ .+ 1 . 2]"
1 54 MET 1.917 0.828 6 1 "[ .+ 1 . 2]"
1 55 ILE 1.275 0.069 12 0 "[ . 1 . 2]"
1 56 THR 0.089 0.016 13 0 "[ . 1 . 2]"
1 57 GLU 0.956 0.527 6 1 "[ .+ 1 . 2]"
1 58 GLY 0.239 0.042 13 0 "[ . 1 . 2]"
1 59 ARG 0.330 0.042 13 0 "[ . 1 . 2]"
1 60 MET 3.717 0.951 15 1 "[ . 1 + 2]"
1 61 ASN 2.631 0.951 15 1 "[ . 1 + 2]"
1 62 GLY 1.398 0.507 15 1 "[ . 1 + 2]"
1 63 PHE 0.308 0.024 3 0 "[ . 1 . 2]"
1 64 ILE 1.130 0.156 5 0 "[ . 1 . 2]"
1 65 ASP 1.032 0.655 5 1 "[ + 1 . 2]"
1 66 GLN 0.205 0.071 5 0 "[ . 1 . 2]"
1 67 ILE 1.276 0.655 5 1 "[ + 1 . 2]"
1 68 ASP 0.001 0.001 12 0 "[ . 1 . 2]"
1 69 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 ILE 0.162 0.098 12 0 "[ . 1 . 2]"
1 71 VAL 0.411 0.117 13 0 "[ . 1 . 2]"
1 72 HIS 1.955 0.140 6 0 "[ . 1 . 2]"
1 73 PHE 4.343 0.273 8 0 "[ . 1 . 2]"
1 74 GLU 2.180 0.273 8 0 "[ . 1 . 2]"
1 75 THR 0.349 0.073 4 0 "[ . 1 . 2]"
1 76 ARG 8.086 0.602 11 4 "[ . *+ .* -]"
1 77 GLU 2.998 0.458 1 0 "[ . 1 . 2]"
1 78 ALA 0.267 0.109 18 0 "[ . 1 . 2]"
1 79 SER 0.034 0.012 3 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 10 SER HA 1 11 ILE H . . 3.440 2.466 2.217 3.469 0.029 17 0 "[ . 1 . 2]" 1
2 1 10 SER HA 1 11 ILE HB . . 5.240 4.921 4.409 5.264 0.024 8 0 "[ . 1 . 2]" 1
3 1 10 SER HA 1 12 LEU H . . 5.350 4.473 3.603 5.393 0.043 2 0 "[ . 1 . 2]" 1
4 1 10 SER HB3 1 11 ILE H . . 4.210 3.661 2.113 4.321 0.111 17 0 "[ . 1 . 2]" 1
5 1 10 SER HB3 1 12 LEU H . . 5.130 3.728 2.126 5.130 . 15 0 "[ . 1 . 2]" 1
6 1 11 ILE H 1 11 ILE HB . . 3.290 2.778 2.412 3.335 0.045 17 0 "[ . 1 . 2]" 1
7 1 11 ILE H 1 11 ILE MD . . 5.040 3.128 1.913 3.915 . 0 0 "[ . 1 . 2]" 1
8 1 11 ILE H 1 11 ILE HG12 . . 4.130 3.460 1.985 4.125 . 0 0 "[ . 1 . 2]" 1
9 1 11 ILE H 1 11 ILE HG13 . . 4.020 2.760 2.032 4.017 . 0 0 "[ . 1 . 2]" 1
10 1 11 ILE H 1 11 ILE MG . . 4.110 3.847 3.740 3.958 . 0 0 "[ . 1 . 2]" 1
11 1 11 ILE HA 1 11 ILE MD . . 4.360 3.462 2.068 3.952 . 0 0 "[ . 1 . 2]" 1
12 1 11 ILE HA 1 11 ILE HG12 . . 4.040 3.137 2.757 3.699 . 0 0 "[ . 1 . 2]" 1
13 1 11 ILE HA 1 11 ILE HG13 . . 4.250 3.059 2.307 3.864 . 0 0 "[ . 1 . 2]" 1
14 1 11 ILE HA 1 11 ILE MG . . 3.500 2.228 2.026 2.398 . 0 0 "[ . 1 . 2]" 1
15 1 11 ILE HA 1 12 LEU H . . 3.170 2.708 2.186 3.054 . 0 0 "[ . 1 . 2]" 1
16 1 11 ILE HA 1 12 LEU QB . . 4.890 4.495 4.084 4.773 . 0 0 "[ . 1 . 2]" 1
17 1 11 ILE HB 1 12 LEU H . . 4.150 4.195 4.089 4.262 0.112 10 0 "[ . 1 . 2]" 1
18 1 12 LEU H 1 12 LEU QB . . 3.130 2.385 1.979 2.965 . 0 0 "[ . 1 . 2]" 1
19 1 12 LEU H 1 12 LEU QD . . 3.850 2.794 1.782 3.730 . 0 0 "[ . 1 . 2]" 1
20 1 12 LEU H 1 12 LEU HG . . 3.860 3.693 2.579 3.956 0.096 20 0 "[ . 1 . 2]" 1
21 1 12 LEU HA 1 12 LEU QD . . 3.570 2.870 1.989 3.365 . 0 0 "[ . 1 . 2]" 1
22 1 12 LEU HA 1 12 LEU HG . . 4.250 3.485 2.088 4.255 0.005 11 0 "[ . 1 . 2]" 1
23 1 12 LEU HA 1 13 ASP H . . 3.370 2.307 2.177 2.855 . 0 0 "[ . 1 . 2]" 1
24 1 12 LEU HA 1 13 ASP HB3 . . 5.490 5.496 5.271 5.721 0.231 17 0 "[ . 1 . 2]" 1
25 1 12 LEU HA 1 14 ARG H . . 5.490 5.517 5.488 5.552 0.062 19 0 "[ . 1 . 2]" 1
26 1 12 LEU HA 1 17 ILE MD . . 5.240 4.171 3.150 5.286 0.046 20 0 "[ . 1 . 2]" 1
27 1 12 LEU QB 1 13 ASP H . . 4.570 3.401 2.238 3.976 . 0 0 "[ . 1 . 2]" 1
28 1 12 LEU QD 1 13 ASP H . . 4.850 3.215 1.837 4.265 . 0 0 "[ . 1 . 2]" 1
29 1 12 LEU QD 1 14 ARG H . . 5.370 4.293 2.731 5.171 . 0 0 "[ . 1 . 2]" 1
30 1 12 LEU HG 1 17 ILE MD . . 4.300 3.557 1.976 4.319 0.019 18 0 "[ . 1 . 2]" 1
31 1 13 ASP H 1 13 ASP HB2 . . 3.700 2.174 2.020 2.478 . 0 0 "[ . 1 . 2]" 1
32 1 13 ASP H 1 13 ASP HB3 . . 3.610 3.235 2.549 3.615 0.005 17 0 "[ . 1 . 2]" 1
33 1 13 ASP H 1 16 VAL HB . . 5.420 3.941 3.377 4.536 . 0 0 "[ . 1 . 2]" 1
34 1 13 ASP H 1 16 VAL QG . . 5.240 3.758 3.508 4.038 . 0 0 "[ . 1 . 2]" 1
35 1 13 ASP H 1 17 ILE MD . . 5.240 3.659 2.723 4.387 . 0 0 "[ . 1 . 2]" 1
36 1 13 ASP HA 1 14 ARG H . . 3.370 2.263 2.258 2.265 . 0 0 "[ . 1 . 2]" 1
37 1 13 ASP HA 1 14 ARG HB2 . . 5.240 4.475 4.295 4.837 . 0 0 "[ . 1 . 2]" 1
38 1 13 ASP HA 1 15 ALA H . . 4.840 3.622 3.519 3.847 . 0 0 "[ . 1 . 2]" 1
39 1 13 ASP HA 1 16 VAL H . . 5.140 4.185 4.014 4.335 . 0 0 "[ . 1 . 2]" 1
40 1 13 ASP HA 1 16 VAL HB . . 4.890 4.640 4.296 4.910 0.020 17 0 "[ . 1 . 2]" 1
41 1 13 ASP HA 1 16 VAL QG . . 4.660 4.250 3.989 4.541 . 0 0 "[ . 1 . 2]" 1
42 1 13 ASP HB2 1 14 ARG H . . 4.770 4.602 4.396 4.676 . 0 0 "[ . 1 . 2]" 1
43 1 13 ASP HB2 1 15 ALA H . . 5.360 4.810 4.186 5.010 . 0 0 "[ . 1 . 2]" 1
44 1 13 ASP HB2 1 15 ALA MB . . 5.490 4.894 4.212 5.205 . 0 0 "[ . 1 . 2]" 1
45 1 13 ASP HB2 1 16 VAL H . . 4.800 3.643 2.781 4.203 . 0 0 "[ . 1 . 2]" 1
46 1 13 ASP HB2 1 16 VAL HB . . 4.250 2.833 1.999 4.126 . 0 0 "[ . 1 . 2]" 1
47 1 13 ASP HB2 1 16 VAL QG . . 4.040 2.478 1.860 3.542 . 0 0 "[ . 1 . 2]" 1
48 1 13 ASP HB2 1 17 ILE MD . . 5.040 4.546 3.496 5.365 0.325 6 0 "[ . 1 . 2]" 1
49 1 13 ASP HB3 1 14 ARG H . . 4.570 3.955 3.759 4.384 . 0 0 "[ . 1 . 2]" 1
50 1 13 ASP HB3 1 16 VAL H . . 5.040 2.241 1.940 2.993 . 0 0 "[ . 1 . 2]" 1
51 1 13 ASP HB3 1 16 VAL HB . . 4.570 2.333 1.989 3.779 . 0 0 "[ . 1 . 2]" 1
52 1 13 ASP HB3 1 16 VAL QG . . 4.360 2.139 1.892 3.026 . 0 0 "[ . 1 . 2]" 1
53 1 13 ASP HB3 1 17 ILE MD . . 5.490 4.407 3.871 4.866 . 0 0 "[ . 1 . 2]" 1
54 1 14 ARG H 1 14 ARG HB2 . . 3.450 2.282 2.072 2.688 . 0 0 "[ . 1 . 2]" 1
55 1 14 ARG H 1 14 ARG HB3 . . 3.790 2.718 2.303 3.006 . 0 0 "[ . 1 . 2]" 1
56 1 14 ARG H 1 14 ARG HG3 . . 4.490 4.402 4.340 4.456 . 0 0 "[ . 1 . 2]" 1
57 1 14 ARG H 1 15 ALA MB . . 5.370 4.173 4.013 4.314 . 0 0 "[ . 1 . 2]" 1
58 1 14 ARG HA 1 14 ARG QD . . 3.860 2.458 2.117 3.322 . 0 0 "[ . 1 . 2]" 1
59 1 14 ARG HA 1 14 ARG HG3 . . 3.760 2.604 2.409 2.970 . 0 0 "[ . 1 . 2]" 1
60 1 14 ARG HA 1 16 VAL H . . 5.210 4.108 3.925 4.408 . 0 0 "[ . 1 . 2]" 1
61 1 14 ARG HA 1 17 ILE H . . 4.220 3.220 3.002 3.371 . 0 0 "[ . 1 . 2]" 1
62 1 14 ARG HA 1 17 ILE HB . . 3.830 2.685 2.399 3.206 . 0 0 "[ . 1 . 2]" 1
63 1 14 ARG HA 1 17 ILE MD . . 3.580 2.152 1.850 2.887 . 0 0 "[ . 1 . 2]" 1
64 1 14 ARG HA 1 17 ILE HG12 . . 4.890 4.521 3.576 4.869 . 0 0 "[ . 1 . 2]" 1
65 1 14 ARG HA 1 17 ILE MG . . 4.490 4.059 3.814 4.521 0.031 19 0 "[ . 1 . 2]" 1
66 1 14 ARG HA 1 18 GLU H . . 4.890 4.089 3.747 4.589 . 0 0 "[ . 1 . 2]" 1
67 1 14 ARG HA 1 50 ILE MD . . 4.770 3.920 2.961 4.607 . 0 0 "[ . 1 . 2]" 1
68 1 14 ARG HB2 1 14 ARG QD . . 3.880 2.303 2.048 2.838 . 0 0 "[ . 1 . 2]" 1
69 1 14 ARG HB2 1 15 ALA H . . 4.200 3.840 3.456 4.121 . 0 0 "[ . 1 . 2]" 1
70 1 14 ARG HB3 1 15 ALA H . . 3.700 2.901 2.723 3.015 . 0 0 "[ . 1 . 2]" 1
71 1 14 ARG QD 1 17 ILE MD . . 4.360 3.046 2.078 4.130 . 0 0 "[ . 1 . 2]" 1
72 1 14 ARG QD 1 18 GLU HG2 . . 5.490 4.994 4.194 5.255 . 0 0 "[ . 1 . 2]" 1
73 1 14 ARG QD 1 18 GLU HG3 . . 5.240 4.372 3.218 4.887 . 0 0 "[ . 1 . 2]" 1
74 1 14 ARG QD 1 50 ILE MD . . 4.250 2.146 1.847 2.754 . 0 0 "[ . 1 . 2]" 1
75 1 14 ARG QD 1 50 ILE QG . . 5.490 3.316 2.260 4.152 . 0 0 "[ . 1 . 2]" 1
76 1 14 ARG QD 1 50 ILE MG . . 5.490 3.573 2.601 4.364 . 0 0 "[ . 1 . 2]" 1
77 1 14 ARG HG2 1 18 GLU HG2 . . 5.240 4.924 4.371 5.247 0.007 11 0 "[ . 1 . 2]" 1
78 1 14 ARG HG2 1 18 GLU HG3 . . 4.570 3.779 3.265 4.383 . 0 0 "[ . 1 . 2]" 1
79 1 14 ARG HG2 1 50 ILE MD . . 4.490 4.203 3.797 4.732 0.242 16 0 "[ . 1 . 2]" 1
80 1 14 ARG HG3 1 15 ALA H . . 4.630 4.459 4.021 4.638 0.008 14 0 "[ . 1 . 2]" 1
81 1 14 ARG HG3 1 18 GLU H . . 5.330 3.980 3.388 4.356 . 0 0 "[ . 1 . 2]" 1
82 1 14 ARG HG3 1 18 GLU HG2 . . 4.890 3.825 3.428 4.222 . 0 0 "[ . 1 . 2]" 1
83 1 14 ARG HG3 1 18 GLU HG3 . . 4.570 2.719 2.106 3.166 . 0 0 "[ . 1 . 2]" 1
84 1 15 ALA H 1 15 ALA MB . . 2.890 2.058 1.933 2.171 . 0 0 "[ . 1 . 2]" 1
85 1 15 ALA H 1 16 VAL H . . 3.460 2.595 2.497 2.671 . 0 0 "[ . 1 . 2]" 1
86 1 15 ALA H 1 16 VAL HB . . 5.240 4.591 4.333 4.763 . 0 0 "[ . 1 . 2]" 1
87 1 15 ALA H 1 16 VAL QG . . 4.570 4.108 3.860 4.345 . 0 0 "[ . 1 . 2]" 1
88 1 15 ALA H 1 17 ILE H . . 4.850 4.178 4.049 4.269 . 0 0 "[ . 1 . 2]" 1
89 1 15 ALA H 1 17 ILE MD . . 5.400 4.683 4.433 4.972 . 0 0 "[ . 1 . 2]" 1
90 1 15 ALA HA 1 16 VAL HA . . 4.890 4.769 4.733 4.820 . 0 0 "[ . 1 . 2]" 1
91 1 15 ALA HA 1 16 VAL QG . . 5.040 4.793 4.679 4.984 . 0 0 "[ . 1 . 2]" 1
92 1 15 ALA HA 1 17 ILE H . . 4.770 4.498 4.236 4.641 . 0 0 "[ . 1 . 2]" 1
93 1 15 ALA HA 1 18 GLU H . . 4.200 3.344 3.091 3.479 . 0 0 "[ . 1 . 2]" 1
94 1 15 ALA HA 1 18 GLU HB2 . . 3.630 2.442 2.247 2.514 . 0 0 "[ . 1 . 2]" 1
95 1 15 ALA HA 1 18 GLU HB3 . . 4.040 4.010 3.752 4.073 0.033 17 0 "[ . 1 . 2]" 1
96 1 15 ALA HA 1 18 GLU HG2 . . 5.240 4.792 4.132 5.214 . 0 0 "[ . 1 . 2]" 1
97 1 15 ALA HA 1 18 GLU HG3 . . 4.770 3.357 2.476 3.956 . 0 0 "[ . 1 . 2]" 1
98 1 15 ALA HA 1 19 HIS H . . 4.830 3.937 3.660 4.311 . 0 0 "[ . 1 . 2]" 1
99 1 15 ALA MB 1 16 VAL H . . 3.520 2.762 2.584 2.882 . 0 0 "[ . 1 . 2]" 1
100 1 15 ALA MB 1 16 VAL HA . . 4.890 3.835 3.778 3.899 . 0 0 "[ . 1 . 2]" 1
101 1 15 ALA MB 1 19 HIS H . . 5.180 4.452 4.205 4.793 . 0 0 "[ . 1 . 2]" 1
102 1 16 VAL H 1 16 VAL HB . . 3.200 2.234 2.037 2.411 . 0 0 "[ . 1 . 2]" 1
103 1 16 VAL H 1 16 VAL QG . . 3.190 2.354 2.073 2.667 . 0 0 "[ . 1 . 2]" 1
104 1 16 VAL H 1 17 ILE HB . . 4.940 4.638 4.443 4.814 . 0 0 "[ . 1 . 2]" 1
105 1 16 VAL H 1 18 GLU H . . 5.000 3.985 3.897 4.125 . 0 0 "[ . 1 . 2]" 1
106 1 16 VAL HA 1 16 VAL QG . . 2.950 2.123 1.961 2.178 . 0 0 "[ . 1 . 2]" 1
107 1 16 VAL HA 1 19 HIS H . . 4.050 3.393 3.309 3.491 . 0 0 "[ . 1 . 2]" 1
108 1 16 VAL HA 1 19 HIS HB2 . . 3.700 3.471 2.900 3.710 0.010 12 0 "[ . 1 . 2]" 1
109 1 16 VAL HA 1 19 HIS HB3 . . 3.740 2.999 2.594 3.381 . 0 0 "[ . 1 . 2]" 1
110 1 16 VAL HA 1 20 ASN H . . 5.240 3.659 3.492 3.966 . 0 0 "[ . 1 . 2]" 1
111 1 16 VAL HB 1 17 ILE H . . 3.460 2.781 2.579 3.588 0.128 19 0 "[ . 1 . 2]" 1
112 1 16 VAL QG 1 17 ILE H . . 4.160 2.939 1.887 3.220 . 0 0 "[ . 1 . 2]" 1
113 1 16 VAL QG 1 19 HIS H . . 5.240 4.324 4.231 4.456 . 0 0 "[ . 1 . 2]" 1
114 1 16 VAL QG 1 19 HIS HB2 . . 5.490 4.460 4.169 4.626 . 0 0 "[ . 1 . 2]" 1
115 1 16 VAL QG 1 19 HIS HB3 . . 4.890 3.796 3.579 3.932 . 0 0 "[ . 1 . 2]" 1
116 1 16 VAL QG 1 19 HIS HD2 . . 5.490 4.902 4.565 5.255 . 0 0 "[ . 1 . 2]" 1
117 1 16 VAL QG 1 20 ASN H . . 4.160 3.623 3.441 3.852 . 0 0 "[ . 1 . 2]" 1
118 1 16 VAL QG 1 20 ASN HB2 . . 5.240 3.557 3.064 4.305 . 0 0 "[ . 1 . 2]" 1
119 1 16 VAL QG 1 20 ASN HD21 . . 3.500 2.458 1.736 3.296 . 0 0 "[ . 1 . 2]" 1
120 1 16 VAL QG 1 20 ASN HD22 . . 3.630 2.372 1.761 3.313 . 0 0 "[ . 1 . 2]" 1
121 1 17 ILE H 1 17 ILE HB . . 3.220 2.313 2.187 2.386 . 0 0 "[ . 1 . 2]" 1
122 1 17 ILE H 1 17 ILE MD . . 4.030 2.624 1.837 3.075 . 0 0 "[ . 1 . 2]" 1
123 1 17 ILE H 1 17 ILE HG12 . . 3.700 3.750 3.631 3.814 0.114 4 0 "[ . 1 . 2]" 1
124 1 17 ILE H 1 17 ILE MG . . 4.200 3.677 3.619 3.702 . 0 0 "[ . 1 . 2]" 1
125 1 17 ILE H 1 18 GLU H . . 3.540 2.660 2.587 2.708 . 0 0 "[ . 1 . 2]" 1
126 1 17 ILE H 1 18 GLU HG3 . . 5.490 4.887 4.405 5.392 . 0 0 "[ . 1 . 2]" 1
127 1 17 ILE H 1 19 HIS H . . 4.650 4.213 4.002 4.371 . 0 0 "[ . 1 . 2]" 1
128 1 17 ILE HA 1 17 ILE MD . . 4.420 3.508 2.197 3.822 . 0 0 "[ . 1 . 2]" 1
129 1 17 ILE HA 1 17 ILE HG12 . . 3.540 3.055 2.721 3.631 0.091 17 0 "[ . 1 . 2]" 1
130 1 17 ILE HA 1 17 ILE MG . . 3.290 2.529 2.465 2.631 . 0 0 "[ . 1 . 2]" 1
131 1 17 ILE HA 1 20 ASN H . . 4.060 3.464 3.217 3.690 . 0 0 "[ . 1 . 2]" 1
132 1 17 ILE HA 1 20 ASN HB2 . . 3.910 2.387 2.109 2.693 . 0 0 "[ . 1 . 2]" 1
133 1 17 ILE HA 1 20 ASN HB3 . . 4.300 3.691 3.165 4.151 . 0 0 "[ . 1 . 2]" 1
134 1 17 ILE HA 1 20 ASN HD21 . . 5.370 3.225 2.011 3.997 . 0 0 "[ . 1 . 2]" 1
135 1 17 ILE HA 1 20 ASN HD22 . . 4.900 4.500 3.031 5.371 0.471 16 0 "[ . 1 . 2]" 1
136 1 17 ILE HA 1 21 LEU H . . 5.240 3.929 3.695 4.138 . 0 0 "[ . 1 . 2]" 1
137 1 17 ILE HA 1 40 LEU MD1 . . 5.490 3.751 3.358 3.998 . 0 0 "[ . 1 . 2]" 1
138 1 17 ILE HA 1 40 LEU MD2 . . 4.360 2.039 1.769 2.456 . 0 0 "[ . 1 . 2]" 1
139 1 17 ILE HB 1 17 ILE MD . . 3.500 2.115 1.935 2.456 . 0 0 "[ . 1 . 2]" 1
140 1 17 ILE HB 1 18 GLU H . . 3.580 2.777 2.622 2.920 . 0 0 "[ . 1 . 2]" 1
141 1 17 ILE MD 1 18 GLU H . . 4.490 4.163 3.954 4.498 0.008 13 0 "[ . 1 . 2]" 1
142 1 17 ILE HG12 1 17 ILE MG . . 3.340 2.227 1.987 2.434 . 0 0 "[ . 1 . 2]" 1
143 1 17 ILE HG12 1 18 GLU H . . 5.490 5.262 5.203 5.306 . 0 0 "[ . 1 . 2]" 1
144 1 17 ILE HG12 1 40 LEU QB . . 2.650 2.223 1.922 3.433 0.783 8 4 "[ -. + 1* . * 2]" 1
145 1 17 ILE HG12 1 40 LEU MD1 . . 4.300 3.427 2.622 4.390 0.090 8 0 "[ . 1 . 2]" 1
146 1 17 ILE HG12 1 42 ILE MD . . 4.660 2.655 2.256 3.143 . 0 0 "[ . 1 . 2]" 1
147 1 17 ILE MG 1 18 GLU H . . 4.200 3.359 3.156 3.519 . 0 0 "[ . 1 . 2]" 1
148 1 17 ILE MG 1 18 GLU HG3 . . 5.490 4.262 3.420 4.803 . 0 0 "[ . 1 . 2]" 1
149 1 17 ILE MG 1 19 HIS H . . 5.070 5.076 5.000 5.097 0.027 1 0 "[ . 1 . 2]" 1
150 1 17 ILE MG 1 21 LEU H . . 5.240 4.034 3.696 4.266 . 0 0 "[ . 1 . 2]" 1
151 1 17 ILE MG 1 21 LEU HB2 . . 4.040 3.676 3.219 4.047 0.007 14 0 "[ . 1 . 2]" 1
152 1 17 ILE MG 1 40 LEU HA . . 5.490 4.869 4.421 5.434 . 0 0 "[ . 1 . 2]" 1
153 1 17 ILE MG 1 40 LEU QB . . 3.570 2.682 2.207 3.149 . 0 0 "[ . 1 . 2]" 1
154 1 17 ILE MG 1 40 LEU MD1 . . 3.070 2.025 1.830 2.573 . 0 0 "[ . 1 . 2]" 1
155 1 17 ILE MG 1 42 ILE MD . . 3.200 2.056 1.804 2.258 . 0 0 "[ . 1 . 2]" 1
156 1 18 GLU H 1 18 GLU HB2 . . 3.610 2.270 2.142 2.439 . 0 0 "[ . 1 . 2]" 1
