NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
638814 |
5zsy   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5zsy
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 1415
_Distance_constraint_stats_list.Viol_count 2930
_Distance_constraint_stats_list.Viol_total 4948.056
_Distance_constraint_stats_list.Viol_max 0.981
_Distance_constraint_stats_list.Viol_rms 0.0413
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0087
_Distance_constraint_stats_list.Viol_average_violations_only 0.0844
_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 3 MET 1.057 0.110 14 0 "[ . 1 . 2]"
1 4 ASP 7.828 0.520 5 1 "[ + 1 . 2]"
1 5 THR 8.885 0.520 5 1 "[ + 1 . 2]"
1 6 ILE 4.549 0.104 7 0 "[ . 1 . 2]"
1 7 ILE 9.179 0.507 11 1 "[ . 1+ . 2]"
1 8 LEU 0.926 0.084 4 0 "[ . 1 . 2]"
1 9 ARG 4.556 0.759 13 1 "[ . 1 + . 2]"
1 10 ASN 7.437 0.109 17 0 "[ . 1 . 2]"
1 11 LEU 4.152 0.156 8 0 "[ . 1 . 2]"
1 12 ASN 6.018 0.496 17 0 "[ . 1 . 2]"
1 13 PRO 3.960 0.500 13 0 "[ . 1 . 2]"
1 14 HIS 7.444 0.314 20 0 "[ . 1 . 2]"
1 15 SER 4.476 0.364 3 0 "[ . 1 . 2]"
1 16 THR 3.209 0.590 13 2 "[ . 1 + - 2]"
1 17 MET 1.946 0.104 1 0 "[ . 1 . 2]"
1 18 ASP 1.741 0.838 19 1 "[ . 1 . +2]"
1 19 SER 3.960 0.680 7 3 "[ -. + 1 * . 2]"
1 20 ILE 8.446 0.680 7 2 "[ -. + 1 . 2]"
1 21 LEU 6.692 0.838 19 1 "[ . 1 . +2]"
1 22 GLY 3.332 0.557 19 1 "[ . 1 . +2]"
1 23 ALA 4.247 0.128 10 0 "[ . 1 . 2]"
1 24 LEU 10.410 0.793 6 5 "[ * .+ 1- * *]"
1 25 ALA 7.537 0.439 2 0 "[ . 1 . 2]"
1 26 PRO 5.305 0.298 20 0 "[ . 1 . 2]"
1 27 TYR 2.234 0.126 10 0 "[ . 1 . 2]"
1 28 ALA 2.825 0.128 19 0 "[ . 1 . 2]"
1 29 VAL 2.842 0.101 15 0 "[ . 1 . 2]"
1 30 LEU 3.762 0.106 1 0 "[ . 1 . 2]"
1 31 SER 13.907 0.981 4 11 "[***+- ** * .*** 2]"
1 32 SER 1.962 0.460 8 0 "[ . 1 . 2]"
1 33 SER 2.633 0.309 1 0 "[ . 1 . 2]"
1 34 ASN 15.441 0.981 4 12 "[***+- ** * **** 2]"
1 35 VAL 3.861 0.100 7 0 "[ . 1 . 2]"
1 36 ARG 3.140 0.098 10 0 "[ . 1 . 2]"
1 37 VAL 3.436 0.420 4 0 "[ . 1 . 2]"
1 38 ILE 2.712 0.125 2 0 "[ . 1 . 2]"
1 39 LYS 0.844 0.090 9 0 "[ . 1 . 2]"
1 40 ASP 7.928 0.120 19 0 "[ . 1 . 2]"
1 41 LYS 5.582 0.422 7 0 "[ . 1 . 2]"
1 42 GLN 5.205 0.155 6 0 "[ . 1 . 2]"
1 43 THR 3.943 0.106 14 0 "[ . 1 . 2]"
1 44 GLN 3.212 0.286 10 0 "[ . 1 . 2]"
1 45 LEU 6.158 0.168 8 0 "[ . 1 . 2]"
1 46 ASN 9.240 0.510 15 1 "[ . 1 + 2]"
1 47 ARG 5.137 0.125 2 0 "[ . 1 . 2]"
1 48 GLY 1.264 0.079 3 0 "[ . 1 . 2]"
1 49 PHE 0.314 0.092 12 0 "[ . 1 . 2]"
1 50 ALA 1.454 0.100 13 0 "[ . 1 . 2]"
1 51 PHE 7.217 0.121 20 0 "[ . 1 . 2]"
1 52 ILE 5.345 0.104 7 0 "[ . 1 . 2]"
1 53 GLN 5.059 0.176 20 0 "[ . 1 . 2]"
1 54 LEU 6.723 0.749 15 1 "[ . 1 + 2]"
1 55 SER 0.044 0.044 3 0 "[ . 1 . 2]"
1 56 THR 1.725 0.156 12 0 "[ . 1 . 2]"
1 57 ILE 8.413 0.372 9 0 "[ . 1 . 2]"
1 58 GLU 6.758 0.425 15 0 "[ . 1 . 2]"
1 59 ALA 6.482 0.116 3 0 "[ . 1 . 2]"
1 60 ALA 2.261 0.092 17 0 "[ . 1 . 2]"
1 61 GLN 3.632 0.611 15 1 "[ . 1 + 2]"
1 62 LEU 4.631 0.128 19 0 "[ . 1 . 2]"
1 63 LEU 6.592 0.105 18 0 "[ . 1 . 2]"
1 64 GLN 5.095 0.105 18 0 "[ . 1 . 2]"
1 65 ILE 4.320 0.611 15 1 "[ . 1 + 2]"
1 66 LEU 2.442 0.098 10 0 "[ . 1 . 2]"
1 67 GLN 9.012 0.102 6 0 "[ . 1 . 2]"
1 68 ALA 2.726 0.091 16 0 "[ . 1 . 2]"
1 69 LEU 3.432 0.231 18 0 "[ . 1 . 2]"
1 70 HIS 0.369 0.063 11 0 "[ . 1 . 2]"
1 71 PRO 2.051 0.231 18 0 "[ . 1 . 2]"
1 72 PRO 2.905 0.112 11 0 "[ . 1 . 2]"
1 73 LEU 3.582 0.292 20 0 "[ . 1 . 2]"
1 74 THR 11.323 0.138 14 0 "[ . 1 . 2]"
1 75 ILE 9.876 0.128 10 0 "[ . 1 . 2]"
1 76 ASP 5.190 0.110 8 0 "[ . 1 . 2]"
1 77 GLY 3.120 0.105 9 0 "[ . 1 . 2]"
1 78 LYS 8.460 0.957 9 1 "[ . +1 . 2]"
1 79 THR 9.086 0.138 14 0 "[ . 1 . 2]"
1 80 ILE 3.605 0.100 9 0 "[ . 1 . 2]"
1 81 ASN 2.602 0.759 13 1 "[ . 1 + . 2]"
1 82 VAL 6.369 0.827 7 7 "[ * * + ** -* 2]"
1 83 GLU 22.126 0.827 7 7 "[ * * + *- ** 2]"
1 84 PHE 15.796 0.478 12 0 "[ . 1 . 2]"
1 85 ALA 1.829 0.119 4 0 "[ . 1 . 2]"
1 86 LYS 8.433 0.548 9 1 "[ . +1 . 2]"
1 87 GLY 3.027 0.486 15 0 "[ . 1 . 2]"
1 88 SER 3.004 0.486 15 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 3 MET HA 1 4 ASP H . . 2.990 2.355 1.984 3.043 0.053 5 0 "[ . 1 . 2]" 1
2 1 3 MET HA 1 86 LYS QD . . 3.420 3.243 2.188 3.530 0.110 14 0 "[ . 1 . 2]" 1
3 1 3 MET HB3 1 4 ASP H . . 4.900 3.710 1.902 4.569 . 0 0 "[ . 1 . 2]" 1
4 1 4 ASP H 1 4 ASP HB2 . . 3.640 3.400 2.389 3.928 0.288 2 0 "[ . 1 . 2]" 1
5 1 4 ASP H 1 4 ASP HB3 . . 3.950 3.730 3.063 4.033 0.083 16 0 "[ . 1 . 2]" 1
6 1 4 ASP H 1 5 THR H . . 3.910 3.493 3.048 3.992 0.082 10 0 "[ . 1 . 2]" 1
7 1 4 ASP H 1 5 THR HA . . 5.500 5.298 4.662 5.593 0.093 9 0 "[ . 1 . 2]" 1
8 1 4 ASP H 1 59 ALA MB . . 4.850 4.870 4.136 4.966 0.116 3 0 "[ . 1 . 2]" 1
9 1 4 ASP H 1 86 LYS HA . . 4.520 3.098 2.060 4.592 0.072 14 0 "[ . 1 . 2]" 1
10 1 4 ASP H 1 86 LYS QD . . 3.720 2.824 2.032 3.818 0.098 11 0 "[ . 1 . 2]" 1
11 1 4 ASP H 1 87 GLY H . . 5.500 3.743 2.032 5.577 0.077 11 0 "[ . 1 . 2]" 1
12 1 4 ASP HA 1 5 THR H . . 3.140 2.120 1.835 2.311 . 0 0 "[ . 1 . 2]" 1
13 1 4 ASP HA 1 59 ALA MB . . 4.960 3.560 2.727 4.169 . 0 0 "[ . 1 . 2]" 1
14 1 4 ASP HA 1 86 LYS HA . . 3.970 2.791 2.208 3.852 . 0 0 "[ . 1 . 2]" 1
15 1 4 ASP HA 1 86 LYS QD . . 3.610 3.149 2.307 3.705 0.095 5 0 "[ . 1 . 2]" 1
16 1 4 ASP HB2 1 5 THR H . . 4.580 4.306 3.174 4.653 0.073 18 0 "[ . 1 . 2]" 1
17 1 4 ASP HB2 1 56 THR HA . . 4.470 2.813 2.057 4.138 . 0 0 "[ . 1 . 2]" 1
18 1 4 ASP HB2 1 59 ALA H . . 5.330 4.668 4.218 5.371 0.041 4 0 "[ . 1 . 2]" 1
19 1 4 ASP HB2 1 59 ALA MB . . 3.370 2.677 2.037 3.443 0.073 1 0 "[ . 1 . 2]" 1
20 1 4 ASP HB3 1 5 THR H . . 3.850 3.942 3.407 4.370 0.520 5 1 "[ + 1 . 2]" 1
21 1 4 ASP HB3 1 56 THR HA . . 4.080 3.415 2.104 4.236 0.156 12 0 "[ . 1 . 2]" 1
22 1 4 ASP HB3 1 56 THR MG . . 5.500 4.587 3.170 5.557 0.057 12 0 "[ . 1 . 2]" 1
23 1 4 ASP HB3 1 59 ALA MB . . 4.030 2.152 1.878 2.686 . 0 0 "[ . 1 . 2]" 1
24 1 5 THR H 1 5 THR HB . . 3.300 2.812 2.466 3.165 . 0 0 "[ . 1 . 2]" 1
25 1 5 THR H 1 5 THR MG . . 4.480 3.949 3.820 4.078 . 0 0 "[ . 1 . 2]" 1
26 1 5 THR H 1 6 ILE H . . 4.670 4.204 3.920 4.478 . 0 0 "[ . 1 . 2]" 1
27 1 5 THR H 1 59 ALA MB . . 4.680 4.165 3.604 4.762 0.082 20 0 "[ . 1 . 2]" 1
28 1 5 THR H 1 84 PHE HA . . 5.370 4.722 4.359 5.175 . 0 0 "[ . 1 . 2]" 1
29 1 5 THR H 1 84 PHE HD1 . . 4.890 3.875 3.266 4.536 . 0 0 "[ . 1 . 2]" 1
30 1 5 THR H 1 85 ALA H . . 4.610 3.605 3.031 4.329 . 0 0 "[ . 1 . 2]" 1
31 1 5 THR H 1 85 ALA MB . . 4.390 4.023 3.166 4.493 0.103 5 0 "[ . 1 . 2]" 1
32 1 5 THR H 1 86 LYS H . . 4.510 4.540 4.304 4.604 0.094 4 0 "[ . 1 . 2]" 1
33 1 5 THR H 1 86 LYS HA . . 4.560 3.043 2.678 3.617 . 0 0 "[ . 1 . 2]" 1
34 1 5 THR H 1 86 LYS QD . . 5.500 4.529 3.710 5.066 . 0 0 "[ . 1 . 2]" 1
35 1 5 THR H 1 87 GLY H . . 4.990 4.454 3.851 5.065 0.075 11 0 "[ . 1 . 2]" 1
36 1 5 THR HA 1 5 THR MG . . 3.170 2.393 2.201 2.495 . 0 0 "[ . 1 . 2]" 1
37 1 5 THR HA 1 6 ILE H . . 2.830 2.212 2.107 2.351 . 0 0 "[ . 1 . 2]" 1
38 1 5 THR HA 1 6 ILE HB . . 4.810 4.782 4.704 4.860 0.050 9 0 "[ . 1 . 2]" 1
39 1 5 THR HA 1 52 ILE H . . 5.230 4.547 3.876 5.139 . 0 0 "[ . 1 . 2]" 1
40 1 5 THR HA 1 52 ILE HB . . 5.120 4.648 4.407 5.034 . 0 0 "[ . 1 . 2]" 1