157 1 18 GLU H 1 18 GLU HB3 . . 4.000 3.506 3.443 3.548 . 0 0 "[ . 1 . 2]" 1
158 1 18 GLU H 1 18 GLU HG2 . . 4.040 3.257 2.881 3.726 . 0 0 "[ . 1 . 2]" 1
159 1 18 GLU H 1 18 GLU HG3 . . 3.680 2.739 2.446 3.147 . 0 0 "[ . 1 . 2]" 1
160 1 18 GLU H 1 19 HIS H . . 3.510 2.710 2.569 2.804 . 0 0 "[ . 1 . 2]" 1
161 1 18 GLU HA 1 18 GLU HG2 . . 3.570 2.178 2.077 2.334 . 0 0 "[ . 1 . 2]" 1
162 1 18 GLU HA 1 18 GLU HG3 . . 3.810 3.221 2.848 3.467 . 0 0 "[ . 1 . 2]" 1
163 1 18 GLU HA 1 20 ASN H . . 5.240 4.664 4.536 4.786 . 0 0 "[ . 1 . 2]" 1
164 1 18 GLU HA 1 21 LEU H . . 4.360 3.519 3.391 3.644 . 0 0 "[ . 1 . 2]" 1
165 1 18 GLU HA 1 21 LEU HB2 . . 3.600 2.662 2.462 2.960 . 0 0 "[ . 1 . 2]" 1
166 1 18 GLU HA 1 21 LEU QD . . 4.040 2.768 2.174 3.385 . 0 0 "[ . 1 . 2]" 1
167 1 18 GLU HA 1 50 ILE MG . . 4.200 3.249 2.944 3.637 . 0 0 "[ . 1 . 2]" 1
168 1 18 GLU HB2 1 19 HIS H . . 3.770 2.686 2.564 2.824 . 0 0 "[ . 1 . 2]" 1
169 1 18 GLU HB3 1 19 HIS H . . 3.860 3.420 3.174 3.715 . 0 0 "[ . 1 . 2]" 1
170 1 18 GLU HB3 1 19 HIS HA . . 5.490 4.162 4.004 4.402 . 0 0 "[ . 1 . 2]" 1
171 1 18 GLU HB3 1 22 LEU QD . . 5.240 3.919 3.246 4.256 . 0 0 "[ . 1 . 2]" 1
172 1 18 GLU HG2 1 19 HIS H . . 5.400 4.895 4.784 5.112 . 0 0 "[ . 1 . 2]" 1
173 1 18 GLU HG2 1 50 ILE MD . . 5.040 4.345 3.671 4.742 . 0 0 "[ . 1 . 2]" 1
174 1 18 GLU HG2 1 50 ILE MG . . 3.700 2.771 2.352 3.376 . 0 0 "[ . 1 . 2]" 1
175 1 18 GLU HG3 1 19 HIS H . . 5.350 4.663 4.427 4.881 . 0 0 "[ . 1 . 2]" 1
176 1 18 GLU HG3 1 50 ILE MG . . 3.940 3.597 3.057 3.944 0.004 19 0 "[ . 1 . 2]" 1
177 1 19 HIS H 1 19 HIS HB2 . . 3.250 2.263 2.095 2.361 . 0 0 "[ . 1 . 2]" 1
178 1 19 HIS H 1 19 HIS HB3 . . 3.470 2.699 2.548 2.943 . 0 0 "[ . 1 . 2]" 1
179 1 19 HIS H 1 20 ASN H . . 3.620 2.639 2.541 2.770 . 0 0 "[ . 1 . 2]" 1
180 1 19 HIS H 1 21 LEU HB2 . . 4.980 4.896 4.742 5.014 0.034 17 0 "[ . 1 . 2]" 1
181 1 19 HIS HA 1 19 HIS HD2 . . 5.040 4.416 3.906 4.655 . 0 0 "[ . 1 . 2]" 1
182 1 19 HIS HA 1 21 LEU H . . 5.490 4.172 3.935 4.352 . 0 0 "[ . 1 . 2]" 1
183 1 19 HIS HA 1 22 LEU H . . 4.160 3.158 3.082 3.305 . 0 0 "[ . 1 . 2]" 1
184 1 19 HIS HA 1 22 LEU HB2 . . 3.650 2.539 2.423 2.588 . 0 0 "[ . 1 . 2]" 1
185 1 19 HIS HA 1 22 LEU HB3 . . 4.160 4.176 4.059 4.233 0.073 17 0 "[ . 1 . 2]" 1
186 1 19 HIS HA 1 22 LEU QD . . 3.660 3.147 2.416 3.599 . 0 0 "[ . 1 . 2]" 1
187 1 19 HIS HA 1 22 LEU HG . . 4.570 3.780 3.277 4.299 . 0 0 "[ . 1 . 2]" 1
188 1 19 HIS HA 1 23 SER H . . 4.860 3.934 3.684 4.193 . 0 0 "[ . 1 . 2]" 1
189 1 19 HIS HB2 1 20 ASN H . . 4.000 3.693 3.450 3.840 . 0 0 "[ . 1 . 2]" 1
190 1 19 HIS HB3 1 20 ASN H . . 3.590 2.610 2.518 2.721 . 0 0 "[ . 1 . 2]" 1
191 1 19 HIS HD2 1 20 ASN H . . 5.490 4.711 3.879 5.151 . 0 0 "[ . 1 . 2]" 1
192 1 19 HIS HD2 1 20 ASN HA . . 5.040 4.523 3.184 5.017 . 0 0 "[ . 1 . 2]" 1
193 1 20 ASN H 1 20 ASN HB2 . . 3.340 2.238 2.027 2.540 . 0 0 "[ . 1 . 2]" 1
194 1 20 ASN H 1 20 ASN HB3 . . 3.840 3.433 3.165 3.553 . 0 0 "[ . 1 . 2]" 1
195 1 20 ASN H 1 20 ASN HD22 . . 4.790 4.443 4.034 4.834 0.044 16 0 "[ . 1 . 2]" 1
196 1 20 ASN H 1 21 LEU H . . 3.460 2.733 2.697 2.757 . 0 0 "[ . 1 . 2]" 1
197 1 20 ASN H 1 21 LEU HA . . 5.480 5.267 5.236 5.290 . 0 0 "[ . 1 . 2]" 1
198 1 20 ASN H 1 21 LEU HB2 . . 4.650 4.543 4.461 4.646 . 0 0 "[ . 1 . 2]" 1
199 1 20 ASN H 1 40 LEU MD2 . . 4.660 3.768 3.449 3.918 . 0 0 "[ . 1 . 2]" 1
200 1 20 ASN HA 1 23 SER H . . 3.830 3.251 3.136 3.498 . 0 0 "[ . 1 . 2]" 1
201 1 20 ASN HA 1 24 ALA H . . 4.920 3.647 3.427 3.958 . 0 0 "[ . 1 . 2]" 1
202 1 20 ASN HA 1 40 LEU MD2 . . 4.770 4.011 3.853 4.175 . 0 0 "[ . 1 . 2]" 1
203 1 20 ASN HB2 1 20 ASN HD22 . . 3.700 3.538 3.445 3.786 0.086 1 0 "[ . 1 . 2]" 1
204 1 20 ASN HB2 1 21 LEU H . . 4.300 2.878 2.577 3.200 . 0 0 "[ . 1 . 2]" 1
205 1 20 ASN HB2 1 21 LEU HA . . 5.490 4.596 4.147 5.128 . 0 0 "[ . 1 . 2]" 1
206 1 20 ASN HB2 1 21 LEU QD . . 5.500 4.021 3.083 4.759 . 0 0 "[ . 1 . 2]" 1
207 1 20 ASN HB2 1 40 LEU MD2 . . 3.610 2.041 1.829 2.440 . 0 0 "[ . 1 . 2]" 1
208 1 20 ASN HB3 1 20 ASN HD22 . . 3.830 3.844 3.507 4.072 0.242 9 0 "[ . 1 . 2]" 1
209 1 20 ASN HB3 1 21 LEU H . . 4.660 3.369 2.756 3.818 . 0 0 "[ . 1 . 2]" 1
210 1 20 ASN HB3 1 21 LEU HA . . 5.490 4.048 3.738 4.393 . 0 0 "[ . 1 . 2]" 1
211 1 20 ASN HB3 1 21 LEU QD . . 5.240 4.176 3.066 4.621 . 0 0 "[ . 1 . 2]" 1
212 1 20 ASN HB3 1 40 LEU HA . . 5.490 4.769 4.387 5.149 . 0 0 "[ . 1 . 2]" 1
213 1 20 ASN HB3 1 40 LEU MD2 . . 3.520 1.859 1.789 2.035 . 0 0 "[ . 1 . 2]" 1
214 1 20 ASN HD21 1 40 LEU MD2 . . 5.040 2.557 1.728 3.393 . 0 0 "[ . 1 . 2]" 1
215 1 20 ASN HD22 1 40 LEU HA . . 5.490 4.328 3.525 5.159 . 0 0 "[ . 1 . 2]" 1
216 1 20 ASN HD22 1 40 LEU MD2 . . 4.570 3.627 3.107 4.064 . 0 0 "[ . 1 . 2]" 1
217 1 21 LEU H 1 21 LEU HB2 . . 3.310 2.043 1.986 2.146 . 0 0 "[ . 1 . 2]" 1
218 1 21 LEU H 1 21 LEU QD . . 4.600 2.999 2.593 3.305 . 0 0 "[ . 1 . 2]" 1
219 1 21 LEU H 1 21 LEU HG . . 4.770 3.702 3.019 4.456 . 0 0 "[ . 1 . 2]" 1
220 1 21 LEU H 1 22 LEU H . . 3.510 2.629 2.520 2.705 . 0 0 "[ . 1 . 2]" 1
221 1 21 LEU H 1 23 SER H . . 4.730 3.986 3.876 4.094 . 0 0 "[ . 1 . 2]" 1
222 1 21 LEU H 1 40 LEU MD2 . . 4.330 3.259 2.843 3.481 . 0 0 "[ . 1 . 2]" 1
223 1 21 LEU HA 1 21 LEU QD . . 3.550 2.432 2.094 2.802 . 0 0 "[ . 1 . 2]" 1
224 1 21 LEU HA 1 21 LEU HG . . 3.680 2.386 2.136 2.584 . 0 0 "[ . 1 . 2]" 1
225 1 21 LEU HA 1 24 ALA H . . 4.110 3.471 3.362 3.588 . 0 0 "[ . 1 . 2]" 1
226 1 21 LEU HA 1 24 ALA MB . . 3.350 2.604 2.340 2.904 . 0 0 "[ . 1 . 2]" 1
227 1 21 LEU HA 1 40 LEU MD2 . . 3.720 3.511 3.217 3.786 0.066 16 0 "[ . 1 . 2]" 1
228 1 21 LEU HB2 1 40 LEU MD2 . . 4.790 3.986 3.568 4.455 . 0 0 "[ . 1 . 2]" 1
229 1 21 LEU HB2 1 54 MET ME . . 3.970 2.941 1.956 3.799 . 0 0 "[ . 1 . 2]" 1
230 1 21 LEU QD 1 50 ILE H . . 5.240 4.452 4.152 4.778 . 0 0 "[ . 1 . 2]" 1
231 1 21 LEU QD 1 50 ILE HB . . 4.160 2.923 2.466 3.467 . 0 0 "[ . 1 . 2]" 1
232 1 21 LEU QD 1 51 ALA H . . 4.090 2.993 2.753 3.233 . 0 0 "[ . 1 . 2]" 1
233 1 21 LEU QD 1 51 ALA HA . . 3.400 2.033 1.760 2.271 . 0 0 "[ . 1 . 2]" 1
234 1 21 LEU QD 1 51 ALA MB . . 3.600 2.157 1.878 2.469 . 0 0 "[ . 1 . 2]" 1
235 1 21 LEU QD 1 54 MET HB2 . . 5.240 3.123 2.340 3.523 . 0 0 "[ . 1 . 2]" 1
236 1 21 LEU QD 1 54 MET HG3 . . 4.660 2.336 1.764 3.986 . 0 0 "[ . 1 . 2]" 1
237 1 21 LEU QD 1 73 PHE HZ . . 4.160 2.749 1.952 3.495 . 0 0 "[ . 1 . 2]" 1
238 1 21 LEU HG 1 51 ALA HA . . 4.890 4.395 3.461 4.912 0.022 11 0 "[ . 1 . 2]" 1
239 1 21 LEU HG 1 73 PHE QE . . 5.490 4.183 3.042 5.371 . 0 0 "[ . 1 . 2]" 1
240 1 22 LEU H 1 22 LEU HB2 . . 2.980 2.209 2.174 2.316 . 0 0 "[ . 1 . 2]" 1
241 1 22 LEU H 1 22 LEU HB3 . . 3.610 3.482 3.465 3.528 . 0 0 "[ . 1 . 2]" 1
242 1 22 LEU H 1 22 LEU QD . . 3.950 3.133 1.974 3.389 . 0 0 "[ . 1 . 2]" 1
243 1 22 LEU H 1 22 LEU HG . . 3.480 2.874 2.509 3.428 . 0 0 "[ . 1 . 2]" 1
244 1 22 LEU H 1 23 SER H . . 3.620 2.518 2.456 2.702 . 0 0 "[ . 1 . 2]" 1
245 1 22 LEU H 1 54 MET ME . . 3.700 3.369 2.734 3.721 0.021 3 0 "[ . 1 . 2]" 1
246 1 22 LEU HA 1 22 LEU QD . . 3.050 1.943 1.893 2.023 . 0 0 "[ . 1 . 2]" 1
247 1 22 LEU HA 1 22 LEU HG . . 3.880 3.034 2.794 3.716 . 0 0 "[ . 1 . 2]" 1
248 1 22 LEU HA 1 25 SER H . . 4.090 3.349 3.173 3.574 . 0 0 "[ . 1 . 2]" 1
249 1 22 LEU HA 1 25 SER HB2 . . 4.360 3.354 2.341 4.316 . 0 0 "[ . 1 . 2]" 1
250 1 22 LEU HA 1 54 MET ME . . 4.420 4.085 3.228 4.553 0.133 12 0 "[ . 1 . 2]" 1
251 1 22 LEU HA 1 60 MET HG3 . . 5.490 3.691 3.425 4.153 . 0 0 "[ . 1 . 2]" 1
252 1 22 LEU HB2 1 23 SER H . . 3.670 2.852 2.728 2.956 . 0 0 "[ . 1 . 2]" 1
253 1 22 LEU HB3 1 22 LEU QD . . 3.180 2.093 2.038 2.151 . 0 0 "[ . 1 . 2]" 1
254 1 22 LEU HB3 1 22 LEU HG . . 2.910 2.976 2.655 3.032 0.122 5 0 "[ . 1 . 2]" 1
255 1 22 LEU HB3 1 23 SER H . . 3.800 3.567 3.491 3.716 . 0 0 "[ . 1 . 2]" 1
256 1 22 LEU QD 1 23 SER H . . 4.740 4.177 3.885 4.261 . 0 0 "[ . 1 . 2]" 1
257 1 22 LEU QD 1 25 SER H . . 5.140 4.555 4.248 4.812 . 0 0 "[ . 1 . 2]" 1
258 1 22 LEU QD 1 54 MET HB3 . . 5.490 3.766 2.922 4.396 . 0 0 "[ . 1 . 2]" 1
259 1 22 LEU QD 1 54 MET ME . . 3.380 2.226 1.620 2.702 . 0 0 "[ . 1 . 2]" 1
260 1 22 LEU QD 1 59 ARG HB2 . . 5.490 3.753 3.205 4.436 . 0 0 "[ . 1 . 2]" 1
261 1 22 LEU QD 1 59 ARG HB3 . . 4.890 2.734 2.141 3.593 . 0 0 "[ . 1 . 2]" 1
262 1 22 LEU QD 1 60 MET HA . . 3.860 2.267 1.953 2.653 . 0 0 "[ . 1 . 2]" 1
263 1 22 LEU QD 1 60 MET HB3 . . 4.300 3.944 3.425 4.245 . 0 0 "[ . 1 . 2]" 1
264 1 22 LEU QD 1 60 MET HG2 . . 3.940 3.840 3.361 3.930 . 0 0 "[ . 1 . 2]" 1
265 1 22 LEU QD 1 60 MET HG3 . . 3.910 2.590 2.166 3.243 . 0 0 "[ . 1 . 2]" 1
266 1 22 LEU HG 1 23 SER H . . 4.740 4.764 4.535 4.932 0.192 14 0 "[ . 1 . 2]" 1
267 1 22 LEU HG 1 54 MET ME . . 3.760 2.138 1.804 2.840 . 0 0 "[ . 1 . 2]" 1
268 1 23 SER H 1 23 SER HB2 . . 4.010 2.195 2.018 3.416 . 0 0 "[ . 1 . 2]" 1
269 1 23 SER H 1 24 ALA H . . 3.470 2.608 2.511 2.714 . 0 0 "[ . 1 . 2]" 1
270 1 23 SER H 1 25 SER H . . 4.560 3.792 3.695 3.948 . 0 0 "[ . 1 . 2]" 1
271 1 23 SER HA 1 23 SER HB2 . . 2.960 2.894 2.282 3.043 0.083 11 0 "[ . 1 . 2]" 1
272 1 23 SER HB2 1 24 ALA H . . 3.590 3.064 2.637 4.079 0.489 3 0 "[ . 1 . 2]" 1
273 1 23 SER HB2 1 27 LEU MD1 . . 5.490 3.580 2.410 4.337 . 0 0 "[ . 1 . 2]" 1
274 1 23 SER HB3 1 24 ALA H . . 4.070 3.178 2.736 3.590 . 0 0 "[ . 1 . 2]" 1
275 1 23 SER HB3 1 24 ALA MB . . 5.240 4.242 3.841 4.806 . 0 0 "[ . 1 . 2]" 1
276 1 24 ALA H 1 24 ALA MB . . 3.000 2.067 1.954 2.168 . 0 0 "[ . 1 . 2]" 1
277 1 24 ALA H 1 27 LEU MD1 . . 5.020 3.693 3.381 4.165 . 0 0 "[ . 1 . 2]" 1
278 1 24 ALA H 1 39 LEU MD2 . . 5.240 4.272 3.879 4.590 . 0 0 "[ . 1 . 2]" 1
279 1 24 ALA HA 1 26 LYS H . . 4.570 4.118 3.705 4.430 . 0 0 "[ . 1 . 2]" 1
280 1 24 ALA HA 1 27 LEU H . . 3.970 3.261 2.826 3.741 . 0 0 "[ . 1 . 2]" 1
281 1 24 ALA HA 1 27 LEU HB3 . . 4.110 3.411 3.040 3.711 . 0 0 "[ . 1 . 2]" 1
282 1 24 ALA HA 1 27 LEU MD1 . . 3.660 2.571 2.115 3.212 . 0 0 "[ . 1 . 2]" 1
283 1 24 ALA HA 1 27 LEU MD2 . . 4.570 4.559 4.409 4.624 0.054 18 0 "[ . 1 . 2]" 1
284 1 24 ALA HA 1 27 LEU HG . . 4.490 4.262 3.655 4.533 0.043 14 0 "[ . 1 . 2]" 1
285 1 24 ALA HA 1 28 TYR H . . 4.570 2.846 2.200 3.425 . 0 0 "[ . 1 . 2]" 1
286 1 24 ALA HA 1 28 TYR QD . . 3.790 2.372 1.996 2.712 . 0 0 "[ . 1 . 2]" 1
287 1 24 ALA HA 1 28 TYR QE . . 4.160 3.881 3.248 4.159 . 0 0 "[ . 1 . 2]" 1
288 1 24 ALA HA 1 39 LEU MD2 . . 4.250 4.089 3.742 4.276 0.026 11 0 "[ . 1 . 2]" 1
289 1 24 ALA MB 1 25 SER H . . 3.540 2.951 2.729 3.064 . 0 0 "[ . 1 . 2]" 1
290 1 24 ALA MB 1 28 TYR HB2 . . 4.660 3.153 2.284 3.610 . 0 0 "[ . 1 . 2]" 1
291 1 24 ALA MB 1 28 TYR QD . . 3.600 2.668 2.147 3.135 . 0 0 "[ . 1 . 2]" 1
292 1 24 ALA MB 1 28 TYR QE . . 3.860 3.697 3.194 3.868 0.008 11 0 "[ . 1 . 2]" 1
293 1 24 ALA MB 1 39 LEU MD2 . . 3.260 2.327 2.051 2.621 . 0 0 "[ . 1 . 2]" 1
294 1 24 ALA MB 1 73 PHE QE . . 4.360 2.981 2.454 3.477 . 0 0 "[ . 1 . 2]" 1
295 1 25 SER H 1 25 SER HB2 . . 3.360 2.868 2.191 3.523 0.163 1 0 "[ . 1 . 2]" 1
296 1 25 SER H 1 26 LYS H . . 3.950 2.589 2.455 2.736 . 0 0 "[ . 1 . 2]" 1
297 1 25 SER HA 1 27 LEU H . . 4.670 3.941 3.700 4.646 . 0 0 "[ . 1 . 2]" 1
298 1 25 SER HA 1 28 TYR H . . 5.240 4.597 3.910 4.930 . 0 0 "[ . 1 . 2]" 1
299 1 25 SER HA 1 73 PHE HB2 . . 5.040 3.286 2.785 3.858 . 0 0 "[ . 1 . 2]" 1
300 1 25 SER HA 1 73 PHE HB3 . . 5.040 2.324 1.995 2.808 . 0 0 "[ . 1 . 2]" 1
301 1 25 SER HA 1 73 PHE QD . . 3.880 2.662 2.368 2.958 . 0 0 "[ . 1 . 2]" 1
302 1 25 SER HA 1 73 PHE QE . . 4.110 3.705 3.325 4.117 0.007 20 0 "[ . 1 . 2]" 1
303 1 25 SER HB2 1 26 LYS H . . 5.370 4.041 3.559 4.343 . 0 0 "[ . 1 . 2]" 1
304 1 25 SER HB2 1 60 MET ME . . 5.240 4.714 3.939 5.362 0.122 17 0 "[ . 1 . 2]" 1
305 1 25 SER HB2 1 60 MET HG2 . . 5.240 4.344 3.556 5.116 . 0 0 "[ . 1 . 2]" 1
306 1 25 SER HB2 1 60 MET HG3 . . 5.240 3.564 2.892 4.689 . 0 0 "[ . 1 . 2]" 1
307 1 25 SER HB2 1 73 PHE QD . . 4.360 2.864 2.068 3.733 . 0 0 "[ . 1 . 2]" 1
308 1 25 SER HB2 1 73 PHE QE . . 4.770 3.624 2.368 4.864 0.094 18 0 "[ . 1 . 2]" 1
309 1 26 LYS H 1 26 LYS HB2 . . 4.130 2.842 2.220 3.688 . 0 0 "[ . 1 . 2]" 1
310 1 26 LYS H 1 26 LYS HB3 . . 3.590 3.264 2.359 3.671 0.081 11 0 "[ . 1 . 2]" 1
311 1 26 LYS H 1 26 LYS HD2 . . 5.240 4.586 2.927 5.076 . 0 0 "[ . 1 . 2]" 1
312 1 26 LYS H 1 26 LYS HG2 . . 3.800 3.200 2.277 3.975 0.175 15 0 "[ . 1 . 2]" 1
313 1 26 LYS H 1 26 LYS HG3 . . 3.970 3.021 2.565 3.974 0.004 16 0 "[ . 1 . 2]" 1
314 1 26 LYS H 1 27 LEU H . . 3.290 2.495 2.096 2.934 . 0 0 "[ . 1 . 2]" 1
315 1 26 LYS H 1 27 LEU HG . . 5.240 4.379 3.782 4.958 . 0 0 "[ . 1 . 2]" 1
316 1 26 LYS H 1 28 TYR H . . 5.070 4.778 4.326 5.061 . 0 0 "[ . 1 . 2]" 1
317 1 26 LYS HA 1 26 LYS HD2 . . 4.360 4.371 3.456 5.218 0.858 6 3 "[ .+* 1 -. 2]" 1
318 1 26 LYS HA 1 26 LYS HG2 . . 3.880 2.862 2.030 3.937 0.057 5 0 "[ . 1 . 2]" 1
319 1 26 LYS HA 1 26 LYS HG3 . . 3.830 3.330 2.473 3.916 0.086 14 0 "[ . 1 . 2]" 1
320 1 26 LYS HB2 1 27 LEU H . . 4.810 4.094 3.110 4.457 . 0 0 "[ . 1 . 2]" 1
321 1 26 LYS HB2 1 27 LEU HG . . 5.240 4.321 3.434 5.251 0.011 14 0 "[ . 1 . 2]" 1
322 1 26 LYS HB3 1 27 LEU H . . 4.300 4.315 3.915 4.570 0.270 19 0 "[ . 1 . 2]" 1
323 1 27 LEU H 1 27 LEU HB2 . . 3.260 2.419 2.096 2.700 . 0 0 "[ . 1 . 2]" 1
324 1 27 LEU H 1 27 LEU HB3 . . 3.960 3.579 3.406 3.729 . 0 0 "[ . 1 . 2]" 1
325 1 27 LEU H 1 27 LEU MD1 . . 4.600 3.695 3.165 4.225 . 0 0 "[ . 1 . 2]" 1