41 1 5 THR HA 1 53 GLN QG . . 4.420 4.144 3.367 4.518 0.098 18 0 "[ . 1 . 2]" 1
42 1 5 THR HA 1 54 LEU H . . 4.400 4.099 3.471 4.458 0.058 20 0 "[ . 1 . 2]" 1
43 1 5 THR HA 1 59 ALA MB . . 4.750 4.084 3.290 4.673 . 0 0 "[ . 1 . 2]" 1
44 1 5 THR HA 1 85 ALA H . . 5.140 5.031 4.721 5.198 0.058 13 0 "[ . 1 . 2]" 1
45 1 5 THR HB 1 6 ILE H . . 4.830 4.184 3.824 4.393 . 0 0 "[ . 1 . 2]" 1
46 1 5 THR HB 1 7 ILE H . . 5.500 5.492 4.921 5.575 0.075 1 0 "[ . 1 . 2]" 1
47 1 5 THR HB 1 85 ALA H . . 4.540 3.415 2.849 3.750 . 0 0 "[ . 1 . 2]" 1
48 1 5 THR HB 1 85 ALA MB . . 3.230 2.387 2.017 3.053 . 0 0 "[ . 1 . 2]" 1
49 1 5 THR MG 1 6 ILE H . . 3.380 2.853 2.460 3.265 . 0 0 "[ . 1 . 2]" 1
50 1 5 THR MG 1 7 ILE MD . . 3.410 3.012 2.293 3.513 0.103 16 0 "[ . 1 . 2]" 1
51 1 5 THR MG 1 7 ILE QG . . 4.170 2.370 2.092 2.736 . 0 0 "[ . 1 . 2]" 1
52 1 5 THR MG 1 51 PHE HA . . 3.910 3.234 2.733 3.658 . 0 0 "[ . 1 . 2]" 1
53 1 5 THR MG 1 51 PHE HB2 . . 4.260 3.957 3.471 4.354 0.094 13 0 "[ . 1 . 2]" 1
54 1 5 THR MG 1 51 PHE HB3 . . 3.190 2.566 2.082 2.960 . 0 0 "[ . 1 . 2]" 1
55 1 5 THR MG 1 51 PHE QD . . 3.620 2.471 2.181 2.936 . 0 0 "[ . 1 . 2]" 1
56 1 5 THR MG 1 51 PHE QE . . 4.340 4.068 3.631 4.405 0.065 9 0 "[ . 1 . 2]" 1
57 1 5 THR MG 1 52 ILE H . . 3.680 3.101 2.411 3.647 . 0 0 "[ . 1 . 2]" 1
58 1 5 THR MG 1 52 ILE HB . . 4.460 4.363 4.140 4.543 0.083 5 0 "[ . 1 . 2]" 1
59 1 5 THR MG 1 53 GLN H . . 5.130 4.842 4.429 5.189 0.059 11 0 "[ . 1 . 2]" 1
60 1 5 THR MG 1 53 GLN HA . . 4.630 3.736 3.283 4.209 . 0 0 "[ . 1 . 2]" 1
61 1 5 THR MG 1 53 GLN HE21 . . 5.500 2.471 1.937 4.323 . 0 0 "[ . 1 . 2]" 1
62 1 5 THR MG 1 53 GLN HE22 . . 4.240 3.163 2.188 4.160 . 0 0 "[ . 1 . 2]" 1
63 1 5 THR MG 1 53 GLN QG . . 4.240 3.416 2.226 4.330 0.090 7 0 "[ . 1 . 2]" 1
64 1 5 THR MG 1 85 ALA H . . 4.830 4.100 3.732 4.421 . 0 0 "[ . 1 . 2]" 1
65 1 6 ILE H 1 6 ILE HB . . 3.320 2.640 2.551 2.754 . 0 0 "[ . 1 . 2]" 1
66 1 6 ILE H 1 6 ILE MD . . 4.400 4.004 3.774 4.272 . 0 0 "[ . 1 . 2]" 1
67 1 6 ILE H 1 6 ILE HG12 . . 4.520 3.692 3.145 3.926 . 0 0 "[ . 1 . 2]" 1
68 1 6 ILE H 1 6 ILE HG13 . . 4.040 2.638 2.314 2.871 . 0 0 "[ . 1 . 2]" 1
69 1 6 ILE H 1 7 ILE QG . . 5.500 4.515 4.087 4.852 . 0 0 "[ . 1 . 2]" 1
70 1 6 ILE H 1 51 PHE HA . . 5.010 4.834 4.438 5.079 0.069 3 0 "[ . 1 . 2]" 1
71 1 6 ILE H 1 52 ILE H . . 3.940 3.277 2.742 3.611 . 0 0 "[ . 1 . 2]" 1
72 1 6 ILE H 1 52 ILE HB . . 4.040 2.864 2.642 3.499 . 0 0 "[ . 1 . 2]" 1
73 1 6 ILE H 1 52 ILE MG . . 4.490 3.750 3.480 3.984 . 0 0 "[ . 1 . 2]" 1
74 1 6 ILE H 1 53 GLN H . . 5.500 5.236 4.906 5.542 0.042 10 0 "[ . 1 . 2]" 1
75 1 6 ILE H 1 53 GLN HA . . 4.320 4.104 3.216 4.395 0.075 14 0 "[ . 1 . 2]" 1
76 1 6 ILE H 1 54 LEU H . . 5.500 4.805 4.296 5.333 . 0 0 "[ . 1 . 2]" 1
77 1 6 ILE H 1 84 PHE HA . . 5.420 5.138 4.800 5.407 . 0 0 "[ . 1 . 2]" 1
78 1 6 ILE H 1 84 PHE HD1 . . 5.500 4.890 4.017 5.573 0.073 18 0 "[ . 1 . 2]" 1
79 1 6 ILE HA 1 6 ILE MD . . 4.110 3.865 3.726 3.923 . 0 0 "[ . 1 . 2]" 1
80 1 6 ILE HA 1 6 ILE HG12 . . 3.870 2.581 2.461 2.673 . 0 0 "[ . 1 . 2]" 1
81 1 6 ILE HA 1 6 ILE HG13 . . 3.960 3.219 3.134 3.384 . 0 0 "[ . 1 . 2]" 1
82 1 6 ILE HA 1 7 ILE H . . 3.260 2.202 2.134 2.369 . 0 0 "[ . 1 . 2]" 1
83 1 6 ILE HA 1 7 ILE QG . . 4.860 3.933 3.427 4.603 . 0 0 "[ . 1 . 2]" 1
84 1 6 ILE HA 1 52 ILE H . . 5.500 4.934 4.827 5.057 . 0 0 "[ . 1 . 2]" 1
85 1 6 ILE HA 1 84 PHE HA . . 3.210 2.610 2.433 2.972 . 0 0 "[ . 1 . 2]" 1
86 1 6 ILE HA 1 85 ALA H . . 4.210 3.400 2.910 3.892 . 0 0 "[ . 1 . 2]" 1
87 1 6 ILE HB 1 6 ILE MD . . 3.600 2.449 2.353 2.644 . 0 0 "[ . 1 . 2]" 1