326 1 27 LEU H 1 27 LEU MD2 . . 4.660 4.331 4.044 4.544 . 0 0 "[ . 1 . 2]" 1
327 1 27 LEU H 1 27 LEU HG . . 3.790 3.387 2.791 3.802 0.012 12 0 "[ . 1 . 2]" 1
328 1 27 LEU H 1 28 TYR QD . . 4.300 4.121 3.427 4.301 0.001 8 0 "[ . 1 . 2]" 1
329 1 27 LEU HA 1 27 LEU MD1 . . 4.360 3.802 3.744 3.910 . 0 0 "[ . 1 . 2]" 1
330 1 27 LEU HA 1 27 LEU MD2 . . 2.950 2.415 2.275 2.612 . 0 0 "[ . 1 . 2]" 1
331 1 27 LEU HA 1 27 LEU HG . . 4.070 2.522 2.386 2.780 . 0 0 "[ . 1 . 2]" 1
332 1 27 LEU HA 1 28 TYR QD . . 5.040 4.804 4.144 5.042 0.002 2 0 "[ . 1 . 2]" 1
333 1 27 LEU HB2 1 27 LEU MD1 . . 3.650 2.096 1.967 2.259 . 0 0 "[ . 1 . 2]" 1
334 1 27 LEU HB2 1 28 TYR H . . 3.990 2.324 1.973 2.748 . 0 0 "[ . 1 . 2]" 1
335 1 27 LEU HB2 1 28 TYR QD . . 4.250 2.622 2.209 2.865 . 0 0 "[ . 1 . 2]" 1
336 1 27 LEU HB2 1 28 TYR QE . . 4.770 4.010 3.230 4.321 . 0 0 "[ . 1 . 2]" 1
337 1 27 LEU HB3 1 27 LEU MD1 . . 3.660 2.664 2.508 2.771 . 0 0 "[ . 1 . 2]" 1
338 1 27 LEU HB3 1 28 TYR H . . 4.510 2.703 2.338 3.283 . 0 0 "[ . 1 . 2]" 1
339 1 27 LEU HB3 1 28 TYR QD . . 4.660 2.820 2.350 3.354 . 0 0 "[ . 1 . 2]" 1
340 1 27 LEU HB3 1 28 TYR QE . . 4.770 3.585 2.616 4.163 . 0 0 "[ . 1 . 2]" 1
341 1 27 LEU MD1 1 28 TYR H . . 5.490 4.028 3.659 4.499 . 0 0 "[ . 1 . 2]" 1
342 1 27 LEU MD1 1 28 TYR QD . . 5.040 3.567 3.186 3.832 . 0 0 "[ . 1 . 2]" 1
343 1 27 LEU MD1 1 28 TYR QE . . 4.250 3.524 2.745 3.912 . 0 0 "[ . 1 . 2]" 1
344 1 27 LEU MD2 1 28 TYR QD . . 5.490 4.381 4.128 4.800 . 0 0 "[ . 1 . 2]" 1
345 1 27 LEU MD2 1 28 TYR QE . . 4.890 4.224 3.662 4.854 . 0 0 "[ . 1 . 2]" 1
346 1 28 TYR H 1 28 TYR HB2 . . 3.540 2.218 2.120 2.346 . 0 0 "[ . 1 . 2]" 1
347 1 28 TYR H 1 28 TYR HB3 . . 4.040 3.445 3.419 3.562 . 0 0 "[ . 1 . 2]" 1
348 1 28 TYR H 1 29 ASN H . . 5.460 4.594 4.431 4.670 . 0 0 "[ . 1 . 2]" 1
349 1 28 TYR HB2 1 29 ASN H . . 4.680 4.157 3.700 4.468 . 0 0 "[ . 1 . 2]" 1
350 1 28 TYR HB2 1 30 ASN H . . 4.490 4.412 4.164 4.504 0.014 14 0 "[ . 1 . 2]" 1
351 1 28 TYR HB2 1 31 ILE HB . . 4.660 3.617 3.158 4.007 . 0 0 "[ . 1 . 2]" 1
352 1 28 TYR HB2 1 31 ILE MD . . 4.890 3.854 3.284 4.368 . 0 0 "[ . 1 . 2]" 1
353 1 28 TYR HB2 1 31 ILE MG . . 4.660 3.245 2.914 3.761 . 0 0 "[ . 1 . 2]" 1
354 1 28 TYR HB2 1 73 PHE QD . . 4.040 3.500 2.986 4.036 . 0 0 "[ . 1 . 2]" 1
355 1 28 TYR HB3 1 29 ASN H . . 4.150 3.140 2.537 3.679 . 0 0 "[ . 1 . 2]" 1
356 1 28 TYR HB3 1 30 ASN H . . 3.790 3.069 2.811 3.234 . 0 0 "[ . 1 . 2]" 1
357 1 28 TYR HB3 1 31 ILE HB . . 4.360 2.897 2.506 3.323 . 0 0 "[ . 1 . 2]" 1
358 1 28 TYR HB3 1 31 ILE MD . . 4.770 3.829 3.342 4.403 . 0 0 "[ . 1 . 2]" 1
359 1 28 TYR HB3 1 31 ILE MG . . 4.660 3.493 2.980 3.839 . 0 0 "[ . 1 . 2]" 1
360 1 28 TYR HB3 1 73 PHE QD . . 4.300 4.133 3.251 4.309 0.009 11 0 "[ . 1 . 2]" 1
361 1 28 TYR QD 1 29 ASN H . . 5.360 4.140 3.680 4.654 . 0 0 "[ . 1 . 2]" 1
362 1 28 TYR QD 1 30 ASN H . . 5.250 4.349 3.974 4.677 . 0 0 "[ . 1 . 2]" 1
363 1 28 TYR QD 1 31 ILE HB . . 4.660 3.504 2.813 4.113 . 0 0 "[ . 1 . 2]" 1
364 1 28 TYR QD 1 31 ILE MD . . 4.200 3.421 2.990 3.956 . 0 0 "[ . 1 . 2]" 1
365 1 28 TYR QD 1 31 ILE HG12 . . 5.490 5.712 5.291 6.315 0.825 13 5 "[ -* . 1 + .** 2]" 1
366 1 28 TYR QD 1 31 ILE MG . . 4.890 4.112 3.756 4.398 . 0 0 "[ . 1 . 2]" 1
367 1 28 TYR QD 1 39 LEU MD2 . . 4.360 3.875 3.530 4.233 . 0 0 "[ . 1 . 2]" 1
368 1 28 TYR QE 1 31 ILE HB . . 5.490 5.033 4.557 5.362 . 0 0 "[ . 1 . 2]" 1
369 1 28 TYR QE 1 31 ILE MD . . 4.250 3.674 3.300 4.217 . 0 0 "[ . 1 . 2]" 1
370 1 28 TYR QE 1 39 LEU MD2 . . 3.360 3.196 2.908 3.371 0.011 6 0 "[ . 1 . 2]" 1
371 1 29 ASN H 1 29 ASN HB2 . . 4.040 2.164 2.023 2.413 . 0 0 "[ . 1 . 2]" 1
372 1 29 ASN H 1 29 ASN HB3 . . 3.860 3.367 3.096 3.573 . 0 0 "[ . 1 . 2]" 1
373 1 29 ASN H 1 30 ASN H . . 3.660 2.441 2.171 2.803 . 0 0 "[ . 1 . 2]" 1
374 1 29 ASN HA 1 29 ASN HD22 . . 5.350 4.188 3.576 4.701 . 0 0 "[ . 1 . 2]" 1
375 1 29 ASN HB2 1 30 ASN H . . 3.970 2.888 2.534 3.178 . 0 0 "[ . 1 . 2]" 1
376 1 29 ASN HB2 1 30 ASN HD21 . . 4.970 4.785 2.763 5.580 0.610 1 1 "[+ . 1 . 2]" 1
377 1 29 ASN HB3 1 30 ASN H . . 3.790 3.217 2.759 3.638 . 0 0 "[ . 1 . 2]" 1
378 1 29 ASN HB3 1 30 ASN HD22 . . 5.170 3.445 2.330 4.825 . 0 0 "[ . 1 . 2]" 1
379 1 30 ASN H 1 30 ASN HB3 . . 4.010 3.815 3.659 3.992 . 0 0 "[ . 1 . 2]" 1
380 1 30 ASN H 1 30 ASN HD21 . . 4.460 3.434 2.292 4.463 0.003 14 0 "[ . 1 . 2]" 1
381 1 30 ASN H 1 31 ILE H . . 4.240 4.211 4.132 4.272 0.032 16 0 "[ . 1 . 2]" 1
382 1 30 ASN H 1 31 ILE HA . . 4.890 4.704 4.655 4.761 . 0 0 "[ . 1 . 2]" 1
383 1 30 ASN H 1 31 ILE HB . . 5.240 4.278 4.162 4.456 . 0 0 "[ . 1 . 2]" 1
384 1 30 ASN H 1 31 ILE MG . . 5.240 4.627 4.227 4.904 . 0 0 "[ . 1 . 2]" 1
385 1 30 ASN HA 1 31 ILE H . . 3.050 2.303 2.300 2.308 . 0 0 "[ . 1 . 2]" 1
386 1 30 ASN HA 1 31 ILE HB . . 4.770 4.480 4.363 4.603 . 0 0 "[ . 1 . 2]" 1
387 1 30 ASN HA 1 31 ILE MG . . 4.360 3.645 3.387 3.875 . 0 0 "[ . 1 . 2]" 1
388 1 30 ASN HA 1 70 ILE MG . . 4.360 3.632 3.354 4.009 . 0 0 "[ . 1 . 2]" 1
389 1 30 ASN HA 1 71 VAL QG . . 5.490 4.378 3.427 5.017 . 0 0 "[ . 1 . 2]" 1
390 1 30 ASN HA 1 73 PHE QD . . 4.770 3.493 2.780 4.383 . 0 0 "[ . 1 . 2]" 1
391 1 30 ASN HB2 1 31 ILE H . . 3.790 3.432 3.219 3.786 . 0 0 "[ . 1 . 2]" 1
392 1 30 ASN HB2 1 31 ILE HA . . 4.160 4.094 4.023 4.181 0.021 7 0 "[ . 1 . 2]" 1
393 1 30 ASN HB2 1 70 ILE MD . . 4.890 4.074 3.622 4.629 . 0 0 "[ . 1 . 2]" 1
394 1 30 ASN HB2 1 70 ILE MG . . 3.650 2.708 2.251 3.295 . 0 0 "[ . 1 . 2]" 1
395 1 30 ASN HB3 1 31 ILE H . . 3.830 3.653 3.292 3.861 0.031 3 0 "[ . 1 . 2]" 1
396 1 30 ASN HB3 1 70 ILE MG . . 3.860 2.874 2.276 3.407 . 0 0 "[ . 1 . 2]" 1
397 1 30 ASN HD21 1 31 ILE H . . 5.450 4.618 4.363 5.478 0.028 11 0 "[ . 1 . 2]" 1
398 1 31 ILE H 1 31 ILE HB . . 3.970 3.315 3.215 3.416 . 0 0 "[ . 1 . 2]" 1
399 1 31 ILE H 1 31 ILE MD . . 5.490 4.749 4.646 4.787 . 0 0 "[ . 1 . 2]" 1
400 1 31 ILE H 1 31 ILE HG12 . . 4.910 4.521 4.355 4.689 . 0 0 "[ . 1 . 2]" 1
401 1 31 ILE H 1 31 ILE MG . . 3.380 2.259 2.074 2.492 . 0 0 "[ . 1 . 2]" 1
402 1 31 ILE H 1 70 ILE MG . . 3.800 2.785 2.373 3.291 . 0 0 "[ . 1 . 2]" 1
403 1 31 ILE H 1 71 VAL H . . 4.310 3.401 2.846 3.865 . 0 0 "[ . 1 . 2]" 1
404 1 31 ILE H 1 71 VAL HB . . 5.040 3.860 3.112 4.942 . 0 0 "[ . 1 . 2]" 1
405 1 31 ILE H 1 71 VAL QG . . 4.490 3.406 1.989 4.152 . 0 0 "[ . 1 . 2]" 1
406 1 31 ILE HA 1 31 ILE HG12 . . 4.040 3.066 2.941 3.152 . 0 0 "[ . 1 . 2]" 1
407 1 31 ILE HA 1 31 ILE HG13 . . 3.650 2.431 2.238 2.686 . 0 0 "[ . 1 . 2]" 1
408 1 31 ILE HA 1 32 THR H . . 3.140 2.292 2.264 2.309 . 0 0 "[ . 1 . 2]" 1
409 1 31 ILE HA 1 35 GLU HB2 . . 4.770 3.900 3.762 4.075 . 0 0 "[ . 1 . 2]" 1
410 1 31 ILE HA 1 35 GLU HB3 . . 4.890 4.769 4.597 4.804 . 0 0 "[ . 1 . 2]" 1
411 1 31 ILE HA 1 70 ILE MG . . 5.040 3.613 3.144 4.218 . 0 0 "[ . 1 . 2]" 1
412 1 31 ILE HB 1 31 ILE MD . . 3.160 2.309 2.120 2.500 . 0 0 "[ . 1 . 2]" 1
413 1 31 ILE HB 1 73 PHE QE . . 4.770 3.931 2.596 4.604 . 0 0 "[ . 1 . 2]" 1
414 1 31 ILE MD 1 31 ILE MG . . 3.050 2.018 1.873 2.242 . 0 0 "[ . 1 . 2]" 1
415 1 31 ILE MD 1 32 THR H . . 4.520 4.045 3.977 4.114 . 0 0 "[ . 1 . 2]" 1
416 1 31 ILE MD 1 35 GLU H . . 4.890 4.470 4.283 4.735 . 0 0 "[ . 1 . 2]" 1
417 1 31 ILE MD 1 35 GLU HB2 . . 3.680 2.967 2.781 3.253 . 0 0 "[ . 1 . 2]" 1
418 1 31 ILE MD 1 35 GLU HB3 . . 4.250 2.373 1.993 2.610 . 0 0 "[ . 1 . 2]" 1
419 1 31 ILE MD 1 35 GLU HG2 . . 4.890 4.801 4.526 4.913 0.023 8 0 "[ . 1 . 2]" 1
420 1 31 ILE MD 1 35 GLU HG3 . . 4.770 4.379 4.053 4.903 0.133 18 0 "[ . 1 . 2]" 1
421 1 31 ILE MD 1 36 LEU H . . 4.330 2.996 2.602 3.375 . 0 0 "[ . 1 . 2]" 1
422 1 31 ILE MD 1 36 LEU HA . . 3.320 1.971 1.758 2.349 . 0 0 "[ . 1 . 2]" 1
423 1 31 ILE MD 1 36 LEU HB3 . . 5.040 4.020 3.412 4.479 . 0 0 "[ . 1 . 2]" 1
424 1 31 ILE MD 1 36 LEU QD . . 3.460 2.655 2.232 3.001 . 0 0 "[ . 1 . 2]" 1
425 1 31 ILE MD 1 36 LEU HG . . 4.770 3.591 1.972 4.778 0.008 6 0 "[ . 1 . 2]" 1
426 1 31 ILE MD 1 37 GLY H . . 5.490 4.652 4.260 5.083 . 0 0 "[ . 1 . 2]" 1
427 1 31 ILE MD 1 39 LEU H . . 5.240 4.102 3.807 4.522 . 0 0 "[ . 1 . 2]" 1
428 1 31 ILE MD 1 39 LEU HB3 . . 4.570 3.173 2.958 3.522 . 0 0 "[ . 1 . 2]" 1
429 1 31 ILE MD 1 39 LEU HG . . 5.490 4.825 4.587 5.216 . 0 0 "[ . 1 . 2]" 1
430 1 31 ILE MD 1 73 PHE QD . . 5.240 5.233 5.130 5.260 0.020 7 0 "[ . 1 . 2]" 1
431 1 31 ILE MD 1 73 PHE QE . . 4.570 3.791 3.342 4.170 . 0 0 "[ . 1 . 2]" 1
432 1 31 ILE HG12 1 31 ILE MG . . 3.470 2.409 2.277 2.592 . 0 0 "[ . 1 . 2]" 1
433 1 31 ILE HG12 1 32 THR H . . 3.750 2.555 2.345 2.754 . 0 0 "[ . 1 . 2]" 1
434 1 31 ILE HG12 1 35 GLU H . . 4.740 3.796 3.721 3.906 . 0 0 "[ . 1 . 2]" 1
435 1 31 ILE HG12 1 35 GLU HB2 . . 3.970 2.245 2.075 2.427 . 0 0 "[ . 1 . 2]" 1
436 1 31 ILE HG12 1 35 GLU HB3 . . 3.970 3.067 2.714 3.486 . 0 0 "[ . 1 . 2]" 1
437 1 31 ILE HG12 1 35 GLU HG2 . . 5.040 4.823 4.589 5.053 0.013 18 0 "[ . 1 . 2]" 1
438 1 31 ILE HG12 1 35 GLU HG3 . . 5.040 4.420 4.215 4.659 . 0 0 "[ . 1 . 2]" 1
439 1 31 ILE HG12 1 36 LEU H . . 4.570 2.379 2.258 2.521 . 0 0 "[ . 1 . 2]" 1
440 1 31 ILE HG12 1 36 LEU HA . . 4.360 3.303 3.071 3.588 . 0 0 "[ . 1 . 2]" 1
441 1 31 ILE HG13 1 32 THR H . . 3.610 2.661 2.531 2.891 . 0 0 "[ . 1 . 2]" 1
442 1 31 ILE HG13 1 35 GLU H . . 4.610 4.435 4.269 4.571 . 0 0 "[ . 1 . 2]" 1
443 1 31 ILE HG13 1 35 GLU HB2 . . 3.880 2.213 1.998 2.462 . 0 0 "[ . 1 . 2]" 1
444 1 31 ILE HG13 1 35 GLU HB3 . . 3.880 2.504 2.375 2.681 . 0 0 "[ . 1 . 2]" 1
445 1 31 ILE HG13 1 35 GLU HG2 . . 4.660 4.491 4.221 4.672 0.012 7 0 "[ . 1 . 2]" 1
446 1 31 ILE HG13 1 35 GLU HG3 . . 4.660 3.590 3.307 4.476 . 0 0 "[ . 1 . 2]" 1
447 1 31 ILE HG13 1 36 LEU H . . 4.890 3.774 3.493 4.027 . 0 0 "[ . 1 . 2]" 1
448 1 31 ILE MG 1 32 THR H . . 4.580 3.825 3.616 4.009 . 0 0 "[ . 1 . 2]" 1
449 1 31 ILE MG 1 35 GLU HB3 . . 5.240 4.752 4.481 5.084 . 0 0 "[ . 1 . 2]" 1
450 1 31 ILE MG 1 36 LEU H . . 4.360 3.687 3.469 3.985 . 0 0 "[ . 1 . 2]" 1
451 1 31 ILE MG 1 36 LEU HA . . 4.360 3.298 2.873 3.672 . 0 0 "[ . 1 . 2]" 1
452 1 31 ILE MG 1 36 LEU HB3 . . 4.200 3.711 3.483 4.209 0.009 13 0 "[ . 1 . 2]" 1
453 1 31 ILE MG 1 36 LEU HG . . 4.200 3.335 2.038 4.151 . 0 0 "[ . 1 . 2]" 1
454 1 31 ILE MG 1 71 VAL H . . 4.490 3.912 3.584 4.418 . 0 0 "[ . 1 . 2]" 1
455 1 31 ILE MG 1 71 VAL HB . . 3.910 3.278 2.641 4.027 0.117 13 0 "[ . 1 . 2]" 1
456 1 31 ILE MG 1 73 PHE QD . . 4.770 2.994 2.377 3.648 . 0 0 "[ . 1 . 2]" 1
457 1 31 ILE MG 1 73 PHE QE . . 3.360 1.877 1.768 2.046 . 0 0 "[ . 1 . 2]" 1
458 1 31 ILE MG 1 73 PHE HZ . . 3.910 3.240 1.867 3.868 . 0 0 "[ . 1 . 2]" 1
459 1 32 THR H 1 32 THR MG . . 3.250 2.077 1.909 2.613 . 0 0 "[ . 1 . 2]" 1
460 1 32 THR H 1 35 GLU HB2 . . 4.250 2.524 2.413 2.703 . 0 0 "[ . 1 . 2]" 1
461 1 32 THR H 1 35 GLU HB3 . . 3.850 4.043 3.875 4.181 0.331 19 0 "[ . 1 . 2]" 1
462 1 32 THR H 1 35 GLU HG2 . . 5.040 4.277 3.523 4.951 . 0 0 "[ . 1 . 2]" 1
463 1 32 THR H 1 35 GLU HG3 . . 5.040 3.698 3.400 3.985 . 0 0 "[ . 1 . 2]" 1
464 1 32 THR H 1 36 LEU H . . 4.900 3.819 3.642 4.024 . 0 0 "[ . 1 . 2]" 1
465 1 32 THR HA 1 33 PHE H . . 3.080 2.441 2.392 2.510 . 0 0 "[ . 1 . 2]" 1
466 1 32 THR MG 1 33 PHE H . . 4.160 3.584 3.224 4.064 . 0 0 "[ . 1 . 2]" 1
467 1 32 THR MG 1 34 GLU H . . 4.630 3.054 1.943 4.503 . 0 0 "[ . 1 . 2]" 1
468 1 32 THR MG 1 35 GLU H . . 4.780 2.741 1.728 4.484 . 0 0 "[ . 1 . 2]" 1
469 1 32 THR MG 1 35 GLU HG2 . . 5.240 3.232 1.948 4.692 . 0 0 "[ . 1 . 2]" 1
470 1 33 PHE H 1 33 PHE HB2 . . 4.000 2.513 2.397 2.614 . 0 0 "[ . 1 . 2]" 1
471 1 33 PHE H 1 33 PHE HB3 . . 3.620 3.459 3.447 3.465 . 0 0 "[ . 1 . 2]" 1
472 1 33 PHE H 1 33 PHE QD . . 3.970 2.702 2.439 2.993 . 0 0 "[ . 1 . 2]" 1
473 1 33 PHE H 1 34 GLU H . . 3.710 2.733 2.651 2.777 . 0 0 "[ . 1 . 2]" 1
474 1 33 PHE H 1 44 ALA MB . . 4.890 3.986 3.828 4.098 . 0 0 "[ . 1 . 2]" 1
475 1 33 PHE H 1 70 ILE HA . . 4.070 3.741 3.352 4.070 . 0 0 "[ . 1 . 2]" 1
476 1 33 PHE H 1 71 VAL QG . . 5.490 3.716 3.501 3.971 . 0 0 "[ . 1 . 2]" 1
477 1 33 PHE HA 1 33 PHE QD . . 3.270 2.472 2.026 2.736 . 0 0 "[ . 1 . 2]" 1
478 1 33 PHE HA 1 36 LEU H . . 4.160 3.474 3.387 3.543 . 0 0 "[ . 1 . 2]" 1
479 1 33 PHE HA 1 36 LEU HB2 . . 3.940 3.318 2.831 3.530 . 0 0 "[ . 1 . 2]" 1
480 1 33 PHE HA 1 36 LEU HB3 . . 3.720 2.463 2.264 2.859 . 0 0 "[ . 1 . 2]" 1
481 1 33 PHE HA 1 36 LEU QD . . 4.300 3.285 3.067 3.450 . 0 0 "[ . 1 . 2]" 1
482 1 33 PHE HA 1 37 GLY H . . 4.740 3.504 3.282 3.627 . 0 0 "[ . 1 . 2]" 1
483 1 33 PHE HA 1 44 ALA MB . . 4.770 3.591 3.484 3.761 . 0 0 "[ . 1 . 2]" 1
484 1 33 PHE HA 1 47 ALA MB . . 4.360 2.920 2.490 3.147 . 0 0 "[ . 1 . 2]" 1
485 1 33 PHE HA 1 71 VAL QG . . 5.240 3.440 3.273 3.653 . 0 0 "[ . 1 . 2]" 1
486 1 33 PHE HB2 1 34 GLU H . . 4.250 2.598 2.537 2.721 . 0 0 "[ . 1 . 2]" 1
487 1 33 PHE HB2 1 34 GLU HA . . 5.490 4.019 3.930 4.137 . 0 0 "[ . 1 . 2]" 1
488 1 33 PHE HB2 1 37 GLY H . . 5.490 5.273 5.092 5.481 . 0 0 "[ . 1 . 2]" 1
489 1 33 PHE HB2 1 44 ALA HA . . 4.360 3.550 3.258 3.863 . 0 0 "[ . 1 . 2]" 1
490 1 33 PHE HB2 1 44 ALA MB . . 3.660 1.984 1.773 2.139 . 0 0 "[ . 1 . 2]" 1
491 1 33 PHE HB2 1 47 ALA MB . . 4.420 4.592 4.323 4.782 0.362 8 0 "[ . 1 . 2]" 1
492 1 33 PHE HB2 1 48 GLU HB2 . . 5.240 4.266 3.955 4.566 . 0 0 "[ . 1 . 2]" 1
493 1 33 PHE HB3 1 34 GLU H . . 3.760 3.804 3.717 3.912 0.152 4 0 "[ . 1 . 2]" 1
494 1 33 PHE HB3 1 34 GLU HA . . 5.240 4.482 4.394 4.606 . 0 0 "[ . 1 . 2]" 1