88 1 6 ILE HB 1 52 ILE H . . 4.220 3.738 3.468 4.137 . 0 0 "[ . 1 . 2]" 1
89 1 6 ILE HB 1 52 ILE HB . . 2.970 2.080 1.977 2.435 . 0 0 "[ . 1 . 2]" 1
90 1 6 ILE HB 1 52 ILE MG . . 3.130 3.145 2.702 3.223 0.093 15 0 "[ . 1 . 2]" 1
91 1 6 ILE MD 1 59 ALA HA . . 3.610 2.618 2.205 3.356 . 0 0 "[ . 1 . 2]" 1
92 1 6 ILE MD 1 62 LEU H . . 4.700 4.570 4.214 4.770 0.070 7 0 "[ . 1 . 2]" 1
93 1 6 ILE MD 1 63 LEU H . . 3.690 3.020 2.656 3.432 . 0 0 "[ . 1 . 2]" 1
94 1 6 ILE MD 1 63 LEU HA . . 4.070 2.916 2.410 3.447 . 0 0 "[ . 1 . 2]" 1
95 1 6 ILE MD 1 63 LEU QB . . 3.310 2.308 2.136 2.547 . 0 0 "[ . 1 . 2]" 1
96 1 6 ILE MD 1 64 GLN H . . 5.500 5.120 4.839 5.417 . 0 0 "[ . 1 . 2]" 1
97 1 6 ILE MD 1 84 PHE HD1 . . 4.490 4.321 3.970 4.587 0.097 13 0 "[ . 1 . 2]" 1
98 1 6 ILE HG12 1 59 ALA MB . . 4.050 3.569 3.203 4.125 0.075 19 0 "[ . 1 . 2]" 1
99 1 6 ILE HG12 1 63 LEU H . . 5.500 4.861 4.249 5.392 . 0 0 "[ . 1 . 2]" 1
100 1 6 ILE HG12 1 63 LEU QB . . 4.410 2.855 2.319 3.337 . 0 0 "[ . 1 . 2]" 1
101 1 6 ILE HG12 1 84 PHE HD1 . . 4.350 2.858 2.434 3.298 . 0 0 "[ . 1 . 2]" 1
102 1 6 ILE HG13 1 52 ILE MG . . 3.710 3.788 3.770 3.814 0.104 7 0 "[ . 1 . 2]" 1
103 1 6 ILE HG13 1 84 PHE HD1 . . 4.380 3.961 3.586 4.299 . 0 0 "[ . 1 . 2]" 1
104 1 7 ILE H 1 7 ILE HB . . 3.440 2.649 2.489 2.746 . 0 0 "[ . 1 . 2]" 1
105 1 7 ILE H 1 7 ILE MD . . 4.250 3.441 2.226 4.212 . 0 0 "[ . 1 . 2]" 1
106 1 7 ILE H 1 7 ILE QG . . 3.820 2.903 2.472 3.463 . 0 0 "[ . 1 . 2]" 1
107 1 7 ILE H 1 8 LEU H . . 5.270 4.440 4.339 4.527 . 0 0 "[ . 1 . 2]" 1
108 1 7 ILE H 1 51 PHE HA . . 5.500 4.966 4.727 5.270 . 0 0 "[ . 1 . 2]" 1
109 1 7 ILE H 1 51 PHE QD . . 5.500 5.519 5.062 5.589 0.089 17 0 "[ . 1 . 2]" 1
110 1 7 ILE H 1 52 ILE H . . 5.500 4.941 4.823 5.123 . 0 0 "[ . 1 . 2]" 1
111 1 7 ILE H 1 82 VAL MG1 . . 5.190 4.081 3.377 4.520 . 0 0 "[ . 1 . 2]" 1
112 1 7 ILE H 1 83 GLU H . . 3.880 2.870 2.574 3.104 . 0 0 "[ . 1 . 2]" 1
113 1 7 ILE H 1 83 GLU HB2 . . 5.060 3.393 2.928 3.800 . 0 0 "[ . 1 . 2]" 1
114 1 7 ILE H 1 83 GLU HB3 . . 4.610 3.726 3.086 4.709 0.099 17 0 "[ . 1 . 2]" 1
115 1 7 ILE H 1 84 PHE HA . . 4.210 3.488 2.976 3.918 . 0 0 "[ . 1 . 2]" 1
116 1 7 ILE H 1 85 ALA H . . 4.770 3.982 3.432 4.610 . 0 0 "[ . 1 . 2]" 1
117 1 7 ILE H 1 85 ALA MB . . 5.300 4.552 3.852 5.029 . 0 0 "[ . 1 . 2]" 1
118 1 7 ILE HA 1 7 ILE MD . . 4.420 3.724 3.447 3.889 . 0 0 "[ . 1 . 2]" 1
119 1 7 ILE HA 1 7 ILE QG . . 3.760 2.405 2.263 2.497 . 0 0 "[ . 1 . 2]" 1
120 1 7 ILE HA 1 8 LEU H . . 2.850 2.233 2.070 2.344 . 0 0 "[ . 1 . 2]" 1
121 1 7 ILE HA 1 50 ALA MB . . 4.950 4.780 4.536 5.004 0.054 19 0 "[ . 1 . 2]" 1
122 1 7 ILE HA 1 51 PHE HA . . 3.370 2.395 2.167 2.704 . 0 0 "[ . 1 . 2]" 1
123 1 7 ILE HA 1 51 PHE QD . . 3.910 3.688 2.823 3.979 0.069 8 0 "[ . 1 . 2]" 1
124 1 7 ILE HA 1 51 PHE QE . . 5.460 5.049 4.515 5.353 . 0 0 "[ . 1 . 2]" 1
125 1 7 ILE HA 1 52 ILE H . . 4.380 3.389 3.209 3.780 . 0 0 "[ . 1 . 2]" 1
126 1 7 ILE HB 1 8 LEU H . . 3.940 3.919 3.707 4.024 0.084 4 0 "[ . 1 . 2]" 1
127 1 7 ILE HB 1 51 PHE QD . . 4.990 4.884 4.473 5.039 0.049 18 0 "[ . 1 . 2]" 1
128 1 7 ILE HB 1 51 PHE QE . . 5.160 5.155 4.734 5.249 0.089 11 0 "[ . 1 . 2]" 1
129 1 7 ILE HB 1 83 GLU H . . 4.480 3.739 3.126 4.489 0.009 17 0 "[ . 1 . 2]" 1
130 1 7 ILE HB 1 83 GLU HB2 . . 3.600 2.245 2.031 3.680 0.080 17 0 "[ . 1 . 2]" 1
131 1 7 ILE HB 1 83 GLU HG2 . . 4.610 4.659 3.339 5.117 0.507 11 1 "[ . 1+ . 2]" 1
132 1 7 ILE HB 1 84 PHE H . . 5.500 4.838 4.370 5.543 0.043 15 0 "[ . 1 . 2]" 1
133 1 7 ILE HB 1 85 ALA MB . . 4.280 4.204 3.719 4.399 0.119 4 0 "[ . 1 . 2]" 1