495 1 33 PHE HB3 1 44 ALA HA . . 4.770 2.334 2.163 2.591 . 0 0 "[ . 1 . 2]" 1
496 1 33 PHE HB3 1 44 ALA MB . . 3.760 1.956 1.896 2.181 . 0 0 "[ . 1 . 2]" 1
497 1 33 PHE HB3 1 47 ALA MB . . 4.770 3.230 2.931 3.465 . 0 0 "[ . 1 . 2]" 1
498 1 33 PHE HB3 1 48 GLU HB2 . . 5.490 3.057 2.732 3.306 . 0 0 "[ . 1 . 2]" 1
499 1 33 PHE HB3 1 71 VAL QG . . 5.490 4.668 4.319 5.071 . 0 0 "[ . 1 . 2]" 1
500 1 33 PHE QD 1 36 LEU HB2 . . 5.490 4.940 4.313 5.415 . 0 0 "[ . 1 . 2]" 1
501 1 33 PHE QD 1 36 LEU HB3 . . 5.040 4.168 3.646 4.393 . 0 0 "[ . 1 . 2]" 1
502 1 33 PHE QD 1 36 LEU QD . . 3.970 3.557 3.082 3.911 . 0 0 "[ . 1 . 2]" 1
503 1 33 PHE QD 1 44 ALA HA . . 5.490 4.243 4.011 4.513 . 0 0 "[ . 1 . 2]" 1
504 1 33 PHE QD 1 44 ALA MB . . 4.570 3.329 2.995 3.587 . 0 0 "[ . 1 . 2]" 1
505 1 33 PHE QD 1 47 ALA MB . . 3.970 3.335 3.017 3.773 . 0 0 "[ . 1 . 2]" 1
506 1 33 PHE QD 1 48 GLU HA . . 3.940 2.638 2.376 2.881 . 0 0 "[ . 1 . 2]" 1
507 1 33 PHE QD 1 48 GLU HB2 . . 4.890 2.873 2.481 3.162 . 0 0 "[ . 1 . 2]" 1
508 1 33 PHE QD 1 48 GLU HB3 . . 5.240 4.338 3.975 4.592 . 0 0 "[ . 1 . 2]" 1
509 1 33 PHE QD 1 48 GLU HG2 . . 4.660 4.658 4.507 5.039 0.379 5 0 "[ . 1 . 2]" 1
510 1 33 PHE QD 1 69 GLY HA2 . . 4.770 4.221 3.946 4.438 . 0 0 "[ . 1 . 2]" 1
511 1 33 PHE QD 1 69 GLY HA3 . . 4.890 3.821 3.336 4.243 . 0 0 "[ . 1 . 2]" 1
512 1 33 PHE QD 1 70 ILE HA . . 4.890 4.663 4.403 4.895 0.005 15 0 "[ . 1 . 2]" 1
513 1 33 PHE QD 1 71 VAL QG . . 4.300 2.681 2.464 2.937 . 0 0 "[ . 1 . 2]" 1
514 1 33 PHE QE 1 48 GLU HG2 . . 4.490 3.836 3.402 4.325 . 0 0 "[ . 1 . 2]" 1
515 1 33 PHE QE 1 48 GLU HG3 . . 4.360 2.831 2.604 3.112 . 0 0 "[ . 1 . 2]" 1
516 1 33 PHE QE 1 64 ILE MD . . 4.420 2.087 1.960 2.875 . 0 0 "[ . 1 . 2]" 1
517 1 33 PHE QE 1 64 ILE HG12 . . 5.040 3.350 2.459 3.925 . 0 0 "[ . 1 . 2]" 1
518 1 33 PHE QE 1 64 ILE HG13 . . 5.240 4.587 4.024 4.915 . 0 0 "[ . 1 . 2]" 1
519 1 33 PHE QE 1 64 ILE MG . . 3.810 2.370 2.188 2.656 . 0 0 "[ . 1 . 2]" 1
520 1 33 PHE QE 1 66 GLN HA . . 5.040 3.885 3.623 4.048 . 0 0 "[ . 1 . 2]" 1
521 1 33 PHE QE 1 66 GLN QG . . 4.770 4.291 3.856 4.489 . 0 0 "[ . 1 . 2]" 1
522 1 33 PHE QE 1 69 GLY HA2 . . 4.200 2.137 1.997 2.691 . 0 0 "[ . 1 . 2]" 1
523 1 33 PHE QE 1 69 GLY HA3 . . 4.360 2.658 2.097 3.473 . 0 0 "[ . 1 . 2]" 1
524 1 33 PHE QE 1 71 VAL H . . 5.470 4.759 4.266 5.076 . 0 0 "[ . 1 . 2]" 1
525 1 33 PHE QE 1 71 VAL HA . . 5.040 4.234 3.892 4.507 . 0 0 "[ . 1 . 2]" 1
526 1 33 PHE QE 1 71 VAL HB . . 5.500 4.867 4.549 5.282 . 0 0 "[ . 1 . 2]" 1
527 1 33 PHE QE 1 71 VAL QG . . 3.680 2.129 1.901 2.412 . 0 0 "[ . 1 . 2]" 1
528 1 33 PHE HZ 1 48 GLU HA . . 5.240 4.856 4.108 5.254 0.014 16 0 "[ . 1 . 2]" 1
529 1 33 PHE HZ 1 48 GLU HG2 . . 4.980 4.683 4.096 4.983 0.003 10 0 "[ . 1 . 2]" 1
530 1 33 PHE HZ 1 48 GLU HG3 . . 4.420 3.212 2.721 3.550 . 0 0 "[ . 1 . 2]" 1
531 1 33 PHE HZ 1 64 ILE MD . . 4.250 3.463 3.115 4.052 . 0 0 "[ . 1 . 2]" 1
532 1 33 PHE HZ 1 64 ILE HG12 . . 4.570 4.354 3.700 4.583 0.013 20 0 "[ . 1 . 2]" 1
533 1 33 PHE HZ 1 64 ILE HG13 . . 5.500 5.488 5.084 5.582 0.082 8 0 "[ . 1 . 2]" 1
534 1 33 PHE HZ 1 64 ILE MG . . 3.680 1.846 1.800 1.922 . 0 0 "[ . 1 . 2]" 1
535 1 33 PHE HZ 1 66 GLN HA . . 4.040 3.980 3.663 4.056 0.016 14 0 "[ . 1 . 2]" 1
536 1 33 PHE HZ 1 66 GLN QG . . 5.500 3.666 3.388 3.799 . 0 0 "[ . 1 . 2]" 1
537 1 33 PHE HZ 1 69 GLY HA3 . . 5.490 4.595 3.769 5.133 . 0 0 "[ . 1 . 2]" 1
538 1 33 PHE HZ 1 71 VAL HA . . 5.490 4.710 4.199 5.318 . 0 0 "[ . 1 . 2]" 1
539 1 33 PHE HZ 1 71 VAL QG . . 4.200 3.347 2.898 3.764 . 0 0 "[ . 1 . 2]" 1
540 1 34 GLU H 1 34 GLU HB2 . . 3.190 2.326 2.173 2.481 . 0 0 "[ . 1 . 2]" 1
541 1 34 GLU H 1 34 GLU HB3 . . 3.630 3.521 3.464 3.551 . 0 0 "[ . 1 . 2]" 1
542 1 34 GLU H 1 34 GLU HG3 . . 3.740 2.509 2.098 3.304 . 0 0 "[ . 1 . 2]" 1
543 1 34 GLU H 1 35 GLU H . . 3.640 2.736 2.659 2.785 . 0 0 "[ . 1 . 2]" 1
544 1 34 GLU H 1 44 ALA MB . . 4.250 2.940 2.726 3.241 . 0 0 "[ . 1 . 2]" 1
545 1 34 GLU HA 1 34 GLU HG3 . . 3.380 2.703 2.310 3.674 0.294 6 0 "[ . 1 . 2]" 1
546 1 34 GLU HA 1 37 GLY H . . 4.250 3.716 3.685 3.804 . 0 0 "[ . 1 . 2]" 1
547 1 34 GLU HA 1 38 ALA H . . 5.040 4.183 4.016 4.360 . 0 0 "[ . 1 . 2]" 1
548 1 34 GLU HA 1 44 ALA H . . 5.130 3.791 3.640 4.009 . 0 0 "[ . 1 . 2]" 1
549 1 34 GLU HA 1 44 ALA HA . . 3.860 3.826 3.553 3.875 0.015 19 0 "[ . 1 . 2]" 1
550 1 34 GLU HA 1 44 ALA MB . . 3.030 2.447 2.244 2.692 . 0 0 "[ . 1 . 2]" 1
551 1 34 GLU HB2 1 35 GLU H . . 3.910 2.600 2.515 2.760 . 0 0 "[ . 1 . 2]" 1
552 1 34 GLU HG3 1 35 GLU H . . 4.770 4.558 4.232 4.786 0.016 6 0 "[ . 1 . 2]" 1
553 1 34 GLU HG3 1 44 ALA MB . . 3.650 2.757 2.382 3.808 0.158 6 0 "[ . 1 . 2]" 1
554 1 35 GLU H 1 35 GLU HB2 . . 3.700 2.315 2.186 2.452 . 0 0 "[ . 1 . 2]" 1
555 1 35 GLU H 1 35 GLU HB3 . . 3.470 3.525 3.473 3.558 0.088 8 0 "[ . 1 . 2]" 1
556 1 35 GLU H 1 35 GLU HG2 . . 3.660 2.630 2.201 3.582 . 0 0 "[ . 1 . 2]" 1
557 1 35 GLU H 1 35 GLU HG3 . . 3.620 3.479 2.249 3.669 0.049 12 0 "[ . 1 . 2]" 1
558 1 35 GLU H 1 36 LEU H . . 3.220 2.578 2.544 2.623 . 0 0 "[ . 1 . 2]" 1
559 1 35 GLU H 1 37 GLY H . . 5.170 4.011 3.974 4.077 . 0 0 "[ . 1 . 2]" 1
560 1 35 GLU HA 1 35 GLU HG2 . . 3.610 2.705 2.419 3.111 . 0 0 "[ . 1 . 2]" 1
561 1 35 GLU HA 1 37 GLY H . . 4.180 4.336 4.299 4.407 0.227 20 0 "[ . 1 . 2]" 1
562 1 35 GLU HA 1 38 ALA H . . 3.630 3.117 3.067 3.167 . 0 0 "[ . 1 . 2]" 1
563 1 35 GLU HA 1 38 ALA MB . . 3.150 2.133 1.991 2.324 . 0 0 "[ . 1 . 2]" 1
564 1 35 GLU HB2 1 36 LEU H . . 4.250 2.661 2.563 2.761 . 0 0 "[ . 1 . 2]" 1
565 1 35 GLU HB3 1 36 LEU H . . 3.870 3.522 3.341 3.712 . 0 0 "[ . 1 . 2]" 1
566 1 35 GLU HG2 1 36 LEU H . . 5.240 4.579 4.275 5.101 . 0 0 "[ . 1 . 2]" 1
567 1 35 GLU HG3 1 36 LEU H . . 5.240 4.910 4.352 5.031 . 0 0 "[ . 1 . 2]" 1
568 1 36 LEU H 1 36 LEU HB2 . . 3.230 2.236 2.020 2.391 . 0 0 "[ . 1 . 2]" 1
569 1 36 LEU H 1 36 LEU HB3 . . 3.310 2.661 2.478 2.986 . 0 0 "[ . 1 . 2]" 1
570 1 36 LEU H 1 36 LEU QD . . 4.550 3.623 3.516 3.717 . 0 0 "[ . 1 . 2]" 1
571 1 36 LEU H 1 37 GLY HA3 . . 5.170 4.985 4.970 4.998 . 0 0 "[ . 1 . 2]" 1
572 1 36 LEU HA 1 36 LEU QD . . 2.980 2.275 1.911 2.793 . 0 0 "[ . 1 . 2]" 1
573 1 36 LEU HA 1 36 LEU HG . . 4.160 2.823 2.262 3.512 . 0 0 "[ . 1 . 2]" 1
574 1 36 LEU HA 1 38 ALA H . . 5.040 4.298 4.209 4.375 . 0 0 "[ . 1 . 2]" 1
575 1 36 LEU HA 1 39 LEU H . . 3.780 3.448 3.326 3.584 . 0 0 "[ . 1 . 2]" 1
576 1 36 LEU HA 1 39 LEU HB3 . . 3.500 2.687 2.514 2.939 . 0 0 "[ . 1 . 2]" 1
577 1 36 LEU HA 1 39 LEU MD2 . . 3.510 2.810 2.654 3.049 . 0 0 "[ . 1 . 2]" 1
578 1 36 LEU HA 1 39 LEU HG . . 4.660 4.456 4.324 4.602 . 0 0 "[ . 1 . 2]" 1
579 1 36 LEU HA 1 40 LEU H . . 4.420 4.470 4.424 4.521 0.101 20 0 "[ . 1 . 2]" 1
580 1 36 LEU HA 1 40 LEU MD1 . . 4.160 3.723 3.490 3.979 . 0 0 "[ . 1 . 2]" 1
581 1 36 LEU HB2 1 37 GLY H . . 3.970 3.798 3.476 3.949 . 0 0 "[ . 1 . 2]" 1
582 1 36 LEU HB3 1 37 GLY H . . 3.730 2.715 2.657 2.788 . 0 0 "[ . 1 . 2]" 1
583 1 36 LEU HB3 1 37 GLY HA2 . . 4.890 4.240 4.035 4.406 . 0 0 "[ . 1 . 2]" 1
584 1 36 LEU HB3 1 37 GLY HA3 . . 4.890 4.448 4.386 4.542 . 0 0 "[ . 1 . 2]" 1
585 1 36 LEU HB3 1 38 ALA H . . 4.750 4.951 4.918 4.982 0.232 13 0 "[ . 1 . 2]" 1
586 1 36 LEU HB3 1 40 LEU MD1 . . 3.660 3.615 3.251 3.732 0.072 2 0 "[ . 1 . 2]" 1
587 1 36 LEU HB3 1 47 ALA MB . . 3.970 2.566 2.151 2.994 . 0 0 "[ . 1 . 2]" 1
588 1 36 LEU QD 1 37 GLY H . . 4.820 3.855 3.271 4.126 . 0 0 "[ . 1 . 2]" 1
589 1 36 LEU QD 1 39 LEU H . . 4.890 4.337 3.817 4.557 . 0 0 "[ . 1 . 2]" 1
590 1 36 LEU QD 1 39 LEU HB3 . . 3.740 3.451 2.973 3.723 . 0 0 "[ . 1 . 2]" 1
591 1 36 LEU QD 1 40 LEU H . . 4.770 4.137 3.598 4.632 . 0 0 "[ . 1 . 2]" 1
592 1 36 LEU QD 1 40 LEU HG . . 3.910 3.026 2.473 3.608 . 0 0 "[ . 1 . 2]" 1
593 1 36 LEU QD 1 47 ALA HA . . 5.240 3.724 3.242 4.212 . 0 0 "[ . 1 . 2]" 1
594 1 36 LEU QD 1 47 ALA MB . . 3.230 2.335 1.738 2.824 . 0 0 "[ . 1 . 2]" 1
595 1 36 LEU QD 1 51 ALA H . . 5.240 4.292 3.776 4.502 . 0 0 "[ . 1 . 2]" 1
596 1 36 LEU QD 1 73 PHE QD . . 5.490 4.195 3.877 4.515 . 0 0 "[ . 1 . 2]" 1
597 1 36 LEU QD 1 73 PHE QE . . 4.420 2.513 2.142 2.895 . 0 0 "[ . 1 . 2]" 1
598 1 36 LEU QD 1 73 PHE HZ . . 4.250 2.016 1.738 2.692 . 0 0 "[ . 1 . 2]" 1
599 1 36 LEU HG 1 37 GLY H . . 4.890 4.554 3.977 5.125 0.235 20 0 "[ . 1 . 2]" 1
600 1 36 LEU HG 1 40 LEU MD1 . . 3.810 2.783 1.942 3.859 0.049 13 0 "[ . 1 . 2]" 1
601 1 37 GLY H 1 38 ALA H . . 3.440 2.526 2.480 2.583 . 0 0 "[ . 1 . 2]" 1
602 1 37 GLY H 1 38 ALA HA . . 5.490 5.096 5.047 5.147 . 0 0 "[ . 1 . 2]" 1
603 1 37 GLY H 1 38 ALA MB . . 4.770 4.120 4.052 4.205 . 0 0 "[ . 1 . 2]" 1
604 1 37 GLY H 1 39 LEU H . . 4.780 3.922 3.860 3.976 . 0 0 "[ . 1 . 2]" 1
605 1 37 GLY H 1 44 ALA HA . . 4.450 3.704 3.555 3.878 . 0 0 "[ . 1 . 2]" 1
606 1 37 GLY H 1 47 ALA MB . . 4.080 3.059 2.719 3.161 . 0 0 "[ . 1 . 2]" 1
607 1 37 GLY HA2 1 38 ALA H . . 3.610 3.586 3.583 3.588 . 0 0 "[ . 1 . 2]" 1
608 1 37 GLY HA2 1 39 LEU H . . 5.040 3.996 3.957 4.027 . 0 0 "[ . 1 . 2]" 1
609 1 37 GLY HA2 1 40 LEU H . . 4.660 3.205 3.103 3.260 . 0 0 "[ . 1 . 2]" 1
610 1 37 GLY HA2 1 40 LEU QB . . 4.660 3.267 2.987 3.421 . 0 0 "[ . 1 . 2]" 1
611 1 37 GLY HA2 1 40 LEU MD1 . . 5.040 2.303 1.963 2.697 . 0 0 "[ . 1 . 2]" 1
612 1 37 GLY HA2 1 41 GLU H . . 5.310 4.363 4.176 4.588 . 0 0 "[ . 1 . 2]" 1
613 1 37 GLY HA2 1 42 ILE H . . 4.150 3.076 2.986 3.193 . 0 0 "[ . 1 . 2]" 1
614 1 37 GLY HA2 1 42 ILE MD . . 4.890 3.455 3.230 3.616 . 0 0 "[ . 1 . 2]" 1
615 1 37 GLY HA2 1 42 ILE HG12 . . 4.250 2.131 1.980 2.282 . 0 0 "[ . 1 . 2]" 1
616 1 37 GLY HA2 1 42 ILE HG13 . . 4.300 2.700 2.333 2.942 . 0 0 "[ . 1 . 2]" 1
617 1 37 GLY HA2 1 47 ALA MB . . 3.630 2.339 2.201 2.572 . 0 0 "[ . 1 . 2]" 1
618 1 37 GLY HA3 1 38 ALA H . . 3.530 2.995 2.987 3.003 . 0 0 "[ . 1 . 2]" 1
619 1 37 GLY HA3 1 39 LEU H . . 5.240 4.484 4.459 4.530 . 0 0 "[ . 1 . 2]" 1
620 1 37 GLY HA3 1 40 LEU H . . 4.570 4.490 4.399 4.541 . 0 0 "[ . 1 . 2]" 1
621 1 37 GLY HA3 1 40 LEU MD1 . . 5.040 3.798 3.507 4.085 . 0 0 "[ . 1 . 2]" 1
622 1 37 GLY HA3 1 42 ILE H . . 4.300 3.933 3.777 4.095 . 0 0 "[ . 1 . 2]" 1
623 1 37 GLY HA3 1 42 ILE MD . . 4.770 4.429 4.216 4.617 . 0 0 "[ . 1 . 2]" 1
624 1 37 GLY HA3 1 42 ILE HG12 . . 4.250 3.452 3.131 3.650 . 0 0 "[ . 1 . 2]" 1
625 1 37 GLY HA3 1 42 ILE HG13 . . 4.570 3.217 3.003 3.417 . 0 0 "[ . 1 . 2]" 1
626 1 37 GLY HA3 1 42 ILE MG . . 5.240 5.106 4.944 5.234 . 0 0 "[ . 1 . 2]" 1
627 1 37 GLY HA3 1 44 ALA H . . 5.220 4.070 3.994 4.227 . 0 0 "[ . 1 . 2]" 1
628 1 37 GLY HA3 1 44 ALA HA . . 4.070 3.293 3.197 3.383 . 0 0 "[ . 1 . 2]" 1
629 1 37 GLY HA3 1 44 ALA MB . . 4.770 4.211 4.127 4.417 . 0 0 "[ . 1 . 2]" 1
630 1 37 GLY HA3 1 47 ALA MB . . 3.650 2.774 2.381 2.950 . 0 0 "[ . 1 . 2]" 1
631 1 38 ALA H 1 38 ALA MB . . 2.820 2.091 1.994 2.179 . 0 0 "[ . 1 . 2]" 1
632 1 38 ALA H 1 39 LEU H . . 3.230 2.503 2.460 2.581 . 0 0 "[ . 1 . 2]" 1
633 1 38 ALA H 1 39 LEU HB3 . . 5.490 4.293 4.239 4.387 . 0 0 "[ . 1 . 2]" 1
634 1 38 ALA HA 1 41 GLU H . . 4.070 3.249 3.088 3.503 . 0 0 "[ . 1 . 2]" 1
635 1 38 ALA HA 1 42 ILE H . . 5.040 4.298 4.077 4.505 . 0 0 "[ . 1 . 2]" 1
636 1 38 ALA MB 1 39 LEU H . . 3.200 2.910 2.804 2.975 . 0 0 "[ . 1 . 2]" 1
637 1 38 ALA MB 1 40 LEU H . . 4.760 4.673 4.628 4.728 . 0 0 "[ . 1 . 2]" 1
638 1 38 ALA MB 1 41 GLU H . . 5.220 4.357 4.286 4.480 . 0 0 "[ . 1 . 2]" 1
639 1 39 LEU H 1 39 LEU HB2 . . 3.580 3.084 3.051 3.112 . 0 0 "[ . 1 . 2]" 1
640 1 39 LEU H 1 39 LEU HB3 . . 3.010 2.050 2.043 2.061 . 0 0 "[ . 1 . 2]" 1
641 1 39 LEU H 1 39 LEU MD2 . . 3.940 3.924 3.864 3.949 0.009 6 0 "[ . 1 . 2]" 1
642 1 39 LEU H 1 39 LEU HG . . 3.860 3.833 3.789 3.882 0.022 13 0 "[ . 1 . 2]" 1
643 1 39 LEU H 1 42 ILE H . . 5.170 4.876 4.792 5.002 . 0 0 "[ . 1 . 2]" 1
644 1 39 LEU HA 1 39 LEU MD1 . . 3.040 2.516 2.388 2.660 . 0 0 "[ . 1 . 2]" 1
645 1 39 LEU HA 1 39 LEU HG . . 4.070 3.508 3.467 3.548 . 0 0 "[ . 1 . 2]" 1
646 1 39 LEU HB2 1 39 LEU MD1 . . 3.320 2.312 2.191 2.422 . 0 0 "[ . 1 . 2]" 1
647 1 39 LEU HB2 1 39 LEU MD2 . . 3.600 2.538 2.517 2.582 . 0 0 "[ . 1 . 2]" 1
648 1 39 LEU HB3 1 39 LEU MD2 . . 3.090 2.147 2.103 2.179 . 0 0 "[ . 1 . 2]" 1
649 1 39 LEU MD2 1 40 LEU H . . 4.360 4.095 4.015 4.166 . 0 0 "[ . 1 . 2]" 1
650 1 39 LEU HG 1 40 LEU H . . 4.570 2.983 2.884 3.101 . 0 0 "[ . 1 . 2]" 1
651 1 39 LEU HG 1 40 LEU HA . . 5.490 3.366 3.288 3.424 . 0 0 "[ . 1 . 2]" 1
652 1 40 LEU H 1 40 LEU QB . . 3.090 2.724 2.682 2.758 . 0 0 "[ . 1 . 2]" 1
653 1 40 LEU H 1 40 LEU MD1 . . 3.820 2.932 2.594 3.097 . 0 0 "[ . 1 . 2]" 1
654 1 40 LEU H 1 40 LEU MD2 . . 4.200 3.550 3.458 3.690 . 0 0 "[ . 1 . 2]" 1
655 1 40 LEU H 1 40 LEU HG . . 3.370 1.951 1.925 2.034 . 0 0 "[ . 1 . 2]" 1
656 1 40 LEU H 1 42 ILE H . . 4.400 3.251 3.188 3.317 . 0 0 "[ . 1 . 2]" 1
657 1 40 LEU H 1 42 ILE MD . . 5.220 4.825 4.462 4.932 . 0 0 "[ . 1 . 2]" 1
658 1 40 LEU H 1 42 ILE HG12 . . 4.890 3.753 3.471 3.890 . 0 0 "[ . 1 . 2]" 1
659 1 40 LEU HA 1 40 LEU MD1 . . 4.570 4.024 3.964 4.046 . 0 0 "[ . 1 . 2]" 1
660 1 40 LEU HA 1 40 LEU MD2 . . 3.000 2.808 2.667 3.029 0.029 13 0 "[ . 1 . 2]" 1
661 1 40 LEU HA 1 40 LEU HG . . 3.910 3.063 2.958 3.130 . 0 0 "[ . 1 . 2]" 1
662 1 40 LEU HA 1 41 GLU QG . . 4.660 4.193 3.170 4.515 . 0 0 "[ . 1 . 2]" 1
663 1 40 LEU HA 1 42 ILE H . . 5.490 4.152 4.128 4.203 . 0 0 "[ . 1 . 2]" 1
664 1 40 LEU HA 1 42 ILE HG12 . . 5.490 4.907 4.710 4.989 . 0 0 "[ . 1 . 2]" 1
665 1 40 LEU HA 1 42 ILE MG . . 4.890 3.877 3.771 4.121 . 0 0 "[ . 1 . 2]" 1
666 1 40 LEU QB 1 40 LEU MD1 . . 3.240 1.997 1.912 2.085 . 0 0 "[ . 1 . 2]" 1
667 1 40 LEU QB 1 41 GLU H . . 4.250 3.636 3.547 3.729 . 0 0 "[ . 1 . 2]" 1
668 1 40 LEU QB 1 41 GLU HB2 . . 5.240 4.481 4.424 4.568 . 0 0 "[ . 1 . 2]" 1
669 1 40 LEU QB 1 42 ILE H . . 4.390 2.599 2.487 2.748 . 0 0 "[ . 1 . 2]" 1
670 1 40 LEU QB 1 42 ILE MD . . 3.700 2.596 2.226 2.804 . 0 0 "[ . 1 . 2]" 1
671 1 40 LEU QB 1 42 ILE HG12 . . 3.760 2.082 1.980 2.126 . 0 0 "[ . 1 . 2]" 1
672 1 40 LEU QB 1 42 ILE HG13 . . 4.250 3.747 3.612 3.788 . 0 0 "[ . 1 . 2]" 1
673 1 40 LEU MD1 1 42 ILE H . . 5.070 3.687 3.312 3.867 . 0 0 "[ . 1 . 2]" 1
674 1 40 LEU MD1 1 47 ALA H . . 5.170 4.390 4.230 4.579 . 0 0 "[ . 1 . 2]" 1
675 1 40 LEU MD1 1 47 ALA MB . . 3.680 2.318 2.105 2.611 . 0 0 "[ . 1 . 2]" 1
676 1 40 LEU HG 1 41 GLU H . . 5.110 4.213 4.082 4.336 . 0 0 "[ . 1 . 2]" 1
677 1 41 GLU H 1 41 GLU HA . . 2.910 2.173 2.170 2.184 . 0 0 "[ . 1 . 2]" 1
678 1 41 GLU H 1 41 GLU HB3 . . 4.200 4.096 4.058 4.114 . 0 0 "[ . 1 . 2]" 1
679 1 41 GLU H 1 41 GLU QG . . 3.480 2.823 2.621 2.946 . 0 0 "[ . 1 . 2]" 1
680 1 41 GLU H 1 42 ILE H . . 3.430 2.652 2.603 2.724 . 0 0 "[ . 1 . 2]" 1
681 1 41 GLU H 1 42 ILE HG12 . . 5.230 4.502 4.206 4.669 . 0 0 "[ . 1 . 2]" 1
682 1 41 GLU H 1 42 ILE MG . . 5.220 4.128 4.089 4.204 . 0 0 "[ . 1 . 2]" 1
683 1 41 GLU HA 1 42 ILE H . . 3.490 3.209 3.114 3.309 . 0 0 "[ . 1 . 2]" 1
684 1 41 GLU HA 1 42 ILE HG12 . . 5.490 5.497 5.256 5.561 0.071 7 0 "[ . 1 . 2]" 1
685 1 41 GLU HB3 1 42 ILE H . . 4.560 4.332 4.247 4.489 . 0 0 "[ . 1 . 2]" 1
686 1 41 GLU QG 1 42 ILE H . . 4.890 4.560 4.158 4.663 . 0 0 "[ . 1 . 2]" 1
687 1 42 ILE H 1 42 ILE MD . . 4.570 3.807 3.623 3.901 . 0 0 "[ . 1 . 2]" 1
688 1 42 ILE H 1 42 ILE HG12 . . 3.600 2.321 2.079 2.395 . 0 0 "[ . 1 . 2]" 1
689 1 42 ILE H 1 42 ILE HG13 . . 3.950 3.405 3.276 3.520 . 0 0 "[ . 1 . 2]" 1
690 1 42 ILE H 1 42 ILE MG . . 4.040 2.389 2.252 2.510 . 0 0 "[ . 1 . 2]" 1
691 1 42 ILE H 1 43 PRO HD3 . . 5.240 4.813 4.802 4.819 . 0 0 "[ . 1 . 2]" 1
692 1 42 ILE HA 1 42 ILE MG . . 3.470 2.451 2.411 2.480 . 0 0 "[ . 1 . 2]" 1
693 1 42 ILE HA 1 43 PRO HD2 . . 3.390 2.866 2.806 2.901 . 0 0 "[ . 1 . 2]" 1
694 1 42 ILE HA 1 43 PRO HG2 . . 4.890 4.756 4.709 4.785 . 0 0 "[ . 1 . 2]" 1
695 1 42 ILE HA 1 43 PRO HG3 . . 5.040 4.336 4.303 4.356 . 0 0 "[ . 1 . 2]" 1
696 1 42 ILE HB 1 42 ILE MD . . 3.230 2.320 2.234 2.434 . 0 0 "[ . 1 . 2]" 1
697 1 42 ILE HB 1 43 PRO HD2 . . 3.120 1.899 1.851 1.932 . 0 0 "[ . 1 . 2]" 1
698 1 42 ILE HB 1 43 PRO HD3 . . 3.320 2.720 2.653 2.852 . 0 0 "[ . 1 . 2]" 1
699 1 42 ILE HB 1 43 PRO HG3 . . 4.490 4.600 4.551 4.684 0.194 4 0 "[ . 1 . 2]" 1
700 1 42 ILE MD 1 43 PRO HD2 . . 4.570 3.325 3.214 3.704 . 0 0 "[ . 1 . 2]" 1
701 1 42 ILE MD 1 43 PRO HD3 . . 5.040 4.531 4.452 4.785 . 0 0 "[ . 1 . 2]" 1
702 1 42 ILE MD 1 46 LYS H . . 5.240 4.221 4.006 4.680 . 0 0 "[ . 1 . 2]" 1
703 1 42 ILE MD 1 46 LYS HA . . 5.040 3.906 3.691 4.435 . 0 0 "[ . 1 . 2]" 1
704 1 42 ILE MD 1 46 LYS HB2 . . 4.040 3.547 3.374 4.071 0.031 4 0 "[ . 1 . 2]" 1
705 1 42 ILE MD 1 46 LYS HB3 . . 4.070 2.117 1.959 2.648 . 0 0 "[ . 1 . 2]" 1
706 1 42 ILE MD 1 46 LYS HG3 . . 4.660 2.499 2.067 3.644 . 0 0 "[ . 1 . 2]" 1
707 1 42 ILE MD 1 47 ALA H . . 4.000 2.817 2.618 3.145 . 0 0 "[ . 1 . 2]" 1
708 1 42 ILE MD 1 47 ALA HA . . 3.120 2.028 1.965 2.367 . 0 0 "[ . 1 . 2]" 1
709 1 42 ILE MD 1 50 ILE H . . 5.310 4.253 3.945 4.596 . 0 0 "[ . 1 . 2]" 1
710 1 42 ILE MD 1 50 ILE HB . . 5.040 3.222 2.918 3.466 . 0 0 "[ . 1 . 2]" 1
711 1 42 ILE MD 1 50 ILE QG . . 5.240 3.249 2.205 3.773 . 0 0 "[ . 1 . 2]" 1
712 1 42 ILE MD 1 51 ALA H . . 5.350 4.863 4.708 5.050 . 0 0 "[ . 1 . 2]" 1
713 1 42 ILE HG12 1 47 ALA H . . 5.040 4.105 3.894 4.476 . 0 0 "[ . 1 . 2]" 1
714 1 42 ILE HG13 1 43 PRO HD2 . . 4.570 3.009 2.802 3.401 . 0 0 "[ . 1 . 2]" 1
715 1 42 ILE HG13 1 43 PRO HD3 . . 5.240 4.099 3.959 4.415 . 0 0 "[ . 1 . 2]" 1
716 1 42 ILE HG13 1 47 ALA H . . 4.660 2.659 2.538 2.820 . 0 0 "[ . 1 . 2]" 1
717 1 42 ILE MG 1 43 PRO HD2 . . 4.000 3.615 3.482 3.652 . 0 0 "[ . 1 . 2]" 1
718 1 42 ILE MG 1 43 PRO HD3 . . 3.970 3.786 3.646 3.836 . 0 0 "[ . 1 . 2]" 1
719 1 42 ILE MG 1 46 LYS HB2 . . 4.890 4.779 4.645 4.921 0.031 12 0 "[ . 1 . 2]" 1
720 1 42 ILE MG 1 46 LYS HB3 . . 5.040 3.800 3.725 3.972 . 0 0 "[ . 1 . 2]" 1
721 1 42 ILE MG 1 47 ALA H . . 5.290 5.178 5.108 5.280 . 0 0 "[ . 1 . 2]" 1
722 1 43 PRO HA 1 44 ALA H . . 2.770 2.352 2.324 2.383 . 0 0 "[ . 1 . 2]" 1
723 1 43 PRO HA 1 44 ALA HA . . 4.490 4.205 4.203 4.206 . 0 0 "[ . 1 . 2]" 1
724 1 43 PRO HA 1 44 ALA MB . . 4.110 4.025 3.990 4.052 . 0 0 "[ . 1 . 2]" 1
725 1 43 PRO HA 1 45 ALA H . . 5.010 4.119 3.975 4.321 . 0 0 "[ . 1 . 2]" 1
726 1 43 PRO HB2 1 44 ALA H . . 4.600 2.927 2.843 3.002 . 0 0 "[ . 1 . 2]" 1
727 1 43 PRO HB2 1 45 ALA H . . 4.140 2.478 2.372 2.649 . 0 0 "[ . 1 . 2]" 1
728 1 43 PRO HB2 1 45 ALA MB . . 4.420 2.888 2.626 3.038 . 0 0 "[ . 1 . 2]" 1
729 1 43 PRO HB2 1 46 LYS H . . 3.670 2.889 2.839 2.923 . 0 0 "[ . 1 . 2]" 1
730 1 43 PRO HB3 1 44 ALA H . . 4.140 3.511 3.466 3.553 . 0 0 "[ . 1 . 2]" 1
731 1 43 PRO HB3 1 45 ALA H . . 4.390 4.088 3.974 4.263 . 0 0 "[ . 1 . 2]" 1
732 1 43 PRO HB3 1 45 ALA MB . . 4.890 4.292 4.096 4.392 . 0 0 "[ . 1 . 2]" 1
733 1 43 PRO HB3 1 46 LYS H . . 4.490 4.400 4.366 4.440 . 0 0 "[ . 1 . 2]" 1
734 1 43 PRO HD2 1 46 LYS H . . 5.240 3.444 3.380 3.559 . 0 0 "[ . 1 . 2]" 1
735 1 43 PRO HD2 1 46 LYS HB2 . . 4.160 2.065 1.982 2.232 . 0 0 "[ . 1 . 2]" 1
736 1 43 PRO HD2 1 46 LYS HB3 . . 4.160 2.002 1.960 2.127 . 0 0 "[ . 1 . 2]" 1
737 1 43 PRO HD2 1 46 LYS HD3 . . 4.360 3.965 2.916 4.633 0.273 9 0 "[ . 1 . 2]" 1
738 1 43 PRO HD2 1 46 LYS HG2 . . 5.240 2.977 2.745 3.721 . 0 0 "[ . 1 . 2]" 1
739 1 43 PRO HD2 1 46 LYS HG3 . . 4.770 4.045 3.904 4.403 . 0 0 "[ . 1 . 2]" 1
740 1 43 PRO HD3 1 46 LYS HG3 . . 5.500 5.642 5.510 6.019 0.519 13 1 "[ . 1 + . 2]" 1
741 1 43 PRO HG2 1 46 LYS H . . 5.490 2.681 2.574 2.770 . 0 0 "[ . 1 . 2]" 1
742 1 43 PRO HG2 1 46 LYS HB3 . . 4.300 3.241 3.077 3.352 . 0 0 "[ . 1 . 2]" 1
743 1 43 PRO HG3 1 44 ALA H . . 5.500 5.348 5.298 5.393 . 0 0 "[ . 1 . 2]" 1
744 1 44 ALA H 1 44 ALA MB . . 3.160 2.002 1.933 2.049 . 0 0 "[ . 1 . 2]" 1
745 1 44 ALA H 1 45 ALA H . . 3.700 2.684 2.661 2.728 . 0 0 "[ . 1 . 2]" 1
746 1 44 ALA HA 1 46 LYS H . . 5.040 4.151 4.046 4.320 . 0 0 "[ . 1 . 2]" 1
747 1 44 ALA HA 1 47 ALA H . . 4.250 3.185 3.110 3.247 . 0 0 "[ . 1 . 2]" 1
748 1 44 ALA HA 1 47 ALA MB . . 3.270 2.378 2.211 2.551 . 0 0 "[ . 1 . 2]" 1
749 1 44 ALA HA 1 48 GLU H . . 4.660 3.626 3.488 3.709 . 0 0 "[ . 1 . 2]" 1
750 1 45 ALA H 1 45 ALA MB . . 2.950 2.045 1.934 2.157 . 0 0 "[ . 1 . 2]" 1
751 1 45 ALA H 1 46 LYS H . . 3.670 2.646 2.580 2.722 . 0 0 "[ . 1 . 2]" 1
752 1 45 ALA H 1 47 ALA H . . 4.930 4.184 4.093 4.276 . 0 0 "[ . 1 . 2]" 1
753 1 45 ALA HA 1 48 GLU H . . 4.140 3.473 3.433 3.507 . 0 0 "[ . 1 . 2]" 1
754 1 45 ALA HA 1 48 GLU HB2 . . 4.420 3.428 3.330 3.630 . 0 0 "[ . 1 . 2]" 1
755 1 45 ALA HA 1 48 GLU HB3 . . 4.110 2.459 2.336 2.505 . 0 0 "[ . 1 . 2]" 1
756 1 45 ALA HA 1 48 GLU HG2 . . 5.040 5.000 4.441 5.088 0.048 18 0 "[ . 1 . 2]" 1
757 1 45 ALA HA 1 48 GLU HG3 . . 5.040 5.065 5.039 5.120 0.080 6 0 "[ . 1 . 2]" 1
758 1 45 ALA HA 1 49 LYS H . . 3.960 3.925 3.645 4.006 0.046 6 0 "[ . 1 . 2]" 1
759 1 45 ALA HA 1 49 LYS QB . . 5.490 4.798 4.095 5.243 . 0 0 "[ . 1 . 2]" 1
760 1 45 ALA MB 1 46 LYS H . . 3.720 2.733 2.570 2.853 . 0 0 "[ . 1 . 2]" 1
761 1 46 LYS H 1 46 LYS HB2 . . 3.580 2.313 2.199 2.417 . 0 0 "[ . 1 . 2]" 1
762 1 46 LYS H 1 46 LYS HB3 . . 3.490 2.704 2.591 2.830 . 0 0 "[ . 1 . 2]" 1
763 1 46 LYS H 1 46 LYS HG2 . . 4.890 4.616 4.575 4.639 . 0 0 "[ . 1 . 2]" 1
764 1 46 LYS H 1 46 LYS HG3 . . 4.680 4.439 4.196 4.523 . 0 0 "[ . 1 . 2]" 1
765 1 46 LYS H 1 47 ALA H . . 3.220 2.529 2.517 2.588 . 0 0 "[ . 1 . 2]" 1
766 1 46 LYS H 1 47 ALA HA . . 5.240 5.109 5.098 5.157 . 0 0 "[ . 1 . 2]" 1
767 1 46 LYS H 1 48 GLU H . . 4.900 3.676 3.646 3.735 . 0 0 "[ . 1 . 2]" 1
768 1 46 LYS HA 1 46 LYS HD2 . . 4.570 2.505 1.989 3.843 . 0 0 "[ . 1 . 2]" 1
769 1 46 LYS HA 1 46 LYS HD3 . . 3.880 3.337 1.997 4.477 0.597 1 1 "[+ . 1 . 2]" 1
770 1 46 LYS HA 1 46 LYS HG2 . . 4.110 3.578 3.199 3.669 . 0 0 "[ . 1 . 2]" 1
771 1 46 LYS HA 1 46 LYS HG3 . . 3.760 2.588 2.036 2.841 . 0 0 "[ . 1 . 2]" 1
772 1 46 LYS HA 1 49 LYS H . . 4.070 3.350 3.315 3.417 . 0 0 "[ . 1 . 2]" 1
773 1 46 LYS HA 1 50 ILE H . . 4.820 3.706 3.489 3.921 . 0 0 "[ . 1 . 2]" 1
774 1 46 LYS HA 1 50 ILE MD . . 5.490 4.072 3.672 4.519 . 0 0 "[ . 1 . 2]" 1
775 1 46 LYS HB2 1 46 LYS HE2 . . 4.770 4.276 3.099 4.842 0.072 17 0 "[ . 1 . 2]" 1
776 1 46 LYS HB2 1 47 ALA H . . 3.690 3.685 3.580 3.783 0.093 7 0 "[ . 1 . 2]" 1
777 1 46 LYS HB3 1 46 LYS HE2 . . 4.770 4.616 3.108 5.305 0.535 12 1 "[ . 1 + . 2]" 1
778 1 46 LYS HB3 1 47 ALA H . . 4.000 2.612 2.582 2.669 . 0 0 "[ . 1 . 2]" 1
779 1 46 LYS HB3 1 50 ILE MD . . 4.770 3.862 3.309 4.814 0.044 12 0 "[ . 1 . 2]" 1
780 1 46 LYS HD2 1 46 LYS HE2 . . 2.950 2.894 2.545 3.057 0.107 19 0 "[ . 1 . 2]" 1
781 1 46 LYS HE2 1 46 LYS HG2 . . 3.680 2.882 2.001 4.051 0.371 12 0 "[ . 1 . 2]" 1
782 1 46 LYS HE2 1 46 LYS HG3 . . 3.600 2.795 1.989 3.785 0.185 8 0 "[ . 1 . 2]" 1
783 1 46 LYS HE2 1 50 ILE MD . . 4.420 3.246 2.047 4.648 0.228 10 0 "[ . 1 . 2]" 1
784 1 46 LYS HG2 1 47 ALA H . . 5.490 4.796 4.487 5.011 . 0 0 "[ . 1 . 2]" 1
785 1 46 LYS HG2 1 50 ILE MD . . 3.720 2.992 1.975 3.761 0.041 8 0 "[ . 1 . 2]" 1
786 1 46 LYS HG3 1 47 ALA H . . 4.880 4.336 4.084 4.800 . 0 0 "[ . 1 . 2]" 1
787 1 46 LYS HG3 1 47 ALA HA . . 4.890 4.522 4.126 5.451 0.561 1 1 "[+ . 1 . 2]" 1
788 1 46 LYS HG3 1 50 ILE MD . . 4.420 2.211 1.849 3.461 . 0 0 "[ . 1 . 2]" 1
789 1 47 ALA H 1 47 ALA MB . . 3.110 2.103 2.043 2.166 . 0 0 "[ . 1 . 2]" 1
790 1 47 ALA HA 1 50 ILE H . . 4.420 3.514 3.457 3.600 . 0 0 "[ . 1 . 2]" 1
791 1 47 ALA HA 1 50 ILE HB . . 3.830 2.504 2.381 2.674 . 0 0 "[ . 1 . 2]" 1
792 1 47 ALA HA 1 50 ILE QG . . 4.770 3.760 3.096 4.043 . 0 0 "[ . 1 . 2]" 1
793 1 47 ALA HA 1 50 ILE MG . . 4.250 3.783 3.664 3.968 . 0 0 "[ . 1 . 2]" 1
794 1 47 ALA HA 1 51 ALA H . . 4.490 3.407 3.303 3.517 . 0 0 "[ . 1 . 2]" 1
795 1 47 ALA MB 1 48 GLU H . . 3.440 2.823 2.770 2.860 . 0 0 "[ . 1 . 2]" 1
796 1 48 GLU H 1 48 GLU HB2 . . 3.480 2.595 2.548 2.756 . 0 0 "[ . 1 . 2]" 1
797 1 48 GLU H 1 48 GLU HB3 . . 3.350 2.394 2.248 2.439 . 0 0 "[ . 1 . 2]" 1
798 1 48 GLU H 1 48 GLU HG2 . . 4.490 4.329 4.209 4.356 . 0 0 "[ . 1 . 2]" 1
799 1 48 GLU H 1 48 GLU HG3 . . 4.490 4.535 4.513 4.576 0.086 11 0 "[ . 1 . 2]" 1
800 1 48 GLU H 1 49 LYS H . . 3.840 2.603 2.584 2.638 . 0 0 "[ . 1 . 2]" 1
801 1 48 GLU H 1 49 LYS QB . . 5.060 4.399 4.286 4.563 . 0 0 "[ . 1 . 2]" 1
802 1 48 GLU H 1 50 ILE H . . 4.900 3.984 3.932 4.027 . 0 0 "[ . 1 . 2]" 1
803 1 48 GLU HA 1 48 GLU HG2 . . 3.380 2.810 2.695 3.263 . 0 0 "[ . 1 . 2]" 1
804 1 48 GLU HA 1 48 GLU HG3 . . 3.790 2.884 2.747 3.022 . 0 0 "[ . 1 . 2]" 1
805 1 48 GLU HA 1 51 ALA H . . 4.360 3.547 3.361 3.640 . 0 0 "[ . 1 . 2]" 1
806 1 48 GLU HA 1 51 ALA MB . . 3.280 2.419 2.127 2.663 . 0 0 "[ . 1 . 2]" 1
807 1 48 GLU HA 1 52 SER H . . 4.940 3.899 3.756 4.133 . 0 0 "[ . 1 . 2]" 1
808 1 48 GLU HA 1 64 ILE MD . . 4.300 2.942 2.550 3.209 . 0 0 "[ . 1 . 2]" 1
809 1 48 GLU HB2 1 49 LYS H . . 4.430 3.925 3.890 4.025 . 0 0 "[ . 1 . 2]" 1
810 1 48 GLU HB3 1 49 LYS H . . 3.460 2.586 2.552 2.692 . 0 0 "[ . 1 . 2]" 1
811 1 48 GLU HG2 1 49 LYS H . . 4.660 3.742 3.243 3.828 . 0 0 "[ . 1 . 2]" 1
812 1 48 GLU HG2 1 49 LYS HA . . 4.890 3.645 3.186 3.757 . 0 0 "[ . 1 . 2]" 1
813 1 48 GLU HG2 1 64 ILE MD . . 4.490 3.157 2.718 4.123 . 0 0 "[ . 1 . 2]" 1
814 1 48 GLU HG2 1 64 ILE MG . . 4.570 3.714 3.229 4.233 . 0 0 "[ . 1 . 2]" 1
815 1 48 GLU HG3 1 49 LYS H . . 4.890 4.867 4.468 4.921 0.031 4 0 "[ . 1 . 2]" 1
816 1 48 GLU HG3 1 49 LYS HA . . 5.490 5.331 4.640 5.440 . 0 0 "[ . 1 . 2]" 1
817 1 48 GLU HG3 1 64 ILE MD . . 4.420 3.244 2.949 3.554 . 0 0 "[ . 1 . 2]" 1
818 1 49 LYS H 1 49 LYS QB . . 3.230 2.206 2.117 2.335 . 0 0 "[ . 1 . 2]" 1
819 1 49 LYS H 1 49 LYS HG2 . . 4.770 3.659 2.331 4.527 . 0 0 "[ . 1 . 2]" 1
820 1 49 LYS H 1 49 LYS HG3 . . 4.140 3.713 2.691 4.487 0.347 16 0 "[ . 1 . 2]" 1
821 1 49 LYS H 1 50 ILE H . . 3.670 2.619 2.565 2.689 . 0 0 "[ . 1 . 2]" 1
822 1 49 LYS H 1 51 ALA H . . 5.070 4.057 4.002 4.095 . 0 0 "[ . 1 . 2]" 1
823 1 49 LYS HA 1 49 LYS HD2 . . 4.300 3.413 2.142 4.177 . 0 0 "[ . 1 . 2]" 1
824 1 49 LYS HA 1 49 LYS HG2 . . 4.110 3.088 2.169 3.897 . 0 0 "[ . 1 . 2]" 1
825 1 49 LYS QB 1 49 LYS HE2 . . 4.890 3.758 2.330 4.360 . 0 0 "[ . 1 . 2]" 1
826 1 49 LYS QB 1 50 ILE H . . 3.560 2.679 2.597 2.770 . 0 0 "[ . 1 . 2]" 1
827 1 49 LYS QB 1 50 ILE MD . . 4.770 4.521 4.168 4.664 . 0 0 "[ . 1 . 2]" 1
828 1 49 LYS QB 1 50 ILE QG . . 5.040 3.198 3.054 3.366 . 0 0 "[ . 1 . 2]" 1
829 1 49 LYS QB 1 51 ALA H . . 5.200 4.835 4.719 4.929 . 0 0 "[ . 1 . 2]" 1
830 1 49 LYS HD2 1 49 LYS HG3 . . 2.680 2.523 2.265 3.039 0.359 12 0 "[ . 1 . 2]" 1
831 1 50 ILE H 1 50 ILE HB . . 3.220 2.367 2.302 2.455 . 0 0 "[ . 1 . 2]" 1
832 1 50 ILE H 1 50 ILE MD . . 4.170 3.569 3.489 3.665 . 0 0 "[ . 1 . 2]" 1