134 1 7 ILE MD 1 51 PHE QD . . 3.570 3.094 2.550 3.691 0.121 20 0 "[ . 1 . 2]" 1
135 1 7 ILE MD 1 51 PHE QE . . 3.700 2.826 2.068 3.800 0.100 5 0 "[ . 1 . 2]" 1
136 1 7 ILE MD 1 83 GLU HB2 . . 4.090 3.658 3.264 4.167 0.077 17 0 "[ . 1 . 2]" 1
137 1 7 ILE MD 1 85 ALA H . . 4.910 3.375 2.115 4.826 . 0 0 "[ . 1 . 2]" 1
138 1 7 ILE MD 1 85 ALA HA . . 4.200 4.008 3.733 4.242 0.042 9 0 "[ . 1 . 2]" 1
139 1 7 ILE MD 1 85 ALA MB . . 3.400 1.948 1.848 2.076 . 0 0 "[ . 1 . 2]" 1
140 1 7 ILE QG 1 8 LEU H . . 4.540 4.106 3.902 4.282 . 0 0 "[ . 1 . 2]" 1
141 1 7 ILE QG 1 51 PHE HA . . 5.460 3.117 2.759 3.484 . 0 0 "[ . 1 . 2]" 1
142 1 7 ILE QG 1 51 PHE QD . . 4.530 2.118 2.003 2.308 . 0 0 "[ . 1 . 2]" 1
143 1 7 ILE QG 1 51 PHE QE . . 5.030 2.919 2.307 3.698 . 0 0 "[ . 1 . 2]" 1
144 1 7 ILE QG 1 85 ALA H . . 5.390 3.707 2.610 5.004 . 0 0 "[ . 1 . 2]" 1
145 1 7 ILE QG 1 85 ALA MB . . 4.250 2.841 2.069 3.594 . 0 0 "[ . 1 . 2]" 1
146 1 8 LEU H 1 8 LEU HB2 . . 3.640 2.604 2.490 2.724 . 0 0 "[ . 1 . 2]" 1
147 1 8 LEU H 1 8 LEU HB3 . . 3.850 3.738 3.600 3.835 . 0 0 "[ . 1 . 2]" 1
148 1 8 LEU H 1 11 LEU QD . . 4.800 4.053 3.807 4.560 . 0 0 "[ . 1 . 2]" 1
149 1 8 LEU H 1 49 PHE HA . . 5.360 4.503 4.324 4.623 . 0 0 "[ . 1 . 2]" 1
150 1 8 LEU H 1 49 PHE QB . . 4.700 3.839 3.610 4.032 . 0 0 "[ . 1 . 2]" 1
151 1 8 LEU H 1 49 PHE QD . . 5.500 5.126 4.802 5.551 0.051 13 0 "[ . 1 . 2]" 1
152 1 8 LEU H 1 50 ALA H . . 3.620 2.543 2.339 2.672 . 0 0 "[ . 1 . 2]" 1
153 1 8 LEU H 1 51 PHE HA . . 4.540 3.641 3.438 3.845 . 0 0 "[ . 1 . 2]" 1
154 1 8 LEU H 1 51 PHE QD . . 5.500 5.013 4.033 5.446 . 0 0 "[ . 1 . 2]" 1
155 1 8 LEU H 1 52 ILE H . . 5.500 4.810 4.197 5.475 . 0 0 "[ . 1 . 2]" 1
156 1 8 LEU HA 1 8 LEU QD . . 3.280 2.465 2.131 3.111 . 0 0 "[ . 1 . 2]" 1
157 1 8 LEU HA 1 9 ARG H . . 2.960 2.336 2.238 2.428 . 0 0 "[ . 1 . 2]" 1
158 1 8 LEU HA 1 80 ILE MG . . 3.490 3.409 3.146 3.568 0.078 6 0 "[ . 1 . 2]" 1
159 1 8 LEU HB2 1 11 LEU QD . . 3.480 2.349 2.113 3.158 . 0 0 "[ . 1 . 2]" 1
160 1 8 LEU HB2 1 50 ALA H . . 4.000 2.849 2.404 3.341 . 0 0 "[ . 1 . 2]" 1
161 1 8 LEU HB2 1 50 ALA MB . . 3.480 2.383 2.137 3.099 . 0 0 "[ . 1 . 2]" 1
162 1 8 LEU HB3 1 8 LEU QD . . 3.240 2.132 2.050 2.214 . 0 0 "[ . 1 . 2]" 1
163 1 8 LEU HB3 1 9 ARG H . . 4.090 2.559 2.383 2.757 . 0 0 "[ . 1 . 2]" 1
164 1 8 LEU HB3 1 50 ALA H . . 4.620 4.148 3.825 4.614 . 0 0 "[ . 1 . 2]" 1
165 1 8 LEU HB3 1 80 ILE MG . . 3.170 2.387 2.185 2.687 . 0 0 "[ . 1 . 2]" 1
166 1 8 LEU QD 1 9 ARG H . . 4.210 3.634 3.228 4.039 . 0 0 "[ . 1 . 2]" 1
167 1 8 LEU QD 1 11 LEU QD . . 2.400 2.341 2.098 2.461 0.061 15 0 "[ . 1 . 2]" 1
168 1 9 ARG H 1 9 ARG HB2 . . 3.560 2.862 2.348 3.269 . 0 0 "[ . 1 . 2]" 1
169 1 9 ARG H 1 9 ARG HB3 . . 3.910 3.869 3.567 3.982 0.072 5 0 "[ . 1 . 2]" 1
170 1 9 ARG H 1 9 ARG QG . . 3.790 3.080 2.653 3.528 . 0 0 "[ . 1 . 2]" 1
171 1 9 ARG H 1 10 ASN H . . 4.950 4.403 4.330 4.449 . 0 0 "[ . 1 . 2]" 1
172 1 9 ARG H 1 49 PHE HA . . 5.500 4.491 4.258 4.698 . 0 0 "[ . 1 . 2]" 1
173 1 9 ARG H 1 80 ILE HA . . 4.950 4.229 3.987 4.477 . 0 0 "[ . 1 . 2]" 1
174 1 9 ARG H 1 80 ILE MG . . 3.670 2.727 2.445 2.968 . 0 0 "[ . 1 . 2]" 1
175 1 9 ARG H 1 81 ASN H . . 3.910 2.468 2.264 2.677 . 0 0 "[ . 1 . 2]" 1
176 1 9 ARG H 1 81 ASN QB . . 4.630 3.020 2.324 3.660 . 0 0 "[ . 1 . 2]" 1
177 1 9 ARG HA 1 9 ARG QG . . 3.490 2.619 2.349 2.853 . 0 0 "[ . 1 . 2]" 1
178 1 9 ARG HA 1 10 ASN H . . 3.030 2.440 2.358 2.528 . 0 0 "[ . 1 . 2]" 1
179 1 9 ARG HA 1 10 ASN HA . . 4.460 4.508 4.486 4.530 0.070 19 0 "[ . 1 . 2]" 1