833 1 50 ILE H 1 50 ILE QG . . 3.310 2.125 2.008 2.245 . 0 0 "[ . 1 . 2]" 1
834 1 50 ILE H 1 50 ILE MG . . 4.170 3.697 3.679 3.708 . 0 0 "[ . 1 . 2]" 1
835 1 50 ILE H 1 51 ALA H . . 3.310 2.668 2.564 2.747 . 0 0 "[ . 1 . 2]" 1
836 1 50 ILE H 1 51 ALA MB . . 4.690 4.230 4.127 4.323 . 0 0 "[ . 1 . 2]" 1
837 1 50 ILE HA 1 50 ILE MD . . 3.940 3.532 2.421 3.816 . 0 0 "[ . 1 . 2]" 1
838 1 50 ILE HA 1 50 ILE QG . . 3.580 2.405 2.305 2.632 . 0 0 "[ . 1 . 2]" 1
839 1 50 ILE HA 1 50 ILE MG . . 3.450 2.477 2.340 2.547 . 0 0 "[ . 1 . 2]" 1
840 1 50 ILE HA 1 52 SER H . . 5.310 4.390 4.313 4.494 . 0 0 "[ . 1 . 2]" 1
841 1 50 ILE HA 1 53 GLN H . . 4.040 3.229 3.134 3.320 . 0 0 "[ . 1 . 2]" 1
842 1 50 ILE HA 1 53 GLN HB2 . . 4.070 2.337 2.101 3.639 . 0 0 "[ . 1 . 2]" 1
843 1 50 ILE HA 1 53 GLN HB3 . . 4.070 3.262 2.056 3.537 . 0 0 "[ . 1 . 2]" 1
844 1 50 ILE HA 1 53 GLN HG2 . . 5.490 4.962 3.541 5.391 . 0 0 "[ . 1 . 2]" 1
845 1 50 ILE HA 1 54 MET H . . 5.150 3.737 3.570 3.936 . 0 0 "[ . 1 . 2]" 1
846 1 50 ILE HB 1 50 ILE MD . . 3.570 2.475 2.234 3.139 . 0 0 "[ . 1 . 2]" 1
847 1 50 ILE HB 1 51 ALA H . . 3.500 2.640 2.592 2.705 . 0 0 "[ . 1 . 2]" 1
848 1 50 ILE HB 1 51 ALA HA . . 5.490 4.381 4.307 4.448 . 0 0 "[ . 1 . 2]" 1
849 1 50 ILE HB 1 51 ALA MB . . 4.660 4.064 3.968 4.113 . 0 0 "[ . 1 . 2]" 1
850 1 50 ILE HB 1 52 SER H . . 5.310 5.069 5.026 5.115 . 0 0 "[ . 1 . 2]" 1
851 1 50 ILE MD 1 51 ALA H . . 4.890 4.638 4.505 4.918 0.028 18 0 "[ . 1 . 2]" 1
852 1 50 ILE QG 1 50 ILE MG . . 3.240 2.392 2.295 2.595 . 0 0 "[ . 1 . 2]" 1
853 1 50 ILE QG 1 51 ALA H . . 4.300 4.084 3.966 4.152 . 0 0 "[ . 1 . 2]" 1
854 1 50 ILE MG 1 51 ALA H . . 3.920 3.383 3.224 3.489 . 0 0 "[ . 1 . 2]" 1
855 1 50 ILE MG 1 51 ALA HA . . 3.970 3.449 3.263 3.574 . 0 0 "[ . 1 . 2]" 1
856 1 50 ILE MG 1 53 GLN H . . 4.840 4.609 4.443 4.699 . 0 0 "[ . 1 . 2]" 1
857 1 50 ILE MG 1 53 GLN HB2 . . 5.240 4.087 3.802 5.246 0.006 19 0 "[ . 1 . 2]" 1
858 1 50 ILE MG 1 54 MET H . . 4.820 3.754 3.584 4.030 . 0 0 "[ . 1 . 2]" 1
859 1 50 ILE MG 1 54 MET HB2 . . 5.490 3.980 3.484 4.232 . 0 0 "[ . 1 . 2]" 1
860 1 50 ILE MG 1 54 MET HG2 . . 4.490 2.845 2.107 3.642 . 0 0 "[ . 1 . 2]" 1
861 1 50 ILE MG 1 54 MET HG3 . . 3.860 2.286 2.012 2.799 . 0 0 "[ . 1 . 2]" 1
862 1 51 ALA H 1 51 ALA MB . . 3.040 2.143 2.114 2.160 . 0 0 "[ . 1 . 2]" 1
863 1 51 ALA H 1 60 MET ME . . 5.430 4.777 4.327 5.196 . 0 0 "[ . 1 . 2]" 1
864 1 51 ALA HA 1 53 GLN H . . 5.490 4.625 4.531 4.832 . 0 0 "[ . 1 . 2]" 1
865 1 51 ALA HA 1 54 MET HB2 . . 4.070 2.750 2.471 2.890 . 0 0 "[ . 1 . 2]" 1
866 1 51 ALA HA 1 54 MET HB3 . . 4.420 4.271 3.826 4.429 0.009 8 0 "[ . 1 . 2]" 1
867 1 51 ALA HA 1 54 MET HG2 . . 4.770 4.400 3.951 4.821 0.051 16 0 "[ . 1 . 2]" 1
868 1 51 ALA HA 1 54 MET HG3 . . 4.770 3.167 2.912 3.833 . 0 0 "[ . 1 . 2]" 1
869 1 51 ALA HA 1 55 ILE H . . 5.040 4.345 4.225 4.484 . 0 0 "[ . 1 . 2]" 1
870 1 51 ALA HA 1 55 ILE MD . . 4.890 4.623 4.214 4.899 0.009 3 0 "[ . 1 . 2]" 1
871 1 51 ALA HA 1 60 MET ME . . 3.120 2.538 2.030 3.129 0.009 16 0 "[ . 1 . 2]" 1
872 1 51 ALA MB 1 52 SER H . . 3.390 2.565 2.518 2.634 . 0 0 "[ . 1 . 2]" 1
873 1 51 ALA MB 1 52 SER HA . . 4.890 3.834 3.817 3.844 . 0 0 "[ . 1 . 2]" 1
874 1 51 ALA MB 1 52 SER QB . . 4.770 3.732 3.700 3.786 . 0 0 "[ . 1 . 2]" 1
875 1 51 ALA MB 1 53 GLN H . . 4.870 4.543 4.459 4.687 . 0 0 "[ . 1 . 2]" 1
876 1 51 ALA MB 1 54 MET H . . 5.360 4.635 4.539 4.691 . 0 0 "[ . 1 . 2]" 1
877 1 51 ALA MB 1 54 MET HB2 . . 5.490 4.223 4.051 4.345 . 0 0 "[ . 1 . 2]" 1
878 1 51 ALA MB 1 55 ILE H . . 5.120 4.862 4.767 4.955 . 0 0 "[ . 1 . 2]" 1
879 1 51 ALA MB 1 55 ILE HB . . 5.240 5.177 5.005 5.283 0.043 14 0 "[ . 1 . 2]" 1
880 1 51 ALA MB 1 60 MET ME . . 3.130 2.642 2.396 2.897 . 0 0 "[ . 1 . 2]" 1
881 1 51 ALA MB 1 64 ILE HA . . 5.490 5.262 4.921 5.471 . 0 0 "[ . 1 . 2]" 1
882 1 51 ALA MB 1 64 ILE MD . . 3.570 2.080 1.901 2.270 . 0 0 "[ . 1 . 2]" 1
883 1 51 ALA MB 1 64 ILE HG12 . . 5.240 3.301 2.985 3.514 . 0 0 "[ . 1 . 2]" 1
884 1 51 ALA MB 1 64 ILE MG . . 4.570 4.052 3.849 4.238 . 0 0 "[ . 1 . 2]" 1
885 1 51 ALA MB 1 71 VAL HB . . 4.770 4.260 3.306 4.767 . 0 0 "[ . 1 . 2]" 1
886 1 51 ALA MB 1 71 VAL QG . . 3.830 2.236 1.879 2.504 . 0 0 "[ . 1 . 2]" 1
887 1 52 SER H 1 52 SER QB . . 3.070 2.079 2.051 2.123 . 0 0 "[ . 1 . 2]" 1
888 1 52 SER H 1 53 GLN H . . 3.130 2.570 2.525 2.633 . 0 0 "[ . 1 . 2]" 1
889 1 52 SER H 1 55 ILE MD . . 5.040 4.942 4.457 5.062 0.022 14 0 "[ . 1 . 2]" 1
890 1 52 SER H 1 64 ILE MD . . 3.840 2.686 2.444 2.862 . 0 0 "[ . 1 . 2]" 1
891 1 52 SER HA 1 55 ILE H . . 4.100 3.400 3.287 3.469 . 0 0 "[ . 1 . 2]" 1
892 1 52 SER HA 1 55 ILE HB . . 3.940 2.839 2.662 3.009 . 0 0 "[ . 1 . 2]" 1
893 1 52 SER HA 1 55 ILE MD . . 4.110 3.093 2.613 3.415 . 0 0 "[ . 1 . 2]" 1
894 1 52 SER HA 1 55 ILE MG . . 4.890 4.097 3.905 4.282 . 0 0 "[ . 1 . 2]" 1
895 1 52 SER HA 1 56 THR H . . 5.240 4.062 3.740 4.287 . 0 0 "[ . 1 . 2]" 1
896 1 52 SER HA 1 60 MET ME . . 4.300 4.300 3.943 4.363 0.063 18 0 "[ . 1 . 2]" 1
897 1 52 SER HA 1 64 ILE MD . . 3.610 2.498 2.117 2.805 . 0 0 "[ . 1 . 2]" 1
898 1 52 SER HA 1 64 ILE HG12 . . 5.240 4.852 4.617 5.170 . 0 0 "[ . 1 . 2]" 1
899 1 52 SER HA 1 64 ILE HG13 . . 4.770 3.576 3.368 3.803 . 0 0 "[ . 1 . 2]" 1
900 1 52 SER QB 1 53 GLN H . . 3.400 3.064 2.443 3.275 . 0 0 "[ . 1 . 2]" 1
901 1 52 SER QB 1 64 ILE HB . . 5.240 4.257 3.596 4.932 . 0 0 "[ . 1 . 2]" 1
902 1 52 SER QB 1 64 ILE MD . . 3.610 2.507 2.177 2.821 . 0 0 "[ . 1 . 2]" 1
903 1 52 SER QB 1 64 ILE HG13 . . 4.890 4.339 4.075 4.723 . 0 0 "[ . 1 . 2]" 1
904 1 53 GLN H 1 53 GLN HB2 . . 3.190 2.104 2.019 2.917 . 0 0 "[ . 1 . 2]" 1
905 1 53 GLN H 1 53 GLN HB3 . . 3.330 3.249 2.122 3.402 0.072 4 0 "[ . 1 . 2]" 1
906 1 53 GLN H 1 53 GLN HG2 . . 4.420 3.884 3.343 4.387 . 0 0 "[ . 1 . 2]" 1
907 1 53 GLN H 1 53 GLN HG3 . . 3.950 3.504 3.073 4.436 0.486 19 0 "[ . 1 . 2]" 1
908 1 53 GLN H 1 54 MET HG3 . . 5.490 5.140 4.569 6.318 0.828 6 1 "[ .+ 1 . 2]" 1
909 1 53 GLN HA 1 53 GLN HG2 . . 3.440 2.328 1.987 3.582 0.142 19 0 "[ . 1 . 2]" 1
910 1 53 GLN HA 1 53 GLN HG3 . . 3.740 2.877 2.364 3.454 . 0 0 "[ . 1 . 2]" 1
911 1 53 GLN HA 1 56 THR HB . . 3.060 2.299 2.081 2.597 . 0 0 "[ . 1 . 2]" 1
912 1 53 GLN HA 1 56 THR MG . . 3.970 3.554 3.212 3.794 . 0 0 "[ . 1 . 2]" 1
913 1 53 GLN HA 1 57 GLU HG3 . . 5.240 4.046 3.695 4.614 . 0 0 "[ . 1 . 2]" 1
914 1 53 GLN HB2 1 54 MET H . . 4.200 3.223 2.979 4.202 0.002 19 0 "[ . 1 . 2]" 1
915 1 53 GLN HB2 1 57 GLU HG3 . . 5.240 5.085 4.681 5.767 0.527 6 1 "[ .+ 1 . 2]" 1
916 1 53 GLN HB3 1 54 MET H . . 3.690 3.213 2.942 3.349 . 0 0 "[ . 1 . 2]" 1
917 1 53 GLN HB3 1 54 MET HG3 . . 5.490 4.957 3.909 5.695 0.205 6 0 "[ . 1 . 2]" 1
918 1 53 GLN HB3 1 56 THR HB . . 5.490 4.783 4.514 5.178 . 0 0 "[ . 1 . 2]" 1
919 1 53 GLN HG3 1 54 MET H . . 5.490 5.082 4.118 5.347 . 0 0 "[ . 1 . 2]" 1
920 1 54 MET H 1 54 MET HB2 . . 3.830 2.265 2.061 2.375 . 0 0 "[ . 1 . 2]" 1
921 1 54 MET H 1 54 MET HB3 . . 3.900 3.486 3.384 3.512 . 0 0 "[ . 1 . 2]" 1
922 1 54 MET H 1 54 MET HG2 . . 4.040 2.804 2.249 3.733 . 0 0 "[ . 1 . 2]" 1
923 1 54 MET H 1 54 MET HG3 . . 3.560 2.996 2.423 3.939 0.379 6 0 "[ . 1 . 2]" 1
924 1 54 MET H 1 55 ILE H . . 3.440 2.717 2.632 2.761 . 0 0 "[ . 1 . 2]" 1
925 1 54 MET H 1 55 ILE HB . . 5.490 4.669 4.563 4.743 . 0 0 "[ . 1 . 2]" 1
926 1 54 MET H 1 55 ILE HG13 . . 5.050 4.786 4.682 4.971 . 0 0 "[ . 1 . 2]" 1
927 1 54 MET H 1 56 THR H . . 4.700 3.997 3.836 4.261 . 0 0 "[ . 1 . 2]" 1
928 1 54 MET HA 1 54 MET HG2 . . 3.540 2.414 2.163 2.671 . 0 0 "[ . 1 . 2]" 1
929 1 54 MET HA 1 54 MET HG3 . . 4.040 3.494 2.704 3.753 . 0 0 "[ . 1 . 2]" 1
930 1 54 MET HA 1 57 GLU H . . 4.530 3.353 3.237 3.511 . 0 0 "[ . 1 . 2]" 1
931 1 54 MET HA 1 57 GLU HB2 . . 4.110 2.589 2.348 3.027 . 0 0 "[ . 1 . 2]" 1
932 1 54 MET HA 1 57 GLU HB3 . . 4.890 4.177 3.883 4.723 . 0 0 "[ . 1 . 2]" 1
933 1 54 MET HA 1 58 GLY H . . 5.490 4.716 4.593 4.951 . 0 0 "[ . 1 . 2]" 1
934 1 54 MET HA 1 59 ARG H . . 4.560 4.105 3.690 4.404 . 0 0 "[ . 1 . 2]" 1
935 1 54 MET HA 1 59 ARG HB2 . . 3.910 2.790 2.465 3.099 . 0 0 "[ . 1 . 2]" 1
936 1 54 MET HA 1 59 ARG HB3 . . 4.890 4.307 3.929 4.621 . 0 0 "[ . 1 . 2]" 1
937 1 54 MET HA 1 60 MET H . . 5.490 3.957 3.674 4.322 . 0 0 "[ . 1 . 2]" 1
938 1 54 MET HB2 1 55 ILE H . . 3.810 2.586 2.469 2.771 . 0 0 "[ . 1 . 2]" 1
939 1 54 MET HB2 1 55 ILE HA . . 5.490 4.440 4.300 4.770 . 0 0 "[ . 1 . 2]" 1
940 1 54 MET HB2 1 56 THR H . . 5.500 4.896 4.703 5.206 . 0 0 "[ . 1 . 2]" 1
941 1 54 MET HB2 1 59 ARG HB2 . . 5.040 4.510 4.041 4.860 . 0 0 "[ . 1 . 2]" 1
942 1 54 MET HB2 1 60 MET HB3 . . 4.490 3.352 2.967 3.917 . 0 0 "[ . 1 . 2]" 1
943 1 54 MET HB2 1 60 MET ME . . 3.720 2.457 1.950 3.407 . 0 0 "[ . 1 . 2]" 1
944 1 54 MET HB3 1 54 MET ME . . 3.630 2.286 1.953 3.233 . 0 0 "[ . 1 . 2]" 1
945 1 54 MET HB3 1 55 ILE H . . 4.570 3.412 3.093 3.631 . 0 0 "[ . 1 . 2]" 1
946 1 54 MET HB3 1 55 ILE HA . . 5.490 4.168 3.927 4.282 . 0 0 "[ . 1 . 2]" 1
947 1 54 MET HB3 1 59 ARG H . . 5.040 4.891 4.378 5.056 0.016 5 0 "[ . 1 . 2]" 1
948 1 54 MET HB3 1 59 ARG HB2 . . 4.490 2.984 2.480 3.416 . 0 0 "[ . 1 . 2]" 1
949 1 54 MET HB3 1 60 MET H . . 5.240 3.051 2.719 3.585 . 0 0 "[ . 1 . 2]" 1
950 1 54 MET HB3 1 60 MET HB3 . . 4.200 2.875 2.213 3.632 . 0 0 "[ . 1 . 2]" 1
951 1 54 MET ME 1 54 MET HG3 . . 3.610 2.799 2.189 3.357 . 0 0 "[ . 1 . 2]" 1
952 1 54 MET ME 1 59 ARG HB2 . . 3.830 2.774 1.973 3.597 . 0 0 "[ . 1 . 2]" 1
953 1 54 MET ME 1 59 ARG HD2 . . 4.660 3.327 1.910 4.664 0.004 13 0 "[ . 1 . 2]" 1
954 1 54 MET ME 1 59 ARG HD3 . . 4.570 3.407 2.231 4.555 . 0 0 "[ . 1 . 2]" 1
955 1 54 MET HG2 1 59 ARG HB2 . . 4.770 4.113 3.066 4.749 . 0 0 "[ . 1 . 2]" 1
956 1 54 MET HG3 1 55 ILE H . . 5.330 4.702 4.507 5.077 . 0 0 "[ . 1 . 2]" 1
957 1 54 MET HG3 1 59 ARG HB2 . . 5.240 4.969 4.480 5.242 0.002 14 0 "[ . 1 . 2]" 1
958 1 55 ILE H 1 55 ILE HB . . 3.010 2.205 2.166 2.256 . 0 0 "[ . 1 . 2]" 1
959 1 55 ILE H 1 55 ILE MD . . 3.950 3.509 3.195 3.627 . 0 0 "[ . 1 . 2]" 1
960 1 55 ILE H 1 55 ILE HG12 . . 3.880 3.783 3.668 3.896 0.016 2 0 "[ . 1 . 2]" 1
961 1 55 ILE H 1 55 ILE HG13 . . 3.330 2.524 2.426 2.635 . 0 0 "[ . 1 . 2]" 1
962 1 55 ILE H 1 55 ILE MG . . 3.910 3.631 3.605 3.660 . 0 0 "[ . 1 . 2]" 1
963 1 55 ILE H 1 56 THR H . . 3.600 2.583 2.529 2.670 . 0 0 "[ . 1 . 2]" 1
964 1 55 ILE H 1 60 MET HB3 . . 5.490 3.346 3.217 3.590 . 0 0 "[ . 1 . 2]" 1
965 1 55 ILE H 1 60 MET ME . . 4.240 3.224 2.892 3.548 . 0 0 "[ . 1 . 2]" 1
966 1 55 ILE HA 1 55 ILE MD . . 4.160 3.782 3.758 3.810 . 0 0 "[ . 1 . 2]" 1
967 1 55 ILE HA 1 55 ILE HG12 . . 3.760 2.491 2.400 2.721 . 0 0 "[ . 1 . 2]" 1
968 1 55 ILE HA 1 55 ILE HG13 . . 3.760 2.689 2.540 2.794 . 0 0 "[ . 1 . 2]" 1
969 1 55 ILE HA 1 55 ILE MG . . 3.260 2.575 2.541 2.620 . 0 0 "[ . 1 . 2]" 1
970 1 55 ILE HA 1 57 GLU H . . 5.040 4.091 3.955 4.274 . 0 0 "[ . 1 . 2]" 1
971 1 55 ILE HA 1 58 GLY H . . 4.660 3.284 3.031 3.446 . 0 0 "[ . 1 . 2]" 1
972 1 55 ILE HA 1 59 ARG H . . 4.890 4.612 4.061 4.900 0.010 15 0 "[ . 1 . 2]" 1
973 1 55 ILE HA 1 60 MET H . . 3.590 2.726 2.506 2.884 . 0 0 "[ . 1 . 2]" 1
974 1 55 ILE HA 1 60 MET HB2 . . 5.240 3.912 3.079 4.429 . 0 0 "[ . 1 . 2]" 1
975 1 55 ILE HA 1 60 MET HB3 . . 4.660 2.565 2.209 2.909 . 0 0 "[ . 1 . 2]" 1
976 1 55 ILE HA 1 60 MET ME . . 4.300 4.026 3.776 4.302 0.002 1 0 "[ . 1 . 2]" 1
977 1 55 ILE HA 1 60 MET HG2 . . 5.240 4.511 4.410 4.574 . 0 0 "[ . 1 . 2]" 1
978 1 55 ILE HA 1 60 MET HG3 . . 5.450 5.373 5.145 5.519 0.069 12 0 "[ . 1 . 2]" 1
979 1 55 ILE HA 1 61 ASN HA . . 5.240 4.165 3.949 4.437 . 0 0 "[ . 1 . 2]" 1
980 1 55 ILE HA 1 62 GLY H . . 5.340 5.038 4.834 5.248 . 0 0 "[ . 1 . 2]" 1
981 1 55 ILE HB 1 55 ILE MD . . 3.350 2.238 2.022 2.362 . 0 0 "[ . 1 . 2]" 1
982 1 55 ILE HB 1 56 THR H . . 3.520 2.873 2.680 2.997 . 0 0 "[ . 1 . 2]" 1
983 1 55 ILE HB 1 56 THR HA . . 5.490 4.650 4.528 4.722 . 0 0 "[ . 1 . 2]" 1
984 1 55 ILE HB 1 56 THR HB . . 5.490 4.845 4.618 4.987 . 0 0 "[ . 1 . 2]" 1
985 1 55 ILE MD 1 55 ILE MG . . 3.070 2.030 1.903 2.414 . 0 0 "[ . 1 . 2]" 1
986 1 55 ILE MD 1 56 THR H . . 4.770 4.698 4.330 4.786 0.016 13 0 "[ . 1 . 2]" 1
987 1 55 ILE MD 1 60 MET HB3 . . 5.240 3.599 3.397 3.990 . 0 0 "[ . 1 . 2]" 1
988 1 55 ILE MD 1 60 MET ME . . 3.510 2.215 1.770 3.154 . 0 0 "[ . 1 . 2]" 1
989 1 55 ILE MD 1 60 MET HG2 . . 4.770 3.629 3.171 4.230 . 0 0 "[ . 1 . 2]" 1
990 1 55 ILE MD 1 60 MET HG3 . . 4.890 4.868 4.657 4.959 0.069 14 0 "[ . 1 . 2]" 1
991 1 55 ILE MD 1 62 GLY H . . 4.390 3.718 3.356 4.391 0.001 12 0 "[ . 1 . 2]" 1
992 1 55 ILE MD 1 62 GLY HA3 . . 4.490 3.322 2.817 3.900 . 0 0 "[ . 1 . 2]" 1
993 1 55 ILE MD 1 63 PHE H . . 4.230 3.342 3.176 3.605 . 0 0 "[ . 1 . 2]" 1
994 1 55 ILE MD 1 63 PHE HA . . 3.650 2.344 1.980 2.646 . 0 0 "[ . 1 . 2]" 1
995 1 55 ILE MD 1 63 PHE HB2 . . 5.040 4.449 4.146 4.711 . 0 0 "[ . 1 . 2]" 1
996 1 55 ILE MD 1 64 ILE H . . 4.420 3.500 3.272 3.925 . 0 0 "[ . 1 . 2]" 1
997 1 55 ILE MD 1 64 ILE HA . . 5.240 4.209 4.002 4.558 . 0 0 "[ . 1 . 2]" 1
998 1 55 ILE MD 1 64 ILE HG12 . . 4.300 3.468 3.044 4.009 . 0 0 "[ . 1 . 2]" 1
999 1 55 ILE MD 1 64 ILE HG13 . . 3.830 2.404 2.060 2.687 . 0 0 "[ . 1 . 2]" 1
1000 1 55 ILE HG12 1 60 MET HB3 . . 5.040 2.542 1.993 3.160 . 0 0 "[ . 1 . 2]" 1
1001 1 55 ILE HG12 1 60 MET HG2 . . 4.890 3.157 2.965 3.449 . 0 0 "[ . 1 . 2]" 1
1002 1 55 ILE HG12 1 60 MET HG3 . . 4.770 4.581 4.434 4.722 . 0 0 "[ . 1 . 2]" 1
1003 1 55 ILE HG12 1 62 GLY H . . 4.440 3.505 3.217 3.568 . 0 0 "[ . 1 . 2]" 1
1004 1 55 ILE HG12 1 62 GLY HA3 . . 5.490 4.210 4.039 4.441 . 0 0 "[ . 1 . 2]" 1
1005 1 55 ILE HG13 1 55 ILE MG . . 3.740 3.229 3.190 3.241 . 0 0 "[ . 1 . 2]" 1
1006 1 55 ILE HG13 1 56 THR H . . 4.910 4.623 4.538 4.680 . 0 0 "[ . 1 . 2]" 1
1007 1 55 ILE HG13 1 62 GLY H . . 5.230 5.220 4.895 5.269 0.039 13 0 "[ . 1 . 2]" 1
1008 1 55 ILE MG 1 56 THR H . . 4.000 3.254 3.005 3.427 . 0 0 "[ . 1 . 2]" 1
1009 1 55 ILE MG 1 56 THR HA . . 3.740 3.295 3.192 3.465 . 0 0 "[ . 1 . 2]" 1
1010 1 55 ILE MG 1 56 THR HB . . 5.490 4.736 4.409 4.974 . 0 0 "[ . 1 . 2]" 1
1011 1 55 ILE MG 1 58 GLY H . . 5.430 4.177 3.994 4.336 . 0 0 "[ . 1 . 2]" 1
1012 1 55 ILE MG 1 62 GLY H . . 4.060 3.287 2.947 3.630 . 0 0 "[ . 1 . 2]" 1
1013 1 55 ILE MG 1 63 PHE H . . 5.440 4.785 4.524 5.062 . 0 0 "[ . 1 . 2]" 1
1014 1 55 ILE MG 1 63 PHE HA . . 3.880 3.011 2.624 3.285 . 0 0 "[ . 1 . 2]" 1
1015 1 56 THR H 1 56 THR HB . . 3.370 2.185 2.074 2.277 . 0 0 "[ . 1 . 2]" 1
1016 1 56 THR H 1 56 THR MG . . 3.860 3.641 3.571 3.667 . 0 0 "[ . 1 . 2]" 1
1017 1 56 THR H 1 57 GLU H . . 3.580 2.577 2.488 2.723 . 0 0 "[ . 1 . 2]" 1
1018 1 56 THR HA 1 56 THR MG . . 3.000 2.526 2.444 2.646 . 0 0 "[ . 1 . 2]" 1
1019 1 56 THR HA 1 58 GLY H . . 5.040 3.683 3.575 3.832 . 0 0 "[ . 1 . 2]" 1
1020 1 56 THR HB 1 57 GLU H . . 3.560 3.048 2.851 3.144 . 0 0 "[ . 1 . 2]" 1
1021 1 56 THR HB 1 57 GLU HG2 . . 5.240 4.420 3.944 5.152 . 0 0 "[ . 1 . 2]" 1
1022 1 56 THR HB 1 57 GLU HG3 . . 4.570 4.256 3.839 4.570 0.000 3 0 "[ . 1 . 2]" 1
1023 1 56 THR HB 1 58 GLY H . . 5.490 4.914 4.762 4.983 . 0 0 "[ . 1 . 2]" 1
1024 1 56 THR MG 1 57 GLU H . . 3.970 3.584 3.322 3.726 . 0 0 "[ . 1 . 2]" 1
1025 1 56 THR MG 1 57 GLU HA . . 4.570 3.546 3.302 3.699 . 0 0 "[ . 1 . 2]" 1
1026 1 56 THR MG 1 57 GLU HG2 . . 4.570 3.475 2.796 4.133 . 0 0 "[ . 1 . 2]" 1
1027 1 56 THR MG 1 57 GLU HG3 . . 4.360 4.114 3.654 4.363 0.003 18 0 "[ . 1 . 2]" 1
1028 1 57 GLU H 1 57 GLU HB2 . . 3.280 2.259 2.110 2.390 . 0 0 "[ . 1 . 2]" 1
1029 1 57 GLU H 1 57 GLU HB3 . . 3.710 3.513 3.377 3.568 . 0 0 "[ . 1 . 2]" 1
1030 1 57 GLU H 1 57 GLU HG2 . . 4.300 3.322 2.939 3.842 . 0 0 "[ . 1 . 2]" 1
1031 1 57 GLU H 1 57 GLU HG3 . . 3.430 3.100 2.824 3.370 . 0 0 "[ . 1 . 2]" 1
1032 1 57 GLU H 1 58 GLY H . . 3.370 2.419 2.302 2.509 . 0 0 "[ . 1 . 2]" 1
1033 1 57 GLU H 1 58 GLY HA3 . . 5.440 5.057 4.960 5.118 . 0 0 "[ . 1 . 2]" 1
1034 1 57 GLU H 1 59 ARG H . . 4.130 3.790 3.487 3.984 . 0 0 "[ . 1 . 2]" 1
1035 1 57 GLU HA 1 57 GLU HG2 . . 3.300 2.165 2.025 2.295 . 0 0 "[ . 1 . 2]" 1
1036 1 57 GLU HA 1 57 GLU HG3 . . 3.740 3.358 2.950 3.546 . 0 0 "[ . 1 . 2]" 1
1037 1 57 GLU HB2 1 58 GLY H . . 4.480 3.525 3.476 3.630 . 0 0 "[ . 1 . 2]" 1
1038 1 57 GLU HB3 1 58 GLY H . . 4.770 4.130 3.936 4.272 . 0 0 "[ . 1 . 2]" 1
1039 1 57 GLU HB3 1 59 ARG H . . 4.760 3.042 2.748 3.318 . 0 0 "[ . 1 . 2]" 1
1040 1 57 GLU HB3 1 59 ARG HD2 . . 5.040 3.911 2.084 4.982 . 0 0 "[ . 1 . 2]" 1
1041 1 57 GLU HB3 1 59 ARG HD3 . . 5.240 4.748 3.706 5.243 0.003 15 0 "[ . 1 . 2]" 1
1042 1 57 GLU HB3 1 59 ARG HG2 . . 4.770 4.061 2.873 4.514 . 0 0 "[ . 1 . 2]" 1
1043 1 57 GLU HB3 1 59 ARG HG3 . . 4.360 2.579 2.138 3.072 . 0 0 "[ . 1 . 2]" 1
1044 1 58 GLY H 1 59 ARG H . . 3.360 2.832 2.617 2.973 . 0 0 "[ . 1 . 2]" 1
1045 1 58 GLY H 1 59 ARG HB2 . . 5.490 4.531 4.425 4.684 . 0 0 "[ . 1 . 2]" 1
1046 1 58 GLY H 1 59 ARG HG3 . . 4.960 4.834 4.558 4.965 0.005 12 0 "[ . 1 . 2]" 1
1047 1 58 GLY H 1 60 MET H . . 4.610 3.654 3.403 3.867 . 0 0 "[ . 1 . 2]" 1
1048 1 58 GLY HA2 1 59 ARG HB2 . . 5.490 5.492 5.394 5.532 0.042 13 0 "[ . 1 . 2]" 1
1049 1 58 GLY HA2 1 60 MET H . . 4.670 4.019 3.610 4.388 . 0 0 "[ . 1 . 2]" 1
1050 1 58 GLY HA3 1 60 MET H . . 5.040 4.791 4.405 5.045 0.005 5 0 "[ . 1 . 2]" 1
1051 1 59 ARG H 1 59 ARG HB2 . . 3.240 2.473 2.346 2.562 . 0 0 "[ . 1 . 2]" 1
1052 1 59 ARG H 1 59 ARG HB3 . . 3.750 3.562 3.532 3.579 . 0 0 "[ . 1 . 2]" 1
1053 1 59 ARG H 1 59 ARG HD2 . . 5.240 4.154 3.235 4.864 . 0 0 "[ . 1 . 2]" 1
1054 1 59 ARG H 1 59 ARG HD3 . . 5.240 4.711 3.834 4.975 . 0 0 "[ . 1 . 2]" 1
1055 1 59 ARG H 1 59 ARG HG2 . . 4.200 3.226 2.221 3.654 . 0 0 "[ . 1 . 2]" 1
1056 1 59 ARG H 1 59 ARG HG3 . . 3.940 2.284 2.016 2.778 . 0 0 "[ . 1 . 2]" 1
1057 1 59 ARG H 1 60 MET H . . 3.150 2.948 2.525 3.137 . 0 0 "[ . 1 . 2]" 1
1058 1 59 ARG HA 1 59 ARG HD2 . . 4.570 4.485 4.049 4.575 0.005 13 0 "[ . 1 . 2]" 1
1059 1 59 ARG HA 1 59 ARG HD3 . . 4.570 4.336 3.041 4.598 0.028 7 0 "[ . 1 . 2]" 1
1060 1 59 ARG HA 1 59 ARG HG2 . . 3.440 2.439 2.212 2.831 . 0 0 "[ . 1 . 2]" 1
1061 1 59 ARG HA 1 59 ARG HG3 . . 3.790 2.992 2.544 3.677 . 0 0 "[ . 1 . 2]" 1
1062 1 59 ARG HB2 1 60 MET H . . 4.130 2.590 2.315 2.993 . 0 0 "[ . 1 . 2]" 1
1063 1 59 ARG HB3 1 59 ARG HD2 . . 3.880 2.925 2.354 3.844 . 0 0 "[ . 1 . 2]" 1
1064 1 59 ARG HB3 1 59 ARG HD3 . . 3.880 2.773 2.538 3.007 . 0 0 "[ . 1 . 2]" 1
1065 1 59 ARG HB3 1 60 MET H . . 4.770 3.500 3.236 3.906 . 0 0 "[ . 1 . 2]" 1
1066 1 60 MET H 1 60 MET HB2 . . 3.790 2.669 2.209 2.964 . 0 0 "[ . 1 . 2]" 1
1067 1 60 MET H 1 60 MET HB3 . . 3.910 2.645 2.457 2.856 . 0 0 "[ . 1 . 2]" 1
1068 1 60 MET H 1 60 MET HG2 . . 4.820 4.518 4.332 4.699 . 0 0 "[ . 1 . 2]" 1
1069 1 60 MET H 1 61 ASN H . . 5.110 4.528 4.475 4.573 . 0 0 "[ . 1 . 2]" 1
1070 1 60 MET HA 1 60 MET ME . . 4.420 4.390 4.083 4.529 0.109 16 0 "[ . 1 . 2]" 1
1071 1 60 MET HA 1 60 MET HG2 . . 3.760 3.037 2.669 3.321 . 0 0 "[ . 1 . 2]" 1
1072 1 60 MET HA 1 60 MET HG3 . . 3.790 2.443 2.099 2.978 . 0 0 "[ . 1 . 2]" 1
1073 1 60 MET HA 1 61 ASN H . . 2.950 2.429 2.292 2.738 . 0 0 "[ . 1 . 2]" 1
1074 1 60 MET HA 1 61 ASN HB2 . . 4.660 4.127 3.917 5.611 0.951 15 1 "[ . 1 + 2]" 1
1075 1 60 MET HA 1 61 ASN HB3 . . 5.240 5.229 4.802 5.284 0.044 13 0 "[ . 1 . 2]" 1
1076 1 60 MET HB2 1 61 ASN H . . 4.330 4.073 3.769 4.238 . 0 0 "[ . 1 . 2]" 1
1077 1 60 MET HB3 1 60 MET ME . . 3.580 2.414 2.109 2.709 . 0 0 "[ . 1 . 2]" 1
1078 1 60 MET HB3 1 61 ASN H . . 4.770 3.595 2.738 4.086 . 0 0 "[ . 1 . 2]" 1
1079 1 60 MET ME 1 71 VAL QG . . 3.860 2.942 2.129 3.380 . 0 0 "[ . 1 . 2]" 1
1080 1 60 MET ME 1 73 PHE HA . . 5.240 4.545 3.940 5.217 . 0 0 "[ . 1 . 2]" 1
1081 1 60 MET ME 1 73 PHE QD . . 3.790 3.462 2.850 3.799 0.009 8 0 "[ . 1 . 2]" 1
1082 1 60 MET ME 1 73 PHE QE . . 3.430 2.303 1.921 3.315 . 0 0 "[ . 1 . 2]" 1
1083 1 60 MET ME 1 73 PHE HZ . . 4.420 3.806 3.021 4.312 . 0 0 "[ . 1 . 2]" 1
1084 1 60 MET HG2 1 61 ASN H . . 4.070 2.233 1.946 2.590 . 0 0 "[ . 1 . 2]" 1
1085 1 60 MET HG2 1 61 ASN HA . . 5.490 4.193 3.877 4.640 . 0 0 "[ . 1 . 2]" 1
1086 1 60 MET HG3 1 61 ASN H . . 4.000 2.747 2.224 3.357 . 0 0 "[ . 1 . 2]" 1
1087 1 60 MET HG3 1 61 ASN HA . . 5.490 5.275 4.760 5.599 0.109 3 0 "[ . 1 . 2]" 1
1088 1 60 MET HG3 1 73 PHE QD . . 4.890 3.788 2.862 4.299 . 0 0 "[ . 1 . 2]" 1
1089 1 60 MET HG3 1 73 PHE QE . . 5.040 3.945 2.685 4.704 . 0 0 "[ . 1 . 2]" 1
1090 1 61 ASN H 1 61 ASN HB2 . . 3.600 2.566 2.305 3.681 0.081 15 0 "[ . 1 . 2]" 1
1091 1 61 ASN H 1 61 ASN HB3 . . 4.000 3.132 3.013 3.633 . 0 0 "[ . 1 . 2]" 1
1092 1 61 ASN H 1 62 GLY H . . 4.810 4.371 4.019 4.483 . 0 0 "[ . 1 . 2]" 1
1093 1 61 ASN HA 1 62 GLY H . . 2.820 2.281 2.253 2.292 . 0 0 "[ . 1 . 2]" 1
1094 1 61 ASN HB2 1 62 GLY H . . 4.490 4.462 3.693 4.534 0.044 13 0 "[ . 1 . 2]" 1
1095 1 61 ASN HB2 1 74 GLU HB2 . . 5.040 4.733 3.030 5.057 0.017 13 0 "[ . 1 . 2]" 1
1096 1 61 ASN HB2 1 74 GLU HB3 . . 4.770 3.779 2.097 4.383 . 0 0 "[ . 1 . 2]" 1
1097 1 61 ASN HB3 1 62 GLY H . . 3.690 3.728 3.691 4.197 0.507 15 1 "[ . 1 + 2]" 1
1098 1 61 ASN HB3 1 74 GLU HB2 . . 5.040 3.518 2.954 4.778 . 0 0 "[ . 1 . 2]" 1
1099 1 61 ASN HB3 1 74 GLU HB3 . . 4.660 2.491 1.999 3.683 . 0 0 "[ . 1 . 2]" 1
1100 1 61 ASN HB3 1 74 GLU QG . . 4.890 2.978 2.290 3.868 . 0 0 "[ . 1 . 2]" 1
1101 1 62 GLY H 1 63 PHE H . . 4.450 4.448 4.419 4.467 0.017 2 0 "[ . 1 . 2]" 1
1102 1 62 GLY H 1 74 GLU HB3 . . 5.060 4.908 4.543 5.119 0.059 11 0 "[ . 1 . 2]" 1
1103 1 62 GLY HA2 1 63 PHE H . . 3.520 2.841 2.687 2.931 . 0 0 "[ . 1 . 2]" 1
1104 1 62 GLY HA3 1 63 PHE H . . 3.390 2.422 2.354 2.554 . 0 0 "[ . 1 . 2]" 1
1105 1 62 GLY HA3 1 63 PHE QD . . 5.490 4.344 3.927 4.735 . 0 0 "[ . 1 . 2]" 1
1106 1 62 GLY HA3 1 73 PHE HA . . 3.860 3.674 3.175 3.863 0.003 10 0 "[ . 1 . 2]" 1
1107 1 62 GLY HA3 1 73 PHE QD . . 5.490 4.874 4.276 5.481 . 0 0 "[ . 1 . 2]" 1
1108 1 62 GLY HA3 1 74 GLU HB3 . . 4.890 4.129 3.751 4.496 . 0 0 "[ . 1 . 2]" 1
1109 1 63 PHE H 1 63 PHE HB3 . . 4.120 3.047 2.821 3.118 . 0 0 "[ . 1 . 2]" 1
1110 1 63 PHE H 1 63 PHE QD . . 4.330 2.768 2.448 3.028 . 0 0 "[ . 1 . 2]" 1
1111 1 63 PHE H 1 64 ILE HA . . 5.500 4.647 4.623 4.709 . 0 0 "[ . 1 . 2]" 1
1112 1 63 PHE H 1 64 ILE HG13 . . 5.240 5.230 5.027 5.264 0.024 3 0 "[ . 1 . 2]" 1
1113 1 63 PHE HA 1 64 ILE H . . 3.200 2.411 2.327 2.480 . 0 0 "[ . 1 . 2]" 1
1114 1 63 PHE HA 1 64 ILE HG12 . . 5.490 5.010 4.681 5.501 0.011 13 0 "[ . 1 . 2]" 1
1115 1 63 PHE HA 1 64 ILE HG13 . . 5.040 3.817 3.586 4.187 . 0 0 "[ . 1 . 2]" 1
1116 1 63 PHE HB2 1 64 ILE H . . 3.570 2.790 2.597 2.995 . 0 0 "[ . 1 . 2]" 1
1117 1 63 PHE HB2 1 64 ILE HB . . 5.240 5.050 4.874 5.218 . 0 0 "[ . 1 . 2]" 1
1118 1 63 PHE QD 1 64 ILE H . . 4.640 3.064 2.776 3.416 . 0 0 "[ . 1 . 2]" 1
1119 1 63 PHE QD 1 64 ILE HA . . 4.770 3.812 3.578 4.097 . 0 0 "[ . 1 . 2]" 1
1120 1 63 PHE QD 1 65 ASP HB2 . . 5.240 3.951 3.680 4.273 . 0 0 "[ . 1 . 2]" 1
1121 1 63 PHE QD 1 72 HIS HB2 . . 5.240 3.562 2.759 3.888 . 0 0 "[ . 1 . 2]" 1
1122 1 63 PHE QD 1 72 HIS HB3 . . 5.240 3.626 2.950 4.345 . 0 0 "[ . 1 . 2]" 1
1123 1 63 PHE QE 1 64 ILE HA . . 5.240 4.871 4.501 5.097 . 0 0 "[ . 1 . 2]" 1
1124 1 63 PHE QE 1 65 ASP HA . . 5.500 2.621 1.998 2.969 . 0 0 "[ . 1 . 2]" 1
1125 1 63 PHE QE 1 65 ASP HB2 . . 4.890 2.292 2.064 2.649 . 0 0 "[ . 1 . 2]" 1
1126 1 63 PHE QE 1 65 ASP HB3 . . 4.360 3.920 3.475 4.268 . 0 0 "[ . 1 . 2]" 1
1127 1 63 PHE HZ 1 65 ASP HA . . 5.490 4.976 4.364 5.395 . 0 0 "[ . 1 . 2]" 1
1128 1 63 PHE HZ 1 65 ASP HB2 . . 4.570 3.612 3.098 4.054 . 0 0 "[ . 1 . 2]" 1
1129 1 63 PHE HZ 1 72 HIS HB2 . . 5.040 4.036 3.799 4.328 . 0 0 "[ . 1 . 2]" 1
1130 1 63 PHE HZ 1 72 HIS HB3 . . 5.240 4.507 4.113 5.001 . 0 0 "[ . 1 . 2]" 1
1131 1 63 PHE HZ 1 72 HIS HD2 . . 5.240 3.911 3.046 4.859 . 0 0 "[ . 1 . 2]" 1
1132 1 64 ILE H 1 64 ILE HB . . 3.340 2.321 2.189 2.422 . 0 0 "[ . 1 . 2]" 1
1133 1 64 ILE H 1 64 ILE MD . . 4.580 4.040 3.707 4.221 . 0 0 "[ . 1 . 2]" 1
1134 1 64 ILE H 1 64 ILE HG12 . . 4.200 3.891 3.677 4.161 . 0 0 "[ . 1 . 2]" 1
1135 1 64 ILE H 1 64 ILE HG13 . . 4.010 2.935 2.720 3.293 . 0 0 "[ . 1 . 2]" 1
1136 1 64 ILE H 1 64 ILE MG . . 4.490 3.643 3.502 3.726 . 0 0 "[ . 1 . 2]" 1
1137 1 64 ILE HA 1 64 ILE MD . . 4.300 3.708 3.665 3.780 . 0 0 "[ . 1 . 2]" 1
1138 1 64 ILE HA 1 64 ILE HG12 . . 3.940 2.337 2.224 2.518 . 0 0 "[ . 1 . 2]" 1
1139 1 64 ILE HA 1 64 ILE HG13 . . 4.200 2.952 2.609 3.125 . 0 0 "[ . 1 . 2]" 1
1140 1 64 ILE HA 1 64 ILE MG . . 3.580 2.572 2.508 2.666 . 0 0 "[ . 1 . 2]" 1
1141 1 64 ILE HA 1 65 ASP H . . 3.210 2.185 2.176 2.217 . 0 0 "[ . 1 . 2]" 1
1142 1 64 ILE HA 1 65 ASP HB2 . . 5.040 4.497 4.226 4.575 . 0 0 "[ . 1 . 2]" 1
1143 1 64 ILE HA 1 65 ASP HB3 . . 4.890 4.592 4.503 5.046 0.156 5 0 "[ . 1 . 2]" 1
1144 1 64 ILE HA 1 71 VAL HB . . 5.490 5.122 4.080 5.499 0.009 15 0 "[ . 1 . 2]" 1
1145 1 64 ILE HA 1 71 VAL QG . . 4.660 3.267 3.141 3.464 . 0 0 "[ . 1 . 2]" 1
1146 1 64 ILE HA 1 72 HIS H . . 4.420 2.781 2.369 3.224 . 0 0 "[ . 1 . 2]" 1
1147 1 64 ILE HA 1 72 HIS HD2 . . 5.240 4.874 3.470 5.240 . 0 0 "[ . 1 . 2]" 1
1148 1 64 ILE HB 1 65 ASP H . . 4.770 4.450 4.264 4.615 . 0 0 "[ . 1 . 2]" 1
1149 1 64 ILE HB 1 66 GLN QG . . 5.490 4.210 3.944 4.516 . 0 0 "[ . 1 . 2]" 1
1150 1 64 ILE MD 1 71 VAL HA . . 4.490 4.125 3.828 4.456 . 0 0 "[ . 1 . 2]" 1
1151 1 64 ILE MD 1 71 VAL QG . . 3.570 2.416 1.959 2.772 . 0 0 "[ . 1 . 2]" 1
1152 1 64 ILE MD 1 72 HIS H . . 5.370 5.199 4.973 5.383 0.013 13 0 "[ . 1 . 2]" 1
1153 1 64 ILE HG12 1 64 ILE MG . . 3.720 2.539 2.415 2.605 . 0 0 "[ . 1 . 2]" 1
1154 1 64 ILE HG12 1 65 ASP H . . 5.240 4.198 3.935 4.331 . 0 0 "[ . 1 . 2]" 1
1155 1 64 ILE HG12 1 71 VAL HA . . 4.490 2.828 2.512 3.017 . 0 0 "[ . 1 . 2]" 1
1156 1 64 ILE HG12 1 71 VAL HB . . 4.890 4.352 2.973 4.888 . 0 0 "[ . 1 . 2]" 1
1157 1 64 ILE HG12 1 71 VAL QG . . 4.250 2.196 1.912 2.387 . 0 0 "[ . 1 . 2]" 1
1158 1 64 ILE HG13 1 65 ASP H . . 5.490 5.066 4.748 5.211 . 0 0 "[ . 1 . 2]" 1
1159 1 64 ILE HG13 1 71 VAL HA . . 4.570 4.269 3.598 4.576 0.006 11 0 "[ . 1 . 2]" 1
1160 1 64 ILE HG13 1 71 VAL QG . . 5.240 3.357 2.999 3.555 . 0 0 "[ . 1 . 2]" 1
1161 1 64 ILE MG 1 65 ASP H . . 3.880 2.891 2.567 3.231 . 0 0 "[ . 1 . 2]" 1
1162 1 64 ILE MG 1 65 ASP HB2 . . 5.240 4.919 4.736 5.041 . 0 0 "[ . 1 . 2]" 1
1163 1 64 ILE MG 1 65 ASP HB3 . . 5.240 4.392 4.221 4.724 . 0 0 "[ . 1 . 2]" 1
1164 1 64 ILE MG 1 66 GLN H . . 4.520 3.849 3.692 3.977 . 0 0 "[ . 1 . 2]" 1
1165 1 64 ILE MG 1 66 GLN HA . . 3.610 3.526 3.482 3.579 . 0 0 "[ . 1 . 2]" 1
1166 1 64 ILE MG 1 66 GLN HB2 . . 4.990 4.696 4.464 4.889 . 0 0 "[ . 1 . 2]" 1
1167 1 64 ILE MG 1 66 GLN QG . . 3.650 2.571 2.395 2.751 . 0 0 "[ . 1 . 2]" 1