180 1 9 ARG HA 1 11 LEU H . . 4.260 3.516 3.244 3.843 . 0 0 "[ . 1 . 2]" 1
181 1 9 ARG HA 1 11 LEU QD . . 5.000 2.968 2.245 3.966 . 0 0 "[ . 1 . 2]" 1
182 1 9 ARG HA 1 49 PHE HA . . 3.350 2.402 2.092 2.748 . 0 0 "[ . 1 . 2]" 1
183 1 9 ARG HA 1 49 PHE QB . . 3.690 2.715 2.450 2.988 . 0 0 "[ . 1 . 2]" 1
184 1 9 ARG HA 1 50 ALA H . . 4.650 4.078 3.866 4.414 . 0 0 "[ . 1 . 2]" 1
185 1 9 ARG HB2 1 9 ARG HD3 . . 3.930 2.450 2.112 3.562 . 0 0 "[ . 1 . 2]" 1
186 1 9 ARG HB2 1 10 ASN H . . 3.970 3.369 2.723 3.913 . 0 0 "[ . 1 . 2]" 1
187 1 9 ARG HB2 1 11 LEU H . . 5.500 5.447 5.199 5.578 0.078 3 0 "[ . 1 . 2]" 1
188 1 9 ARG HB2 1 80 ILE MG . . 5.500 4.684 3.977 5.103 . 0 0 "[ . 1 . 2]" 1
189 1 9 ARG HB2 1 81 ASN QB . . 3.400 1.954 1.893 2.008 . 0 0 "[ . 1 . 2]" 1
190 1 9 ARG HB2 1 81 ASN QD . . 5.500 4.147 3.773 4.814 . 0 0 "[ . 1 . 2]" 1
191 1 9 ARG HB3 1 9 ARG HD3 . . 3.710 2.759 2.296 3.246 . 0 0 "[ . 1 . 2]" 1
192 1 9 ARG HB3 1 10 ASN H . . 3.570 2.374 2.092 2.670 . 0 0 "[ . 1 . 2]" 1
193 1 9 ARG HB3 1 10 ASN HA . . 5.100 4.257 3.913 4.585 . 0 0 "[ . 1 . 2]" 1
194 1 9 ARG HB3 1 10 ASN HB2 . . 4.640 3.813 2.964 4.270 . 0 0 "[ . 1 . 2]" 1
195 1 9 ARG HB3 1 10 ASN HB3 . . 4.880 4.641 4.074 4.947 0.067 15 0 "[ . 1 . 2]" 1
196 1 9 ARG HB3 1 81 ASN QB . . 3.820 3.203 2.281 3.520 . 0 0 "[ . 1 . 2]" 1
197 1 9 ARG HB3 1 81 ASN QD . . 5.500 5.127 4.510 5.317 . 0 0 "[ . 1 . 2]" 1
198 1 9 ARG HD3 1 81 ASN QB . . 3.600 2.795 2.109 4.287 0.687 13 1 "[ . 1 + . 2]" 1
199 1 9 ARG HD3 1 81 ASN QD . . 5.500 4.845 4.011 6.259 0.759 13 1 "[ . 1 + . 2]" 1
200 1 9 ARG QG 1 49 PHE QB . . 4.240 2.977 2.427 3.566 . 0 0 "[ . 1 . 2]" 1
201 1 9 ARG QG 1 49 PHE QD . . 5.500 4.601 3.725 5.368 . 0 0 "[ . 1 . 2]" 1
202 1 9 ARG QG 1 81 ASN H . . 5.490 4.657 3.710 5.163 . 0 0 "[ . 1 . 2]" 1
203 1 9 ARG QG 1 81 ASN QB . . 4.120 3.039 2.007 3.568 . 0 0 "[ . 1 . 2]" 1
204 1 10 ASN H 1 10 ASN HA . . 2.800 2.211 2.182 2.221 . 0 0 "[ . 1 . 2]" 1
205 1 10 ASN H 1 10 ASN HB2 . . 3.960 3.111 2.965 3.215 . 0 0 "[ . 1 . 2]" 1
206 1 10 ASN H 1 11 LEU H . . 3.430 2.702 2.589 2.829 . 0 0 "[ . 1 . 2]" 1
207 1 10 ASN H 1 11 LEU HA . . 5.500 5.302 5.187 5.427 . 0 0 "[ . 1 . 2]" 1
208 1 10 ASN H 1 11 LEU HB2 . . 5.500 4.883 4.653 5.178 . 0 0 "[ . 1 . 2]" 1
209 1 10 ASN H 1 48 GLY HA3 . . 4.920 4.735 4.341 4.987 0.067 2 0 "[ . 1 . 2]" 1
210 1 10 ASN H 1 49 PHE HA . . 4.800 4.110 3.699 4.540 . 0 0 "[ . 1 . 2]" 1
211 1 10 ASN H 1 49 PHE QB . . 4.440 4.166 3.842 4.360 . 0 0 "[ . 1 . 2]" 1
212 1 10 ASN H 1 80 ILE MD . . 5.500 5.174 4.640 5.583 0.083 17 0 "[ . 1 . 2]" 1
213 1 10 ASN H 1 81 ASN H . . 5.500 5.036 4.603 5.505 0.005 12 0 "[ . 1 . 2]" 1
214 1 10 ASN HA 1 10 ASN HB2 . . 3.020 2.500 2.433 2.594 . 0 0 "[ . 1 . 2]" 1
215 1 10 ASN HA 1 11 LEU H . . 3.570 2.827 2.499 3.207 . 0 0 "[ . 1 . 2]" 1
216 1 10 ASN HB2 1 10 ASN HD21 . . 3.650 3.117 2.819 3.342 . 0 0 "[ . 1 . 2]" 1
217 1 10 ASN HB2 1 11 LEU H . . 5.170 4.664 4.551 4.735 . 0 0 "[ . 1 . 2]" 1
218 1 10 ASN HB2 1 80 ILE MD . . 5.150 4.888 4.278 5.224 0.074 17 0 "[ . 1 . 2]" 1
219 1 10 ASN HB2 1 80 ILE MG . . 5.320 5.353 4.989 5.420 0.100 9 0 "[ . 1 . 2]" 1
220 1 10 ASN HB2 1 81 ASN QB . . 4.360 3.605 3.165 4.015 . 0 0 "[ . 1 . 2]" 1
221 1 10 ASN HB3 1 10 ASN HD21 . . 3.340 2.251 2.176 2.348 . 0 0 "[ . 1 . 2]" 1
222 1 10 ASN HB3 1 10 ASN HD22 . . 4.020 3.561 3.528 3.596 . 0 0 "[ . 1 . 2]" 1
223 1 10 ASN HB3 1 79 THR H . . 5.230 5.099 4.884 5.281 0.051 8 0 "[ . 1 . 2]" 1
224 1 10 ASN HB3 1 80 ILE HA . . 3.590 2.548 2.330 2.764 . 0 0 "[ . 1 . 2]" 1