1168 1 64 ILE MG 1 70 ILE H . . 4.960 4.364 4.242 4.571 . 0 0 "[ . 1 . 2]" 1
1169 1 64 ILE MG 1 71 VAL HA . . 4.570 3.280 2.788 3.832 . 0 0 "[ . 1 . 2]" 1
1170 1 64 ILE MG 1 71 VAL QG . . 4.110 2.644 2.108 3.177 . 0 0 "[ . 1 . 2]" 1
1171 1 65 ASP H 1 65 ASP HB2 . . 3.570 2.596 2.105 2.748 . 0 0 "[ . 1 . 2]" 1
1172 1 65 ASP H 1 65 ASP HB3 . . 4.130 2.432 2.343 2.918 . 0 0 "[ . 1 . 2]" 1
1173 1 65 ASP H 1 70 ILE H . . 4.370 3.655 3.445 3.886 . 0 0 "[ . 1 . 2]" 1
1174 1 65 ASP H 1 70 ILE HB . . 5.240 4.622 4.122 4.798 . 0 0 "[ . 1 . 2]" 1
1175 1 65 ASP H 1 71 VAL HA . . 4.420 3.088 2.879 3.298 . 0 0 "[ . 1 . 2]" 1
1176 1 65 ASP H 1 72 HIS HD2 . . 4.890 3.616 2.392 4.103 . 0 0 "[ . 1 . 2]" 1
1177 1 65 ASP HA 1 66 GLN H . . 3.160 2.257 2.253 2.259 . 0 0 "[ . 1 . 2]" 1
1178 1 65 ASP HA 1 66 GLN HB2 . . 5.040 4.502 4.461 4.567 . 0 0 "[ . 1 . 2]" 1
1179 1 65 ASP HA 1 66 GLN QG . . 4.890 4.332 4.167 4.686 . 0 0 "[ . 1 . 2]" 1
1180 1 65 ASP HB2 1 66 GLN H . . 4.570 4.501 4.466 4.641 0.071 5 0 "[ . 1 . 2]" 1
1181 1 65 ASP HB2 1 67 ILE H . . 4.730 4.729 4.562 5.385 0.655 5 1 "[ + 1 . 2]" 1
1182 1 65 ASP HB2 1 70 ILE H . . 4.110 4.015 3.290 4.117 0.007 20 0 "[ . 1 . 2]" 1
1183 1 65 ASP HB2 1 72 HIS HD2 . . 4.200 2.741 2.008 3.496 . 0 0 "[ . 1 . 2]" 1
1184 1 65 ASP HB3 1 67 ILE H . . 5.490 4.391 4.104 4.580 . 0 0 "[ . 1 . 2]" 1
1185 1 65 ASP HB3 1 68 ASP H . . 4.770 3.408 2.848 3.608 . 0 0 "[ . 1 . 2]" 1
1186 1 65 ASP HB3 1 68 ASP HB2 . . 4.890 3.146 2.292 3.383 . 0 0 "[ . 1 . 2]" 1
1187 1 65 ASP HB3 1 69 GLY H . . 5.380 3.535 3.080 3.824 . 0 0 "[ . 1 . 2]" 1
1188 1 65 ASP HB3 1 70 ILE H . . 3.840 2.297 2.002 2.401 . 0 0 "[ . 1 . 2]" 1
1189 1 65 ASP HB3 1 70 ILE HA . . 5.240 4.657 4.410 4.927 . 0 0 "[ . 1 . 2]" 1
1190 1 65 ASP HB3 1 70 ILE HB . . 3.790 3.118 2.922 3.492 . 0 0 "[ . 1 . 2]" 1
1191 1 65 ASP HB3 1 70 ILE HG13 . . 4.770 4.565 3.564 4.868 0.098 12 0 "[ . 1 . 2]" 1
1192 1 65 ASP HB3 1 70 ILE MG . . 5.240 4.291 4.004 4.678 . 0 0 "[ . 1 . 2]" 1
1193 1 65 ASP HB3 1 72 HIS HD2 . . 4.490 3.289 2.575 3.961 . 0 0 "[ . 1 . 2]" 1
1194 1 66 GLN H 1 66 GLN HB2 . . 3.650 2.272 2.239 2.332 . 0 0 "[ . 1 . 2]" 1
1195 1 66 GLN H 1 66 GLN HB3 . . 4.110 3.528 3.509 3.564 . 0 0 "[ . 1 . 2]" 1
1196 1 66 GLN H 1 66 GLN QG . . 3.760 2.864 2.682 3.222 . 0 0 "[ . 1 . 2]" 1
1197 1 66 GLN H 1 67 ILE H . . 3.490 2.331 2.272 2.397 . 0 0 "[ . 1 . 2]" 1
1198 1 66 GLN HA 1 66 GLN QG . . 3.650 2.138 2.117 2.188 . 0 0 "[ . 1 . 2]" 1
1199 1 66 GLN HA 1 69 GLY H . . 4.110 2.892 2.764 2.964 . 0 0 "[ . 1 . 2]" 1
1200 1 66 GLN HA 1 69 GLY HA3 . . 5.040 4.041 3.976 4.133 . 0 0 "[ . 1 . 2]" 1
1201 1 66 GLN HA 1 70 ILE H . . 5.240 4.503 4.307 4.703 . 0 0 "[ . 1 . 2]" 1
1202 1 66 GLN HB2 1 67 ILE H . . 4.490 3.311 2.953 3.412 . 0 0 "[ . 1 . 2]" 1
1203 1 66 GLN HB3 1 67 ILE H . . 4.770 4.007 3.704 4.145 . 0 0 "[ . 1 . 2]" 1
1204 1 66 GLN QG 1 67 ILE H . . 5.020 4.442 4.332 4.619 . 0 0 "[ . 1 . 2]" 1
1205 1 67 ILE H 1 67 ILE HB . . 2.980 2.390 2.313 2.461 . 0 0 "[ . 1 . 2]" 1
1206 1 67 ILE H 1 67 ILE MD . . 3.730 3.238 2.967 3.636 . 0 0 "[ . 1 . 2]" 1
1207 1 67 ILE H 1 67 ILE HG12 . . 3.570 3.232 1.950 3.649 0.079 18 0 "[ . 1 . 2]" 1
1208 1 67 ILE H 1 67 ILE HG13 . . 3.650 2.464 2.068 3.585 . 0 0 "[ . 1 . 2]" 1
1209 1 67 ILE H 1 67 ILE MG . . 4.070 3.706 3.684 3.715 . 0 0 "[ . 1 . 2]" 1
1210 1 67 ILE H 1 68 ASP H . . 3.200 2.559 2.483 2.627 . 0 0 "[ . 1 . 2]" 1
1211 1 67 ILE H 1 68 ASP HB2 . . 5.490 4.773 4.606 4.969 . 0 0 "[ . 1 . 2]" 1
1212 1 67 ILE H 1 69 GLY H . . 4.570 3.363 3.305 3.543 . 0 0 "[ . 1 . 2]" 1
1213 1 67 ILE HA 1 67 ILE HG12 . . 3.860 2.777 2.639 2.940 . 0 0 "[ . 1 . 2]" 1
1214 1 67 ILE HA 1 67 ILE HG13 . . 3.810 2.987 2.670 3.786 . 0 0 "[ . 1 . 2]" 1
1215 1 67 ILE HA 1 67 ILE MG . . 3.060 2.398 2.293 2.472 . 0 0 "[ . 1 . 2]" 1
1216 1 67 ILE HB 1 68 ASP H . . 3.510 2.768 2.705 2.993 . 0 0 "[ . 1 . 2]" 1
1217 1 67 ILE MD 1 68 ASP H . . 5.490 4.480 4.152 4.864 . 0 0 "[ . 1 . 2]" 1
1218 1 67 ILE HG12 1 67 ILE MG . . 3.550 2.471 2.095 3.227 . 0 0 "[ . 1 . 2]" 1
1219 1 67 ILE HG12 1 68 ASP H . . 5.490 4.981 4.194 5.296 . 0 0 "[ . 1 . 2]" 1
1220 1 67 ILE HG13 1 68 ASP H . . 5.490 4.492 4.289 5.104 . 0 0 "[ . 1 . 2]" 1
1221 1 67 ILE MG 1 68 ASP H . . 3.940 3.588 3.503 3.675 . 0 0 "[ . 1 . 2]" 1
1222 1 68 ASP H 1 68 ASP HB2 . . 3.700 2.385 2.251 2.531 . 0 0 "[ . 1 . 2]" 1
1223 1 68 ASP H 1 68 ASP HB3 . . 4.070 3.585 3.448 3.673 . 0 0 "[ . 1 . 2]" 1
1224 1 68 ASP HA 1 70 ILE H . . 5.350 4.765 4.643 4.823 . 0 0 "[ . 1 . 2]" 1
1225 1 68 ASP HB2 1 69 GLY H . . 4.700 3.254 3.201 3.371 . 0 0 "[ . 1 . 2]" 1
1226 1 68 ASP HB2 1 70 ILE H . . 5.210 2.967 2.755 3.211 . 0 0 "[ . 1 . 2]" 1
1227 1 68 ASP HB2 1 70 ILE HB . . 5.490 3.172 2.885 3.445 . 0 0 "[ . 1 . 2]" 1
1228 1 68 ASP HB2 1 70 ILE MD . . 4.160 3.006 2.380 4.100 . 0 0 "[ . 1 . 2]" 1
1229 1 68 ASP HB2 1 70 ILE HG12 . . 5.240 4.711 2.434 5.193 . 0 0 "[ . 1 . 2]" 1
1230 1 68 ASP HB2 1 70 ILE HG13 . . 4.770 3.270 2.675 3.663 . 0 0 "[ . 1 . 2]" 1
1231 1 68 ASP HB3 1 69 GLY H . . 4.890 4.024 3.836 4.191 . 0 0 "[ . 1 . 2]" 1
1232 1 68 ASP HB3 1 70 ILE H . . 4.350 3.712 3.313 3.999 . 0 0 "[ . 1 . 2]" 1
1233 1 68 ASP HB3 1 70 ILE HB . . 3.940 3.539 3.130 3.941 0.001 12 0 "[ . 1 . 2]" 1
1234 1 68 ASP HB3 1 70 ILE MD . . 3.910 2.162 1.953 3.533 . 0 0 "[ . 1 . 2]" 1
1235 1 68 ASP HB3 1 70 ILE HG12 . . 5.040 3.949 2.311 4.419 . 0 0 "[ . 1 . 2]" 1
1236 1 68 ASP HB3 1 70 ILE HG13 . . 4.570 2.579 2.007 2.930 . 0 0 "[ . 1 . 2]" 1
1237 1 69 GLY H 1 70 ILE H . . 3.540 2.558 2.488 2.614 . 0 0 "[ . 1 . 2]" 1
1238 1 69 GLY H 1 70 ILE HB . . 5.500 4.816 4.678 5.054 . 0 0 "[ . 1 . 2]" 1
1239 1 70 ILE H 1 70 ILE HB . . 3.620 2.554 2.451 2.701 . 0 0 "[ . 1 . 2]" 1
1240 1 70 ILE H 1 70 ILE MD . . 4.860 3.793 3.509 3.989 . 0 0 "[ . 1 . 2]" 1
1241 1 70 ILE H 1 70 ILE HG12 . . 4.680 3.889 2.361 4.119 . 0 0 "[ . 1 . 2]" 1
1242 1 70 ILE H 1 70 ILE HG13 . . 4.170 2.792 2.429 3.784 . 0 0 "[ . 1 . 2]" 1
1243 1 70 ILE H 1 70 ILE MG . . 4.700 3.801 3.750 3.859 . 0 0 "[ . 1 . 2]" 1
1244 1 70 ILE H 1 71 VAL H . . 5.370 4.496 4.460 4.526 . 0 0 "[ . 1 . 2]" 1
1245 1 70 ILE HA 1 70 ILE MD . . 4.200 3.774 2.169 3.924 . 0 0 "[ . 1 . 2]" 1
1246 1 70 ILE HA 1 70 ILE HG12 . . 3.880 2.645 2.517 3.181 . 0 0 "[ . 1 . 2]" 1
1247 1 70 ILE HA 1 70 ILE HG13 . . 4.200 2.962 2.826 3.858 . 0 0 "[ . 1 . 2]" 1
1248 1 70 ILE HA 1 70 ILE MG . . 3.630 2.357 2.195 2.446 . 0 0 "[ . 1 . 2]" 1
1249 1 70 ILE HA 1 71 VAL H . . 3.210 2.298 2.255 2.428 . 0 0 "[ . 1 . 2]" 1
1250 1 70 ILE HA 1 71 VAL QG . . 5.040 3.511 3.298 3.696 . 0 0 "[ . 1 . 2]" 1
1251 1 70 ILE HB 1 71 VAL H . . 4.530 3.993 3.594 4.145 . 0 0 "[ . 1 . 2]" 1
1252 1 70 ILE HB 1 72 HIS HD2 . . 5.490 3.683 3.515 4.167 . 0 0 "[ . 1 . 2]" 1
1253 1 70 ILE MD 1 70 ILE MG . . 3.460 2.086 1.977 2.174 . 0 0 "[ . 1 . 2]" 1
1254 1 70 ILE HG12 1 71 VAL H . . 5.500 4.374 4.165 5.113 . 0 0 "[ . 1 . 2]" 1
1255 1 70 ILE MG 1 71 VAL H . . 3.750 1.990 1.928 2.095 . 0 0 "[ . 1 . 2]" 1
1256 1 70 ILE MG 1 71 VAL HA . . 4.890 3.972 3.881 4.174 . 0 0 "[ . 1 . 2]" 1
1257 1 70 ILE MG 1 71 VAL HB . . 4.890 4.054 3.657 4.914 0.024 5 0 "[ . 1 . 2]" 1
1258 1 70 ILE MG 1 71 VAL QG . . 4.040 3.480 2.731 3.795 . 0 0 "[ . 1 . 2]" 1
1259 1 70 ILE MG 1 72 HIS HD2 . . 4.660 3.529 2.960 4.142 . 0 0 "[ . 1 . 2]" 1
1260 1 71 VAL H 1 71 VAL HB . . 3.890 2.681 2.253 3.660 . 0 0 "[ . 1 . 2]" 1
1261 1 71 VAL H 1 71 VAL QG . . 4.070 2.371 1.955 2.629 . 0 0 "[ . 1 . 2]" 1
1262 1 71 VAL HA 1 72 HIS H . . 3.030 2.209 2.182 2.258 . 0 0 "[ . 1 . 2]" 1
1263 1 71 VAL HA 1 72 HIS HB2 . . 5.240 4.189 4.085 4.514 . 0 0 "[ . 1 . 2]" 1
1264 1 71 VAL HA 1 72 HIS HD2 . . 5.040 4.455 3.404 4.923 . 0 0 "[ . 1 . 2]" 1
1265 1 71 VAL HB 1 72 HIS H . . 4.660 4.008 3.057 4.491 . 0 0 "[ . 1 . 2]" 1
1266 1 71 VAL HB 1 73 PHE QE . . 4.420 3.615 2.908 4.054 . 0 0 "[ . 1 . 2]" 1
1267 1 71 VAL QG 1 72 HIS H . . 3.970 2.916 2.128 3.539 . 0 0 "[ . 1 . 2]" 1
1268 1 71 VAL QG 1 72 HIS HA . . 5.240 3.905 3.597 4.051 . 0 0 "[ . 1 . 2]" 1
1269 1 71 VAL QG 1 73 PHE H . . 5.420 4.040 3.752 4.531 . 0 0 "[ . 1 . 2]" 1
1270 1 71 VAL QG 1 73 PHE QD . . 4.490 3.267 2.887 3.758 . 0 0 "[ . 1 . 2]" 1
1271 1 71 VAL QG 1 73 PHE QE . . 3.860 2.648 2.248 2.983 . 0 0 "[ . 1 . 2]" 1
1272 1 71 VAL QG 1 73 PHE HZ . . 4.360 2.730 2.129 3.338 . 0 0 "[ . 1 . 2]" 1
1273 1 72 HIS H 1 72 HIS HB2 . . 3.900 2.224 2.091 2.350 . 0 0 "[ . 1 . 2]" 1
1274 1 72 HIS H 1 72 HIS HB3 . . 3.570 3.372 3.249 3.563 . 0 0 "[ . 1 . 2]" 1
1275 1 72 HIS H 1 72 HIS HD2 . . 4.400 3.662 2.453 4.066 . 0 0 "[ . 1 . 2]" 1
1276 1 72 HIS HA 1 73 PHE H . . 3.050 2.190 2.186 2.191 . 0 0 "[ . 1 . 2]" 1
1277 1 72 HIS HA 1 73 PHE HB3 . . 5.490 5.586 5.501 5.630 0.140 6 0 "[ . 1 . 2]" 1
1278 1 72 HIS HA 1 73 PHE QD . . 5.490 4.744 4.477 4.860 . 0 0 "[ . 1 . 2]" 1
1279 1 72 HIS HB2 1 73 PHE H . . 4.770 4.625 4.496 4.657 . 0 0 "[ . 1 . 2]" 1
1280 1 72 HIS HB3 1 73 PHE H . . 4.850 3.837 3.613 3.915 . 0 0 "[ . 1 . 2]" 1
1281 1 73 PHE H 1 73 PHE HB2 . . 4.070 2.178 2.069 2.336 . 0 0 "[ . 1 . 2]" 1
1282 1 73 PHE H 1 73 PHE HB3 . . 3.520 3.451 3.341 3.552 0.032 4 0 "[ . 1 . 2]" 1
1283 1 73 PHE H 1 73 PHE QD . . 3.930 3.406 3.313 3.524 . 0 0 "[ . 1 . 2]" 1
1284 1 73 PHE HA 1 73 PHE QD . . 3.430 2.113 1.964 2.436 . 0 0 "[ . 1 . 2]" 1
1285 1 73 PHE HA 1 73 PHE QE . . 5.240 4.328 4.273 4.380 . 0 0 "[ . 1 . 2]" 1
1286 1 73 PHE HA 1 74 GLU H . . 3.210 2.344 2.303 2.392 . 0 0 "[ . 1 . 2]" 1
1287 1 73 PHE HA 1 74 GLU HB3 . . 5.490 4.384 4.293 4.480 . 0 0 "[ . 1 . 2]" 1
1288 1 73 PHE HB2 1 74 GLU H . . 4.000 4.085 3.854 4.273 0.273 8 0 "[ . 1 . 2]" 1
1289 1 73 PHE HB3 1 74 GLU H . . 4.300 2.902 2.733 3.088 . 0 0 "[ . 1 . 2]" 1
1290 1 73 PHE QD 1 74 GLU H . . 4.660 3.366 2.780 3.880 . 0 0 "[ . 1 . 2]" 1
1291 1 74 GLU H 1 74 GLU HB2 . . 4.040 3.473 3.082 3.602 . 0 0 "[ . 1 . 2]" 1
1292 1 74 GLU H 1 74 GLU HB3 . . 3.540 2.493 2.229 2.653 . 0 0 "[ . 1 . 2]" 1
1293 1 74 GLU H 1 74 GLU QG . . 3.920 2.686 2.052 3.781 . 0 0 "[ . 1 . 2]" 1
1294 1 74 GLU HA 1 74 GLU QG . . 3.680 3.270 2.700 3.471 . 0 0 "[ . 1 . 2]" 1
1295 1 74 GLU HA 1 75 THR H . . 2.990 2.318 2.245 2.382 . 0 0 "[ . 1 . 2]" 1
1296 1 74 GLU HA 1 75 THR MG . . 4.360 3.558 3.105 3.860 . 0 0 "[ . 1 . 2]" 1
1297 1 74 GLU HB2 1 74 GLU QG . . 2.780 2.440 2.206 2.545 . 0 0 "[ . 1 . 2]" 1
1298 1 74 GLU HB2 1 75 THR H . . 4.150 3.238 2.835 3.825 . 0 0 "[ . 1 . 2]" 1
1299 1 74 GLU HB3 1 75 THR H . . 4.330 4.165 4.047 4.306 . 0 0 "[ . 1 . 2]" 1
1300 1 74 GLU QG 1 75 THR H . . 4.400 3.473 2.033 3.963 . 0 0 "[ . 1 . 2]" 1
1301 1 74 GLU QG 1 76 ARG H . . 5.390 4.843 4.139 5.225 . 0 0 "[ . 1 . 2]" 1
1302 1 75 THR H 1 75 THR HB . . 3.660 3.122 2.817 3.686 0.026 15 0 "[ . 1 . 2]" 1
1303 1 75 THR H 1 75 THR MG . . 3.950 2.040 1.890 2.977 . 0 0 "[ . 1 . 2]" 1
1304 1 75 THR HA 1 75 THR HB . . 2.870 2.443 2.390 2.622 . 0 0 "[ . 1 . 2]" 1
1305 1 75 THR HA 1 75 THR MG . . 3.300 3.084 2.211 3.246 . 0 0 "[ . 1 . 2]" 1
1306 1 75 THR HA 1 76 ARG H . . 3.040 2.258 2.186 2.278 . 0 0 "[ . 1 . 2]" 1
1307 1 75 THR HB 1 76 ARG H . . 4.000 3.851 3.034 4.073 0.073 4 0 "[ . 1 . 2]" 1
1308 1 75 THR MG 1 76 ARG H . . 4.400 3.977 3.788 4.322 . 0 0 "[ . 1 . 2]" 1
1309 1 75 THR MG 1 76 ARG HA . . 5.490 4.814 4.194 5.508 0.018 9 0 "[ . 1 . 2]" 1
1310 1 75 THR MG 1 77 GLU H . . 5.370 5.256 4.958 5.394 0.024 20 0 "[ . 1 . 2]" 1
1311 1 76 ARG H 1 76 ARG HB2 . . 3.690 2.551 2.033 3.557 . 0 0 "[ . 1 . 2]" 1
1312 1 76 ARG H 1 76 ARG HB3 . . 4.000 3.199 2.284 3.655 . 0 0 "[ . 1 . 2]" 1
1313 1 76 ARG H 1 76 ARG HG2 . . 3.910 3.547 2.021 4.512 0.602 11 1 "[ . 1+ . 2]" 1
1314 1 76 ARG HA 1 76 ARG HD2 . . 4.300 3.722 2.035 4.858 0.558 10 1 "[ . + . 2]" 1
1315 1 76 ARG HA 1 76 ARG HG2 . . 3.720 2.798 2.208 4.279 0.559 16 2 "[ . 1 .+ -]" 1
1316 1 76 ARG HA 1 77 GLU H . . 3.050 2.349 2.234 2.560 . 0 0 "[ . 1 . 2]" 1
1317 1 76 ARG HB2 1 76 ARG HD2 . . 3.970 3.311 2.370 3.853 . 0 0 "[ . 1 . 2]" 1
1318 1 76 ARG HB2 1 76 ARG HG2 . . 2.570 2.741 2.562 3.052 0.482 1 0 "[ . 1 . 2]" 1
1319 1 76 ARG HB2 1 77 GLU H . . 4.580 4.088 2.588 4.666 0.086 15 0 "[ . 1 . 2]" 1
1320 1 76 ARG HB3 1 76 ARG HD2 . . 4.040 2.830 2.118 4.128 0.088 16 0 "[ . 1 . 2]" 1
1321 1 76 ARG HB3 1 76 ARG HG2 . . 3.040 2.796 2.342 3.052 0.012 18 0 "[ . 1 . 2]" 1
1322 1 76 ARG HB3 1 77 GLU H . . 4.410 3.704 2.854 4.537 0.127 17 0 "[ . 1 . 2]" 1
1323 1 76 ARG HG2 1 77 GLU H . . 4.750 4.165 3.193 5.024 0.274 16 0 "[ . 1 . 2]" 1
1324 1 77 GLU H 1 77 GLU HB2 . . 4.100 2.648 2.108 3.588 . 0 0 "[ . 1 . 2]" 1
1325 1 77 GLU H 1 77 GLU HB3 . . 3.620 3.428 2.422 4.078 0.458 1 0 "[ . 1 . 2]" 1
1326 1 77 GLU H 1 77 GLU HG2 . . 4.450 3.579 2.077 4.618 0.168 6 0 "[ . 1 . 2]" 1
1327 1 77 GLU HA 1 77 GLU HG2 . . 3.910 2.788 2.032 3.989 0.079 11 0 "[ . 1 . 2]" 1
1328 1 77 GLU HA 1 78 ALA H . . 3.220 2.327 2.209 2.560 . 0 0 "[ . 1 . 2]" 1
1329 1 77 GLU HB2 1 78 ALA H . . 4.630 4.203 2.878 4.739 0.109 18 0 "[ . 1 . 2]" 1
1330 1 77 GLU HB3 1 78 ALA H . . 4.860 3.637 2.351 4.386 . 0 0 "[ . 1 . 2]" 1
1331 1 78 ALA H 1 78 ALA MB . . 3.520 2.509 1.933 2.924 . 0 0 "[ . 1 . 2]" 1
1332 1 78 ALA HA 1 79 SER H . . 3.630 2.517 2.187 3.642 0.012 3 0 "[ . 1 . 2]" 1
1333 1 78 ALA MB 1 79 SER H . . 4.650 3.089 2.151 3.754 . 0 0 "[ . 1 . 2]" 1
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