225 1 10 ASN HB3 1 80 ILE MD . . 4.340 3.453 2.832 3.797 . 0 0 "[ . 1 . 2]" 1
226 1 10 ASN HB3 1 80 ILE MG . . 5.060 4.159 3.953 4.342 . 0 0 "[ . 1 . 2]" 1
227 1 10 ASN HB3 1 81 ASN H . . 4.160 3.432 2.795 3.971 . 0 0 "[ . 1 . 2]" 1
228 1 10 ASN HB3 1 81 ASN QD . . 5.500 3.864 3.475 4.620 . 0 0 "[ . 1 . 2]" 1
229 1 10 ASN HD21 1 78 LYS HB2 . . 4.670 3.021 2.585 3.251 . 0 0 "[ . 1 . 2]" 1
230 1 10 ASN HD21 1 78 LYS HD3 . . 4.950 4.957 4.571 5.044 0.094 9 0 "[ . 1 . 2]" 1
231 1 10 ASN HD21 1 78 LYS QG . . 5.500 4.900 3.685 5.180 . 0 0 "[ . 1 . 2]" 1
232 1 10 ASN HD21 1 79 THR H . . 4.600 2.954 2.725 3.128 . 0 0 "[ . 1 . 2]" 1
233 1 10 ASN HD21 1 79 THR HB . . 4.840 3.757 3.491 4.019 . 0 0 "[ . 1 . 2]" 1
234 1 10 ASN HD21 1 79 THR MG . . 5.500 4.694 4.515 4.849 . 0 0 "[ . 1 . 2]" 1
235 1 10 ASN HD21 1 80 ILE H . . 5.500 4.377 4.126 4.699 . 0 0 "[ . 1 . 2]" 1
236 1 10 ASN HD21 1 80 ILE HA . . 4.450 3.447 3.189 3.742 . 0 0 "[ . 1 . 2]" 1
237 1 10 ASN HD21 1 80 ILE MD . . 5.500 3.858 3.205 4.304 . 0 0 "[ . 1 . 2]" 1
238 1 10 ASN HD21 1 81 ASN QB . . 5.500 5.213 4.964 5.400 . 0 0 "[ . 1 . 2]" 1
239 1 10 ASN HD22 1 78 LYS HB2 . . 4.910 2.823 2.345 3.010 . 0 0 "[ . 1 . 2]" 1
240 1 10 ASN HD22 1 78 LYS HD3 . . 5.230 5.264 5.130 5.317 0.087 20 0 "[ . 1 . 2]" 1
241 1 10 ASN HD22 1 78 LYS QG . . 5.500 4.550 3.971 4.896 . 0 0 "[ . 1 . 2]" 1
242 1 10 ASN HD22 1 79 THR H . . 4.980 2.851 2.655 3.024 . 0 0 "[ . 1 . 2]" 1
243 1 10 ASN HD22 1 79 THR HA . . 4.980 5.034 4.936 5.063 0.083 16 0 "[ . 1 . 2]" 1
244 1 10 ASN HD22 1 79 THR HB . . 5.130 4.575 4.216 4.776 . 0 0 "[ . 1 . 2]" 1
245 1 10 ASN HD22 1 79 THR MG . . 5.500 5.561 5.417 5.609 0.109 17 0 "[ . 1 . 2]" 1
246 1 10 ASN HD22 1 80 ILE MD . . 5.500 4.850 4.383 5.272 . 0 0 "[ . 1 . 2]" 1
247 1 11 LEU H 1 11 LEU HB2 . . 3.460 2.418 2.272 2.598 . 0 0 "[ . 1 . 2]" 1
248 1 11 LEU H 1 11 LEU HB3 . . 3.610 3.582 3.492 3.683 0.073 19 0 "[ . 1 . 2]" 1
249 1 11 LEU H 1 11 LEU QD . . 4.270 2.445 1.728 3.416 . 0 0 "[ . 1 . 2]" 1
250 1 11 LEU H 1 11 LEU HG . . 3.480 3.185 2.250 3.576 0.096 13 0 "[ . 1 . 2]" 1
251 1 11 LEU H 1 12 ASN H . . 5.200 4.453 4.129 4.603 . 0 0 "[ . 1 . 2]" 1
252 1 11 LEU H 1 48 GLY H . . 5.500 5.163 4.909 5.569 0.069 17 0 "[ . 1 . 2]" 1
253 1 11 LEU H 1 48 GLY HA2 . . 4.090 3.192 2.888 3.578 . 0 0 "[ . 1 . 2]" 1
254 1 11 LEU H 1 48 GLY HA3 . . 4.920 3.961 3.436 4.500 . 0 0 "[ . 1 . 2]" 1
255 1 11 LEU H 1 49 PHE H . . 5.500 4.759 4.414 5.015 . 0 0 "[ . 1 . 2]" 1
256 1 11 LEU H 1 49 PHE HA . . 4.870 3.709 3.460 4.096 . 0 0 "[ . 1 . 2]" 1
257 1 11 LEU H 1 49 PHE QB . . 5.500 4.817 4.617 5.215 . 0 0 "[ . 1 . 2]" 1
258 1 11 LEU H 1 80 ILE MD . . 4.400 4.040 3.203 4.472 0.072 6 0 "[ . 1 . 2]" 1
259 1 11 LEU HA 1 11 LEU QD . . 3.180 2.255 2.086 2.423 . 0 0 "[ . 1 . 2]" 1
260 1 11 LEU HA 1 12 ASN H . . 2.960 2.222 2.118 2.314 . 0 0 "[ . 1 . 2]" 1
261 1 11 LEU HA 1 12 ASN QB . . 4.410 4.240 4.096 4.336 . 0 0 "[ . 1 . 2]" 1
262 1 11 LEU HA 1 78 LYS HD3 . . 5.430 3.972 2.624 5.503 0.073 2 0 "[ . 1 . 2]" 1
263 1 11 LEU HA 1 78 LYS QG . . 4.640 3.612 2.714 4.118 . 0 0 "[ . 1 . 2]" 1
264 1 11 LEU HA 1 80 ILE MD . . 3.180 2.647 2.261 3.057 . 0 0 "[ . 1 . 2]" 1
265 1 11 LEU HA 1 80 ILE MG . . 4.810 4.567 4.226 4.900 0.090 17 0 "[ . 1 . 2]" 1
266 1 11 LEU HB2 1 12 ASN H . . 4.530 4.263 4.019 4.501 . 0 0 "[ . 1 . 2]" 1
267 1 11 LEU HB2 1 46 ASN HD21 . . 5.250 4.248 3.345 5.120 . 0 0 "[ . 1 . 2]" 1
268 1 11 LEU HB2 1 48 GLY HA2 . . 3.780 2.283 2.082 2.566 . 0 0 "[ . 1 . 2]" 1
269 1 11 LEU HB2 1 48 GLY HA3 . . 4.220 3.839 3.629 4.065 . 0 0 "[ . 1 . 2]" 1
270 1 11 LEU HB3 1 11 LEU QD . . 3.080 2.255 2.154 2.358 . 0 0 "[ . 1 . 2]" 1
271 1 11 LEU HB3 1 12 ASN H . . 4.090 3.468 3.092 4.058 . 0 0 "[ . 1 . 2]" 1
272 1 11 LEU HB3 1 15 SER H . . 5.430 5.060 4.305 5.461 0.031 12 0 "[ . 1 . 2]" 1
273 1 11 LEU HB3 1 46 ASN HD21 . . 4.940 3.466 2.837 4.204 . 0 0 "[ . 1 . 2]" 1
274 1 11 LEU HB3 1 46 ASN HD22 . . 5.120 3.598 2.527 4.608 . 0 0 "[ . 1 . 2]" 1
275 1 11 LEU HB3 1 48 GLY H . . 5.270 4.616 4.351 4.996 . 0 0 "[ . 1 . 2]" 1
276 1 11 LEU HB3 1 48 GLY HA2 . . 3.870 3.713 3.523 3.934 0.064 6 0 "[ . 1 . 2]" 1
277 1 11 LEU HB3 1 80 ILE MD . . 4.290 4.214 3.978 4.369 0.079 17 0 "[ . 1 . 2]" 1
278 1 11 LEU QD 1 12 ASN H . . 4.170 3.791 3.539 3.992 . 0 0 "[ . 1 . 2]" 1
279 1 11 LEU QD 1 15 SER HB2 . . 5.080 3.942 2.639 4.751 . 0 0 "[ . 1 . 2]" 1
280 1 11 LEU QD 1 15 SER HB3 . . 4.390 3.904 2.602 4.546 0.156 8 0 "[ . 1 . 2]" 1
281 1 11 LEU QD 1 46 ASN HD21 . . 5.230 4.386 3.766 4.800 . 0 0 "[ . 1 . 2]" 1
282 1 11 LEU QD 1 48 GLY H . . 5.170 4.361 3.369 4.911 . 0 0 "[ . 1 . 2]" 1
283 1 11 LEU QD 1 49 PHE H . . 4.130 3.532 2.740 4.079 . 0 0 "[ . 1 . 2]" 1
284 1 11 LEU QD 1 49 PHE HA . . 3.840 2.202 1.952 2.962 . 0 0 "[ . 1 . 2]" 1
285 1 11 LEU QD 1 49 PHE QB . . 5.000 3.609 3.375 4.114 . 0 0 "[ . 1 . 2]" 1
286 1 11 LEU QD 1 50 ALA H . . 4.070 2.956 2.712 3.266 . 0 0 "[ . 1 . 2]" 1
287 1 11 LEU QD 1 50 ALA MB . . 3.070 2.339 1.956 2.784 . 0 0 "[ . 1 . 2]" 1
288 1 11 LEU QD 1 80 ILE HA . . 4.850 3.821 3.474 4.297 . 0 0 "[ . 1 . 2]" 1
289 1 11 LEU QD 1 80 ILE MD . . 2.400 1.969 1.906 2.032 . 0 0 "[ . 1 . 2]" 1
290 1 11 LEU QD 1 80 ILE MG . . 2.940 2.504 2.123 2.958 0.018 15 0 "[ . 1 . 2]" 1
291 1 11 LEU HG 1 49 PHE HA . . 4.130 3.162 2.570 3.772 . 0 0 "[ . 1 . 2]" 1
292 1 11 LEU HG 1 50 ALA H . . 4.970 4.240 3.735 4.740 . 0 0 "[ . 1 . 2]" 1
293 1 11 LEU HG 1 80 ILE MD . . 4.320 4.026 3.069 4.413 0.093 12 0 "[ . 1 . 2]" 1
294 1 12 ASN H 1 12 ASN QB . . 3.490 2.222 2.087 2.559 . 0 0 "[ . 1 . 2]" 1
295 1 12 ASN H 1 12 ASN HD21 . . 5.290 4.752 3.071 4.968 . 0 0 "[ . 1 . 2]" 1
296 1 12 ASN H 1 12 ASN HD22 . . 5.500 5.338 3.668 5.574 0.074 8 0 "[ . 1 . 2]" 1
297 1 12 ASN H 1 15 SER H . . 5.000 4.344 3.843 5.012 0.012 13 0 "[ . 1 . 2]" 1
298 1 12 ASN H 1 46 ASN HD22 . . 5.500 4.932 4.029 5.621 0.121 15 0 "[ . 1 . 2]" 1
299 1 12 ASN H 1 76 ASP HB3 . . 5.500 4.426 4.081 4.804 . 0 0 "[ . 1 . 2]" 1
300 1 12 ASN H 1 78 LYS HB2 . . 5.050 3.926 3.364 4.349 . 0 0 "[ . 1 . 2]" 1
301 1 12 ASN H 1 78 LYS HB3 . . 5.060 4.280 3.819 4.786 . 0 0 "[ . 1 . 2]" 1
302 1 12 ASN H 1 78 LYS QG . . 4.360 2.271 1.857 2.602 . 0 0 "[ . 1 . 2]" 1
303 1 12 ASN H 1 80 ILE MD . . 4.610 3.764 3.417 4.372 . 0 0 "[ . 1 . 2]" 1
304 1 12 ASN HA 1 12 ASN HD22 . . 5.500 4.579 4.324 5.407 . 0 0 "[ . 1 . 2]" 1
305 1 12 ASN HA 1 13 PRO HD2 . . 3.060 2.446 2.244 2.763 . 0 0 "[ . 1 . 2]" 1
306 1 12 ASN HA 1 13 PRO HD3 . . 2.970 2.430 2.288 2.588 . 0 0 "[ . 1 . 2]" 1
307 1 12 ASN HA 1 13 PRO HG2 . . 4.650 4.568 4.413 4.721 0.071 5 0 "[ . 1 . 2]" 1
308 1 12 ASN HA 1 13 PRO HG3 . . 4.510 4.577 4.543 4.590 0.080 3 0 "[ . 1 . 2]" 1
309 1 12 ASN HA 1 78 LYS QG . . 3.630 3.463 3.200 3.624 . 0 0 "[ . 1 . 2]" 1
310 1 12 ASN QB 1 14 HIS H . . 4.320 2.562 2.134 2.974 . 0 0 "[ . 1 . 2]" 1
311 1 12 ASN QB 1 15 SER H . . 4.280 3.123 2.605 3.782 . 0 0 "[ . 1 . 2]" 1
312 1 12 ASN QB 1 76 ASP HB2 . . 4.160 3.510 2.967 3.959 . 0 0 "[ . 1 . 2]" 1
313 1 12 ASN QB 1 76 ASP HB3 . . 4.350 2.646 2.233 3.089 . 0 0 "[ . 1 . 2]" 1
314 1 12 ASN QB 1 78 LYS QG . . 3.670 2.121 1.921 2.249 . 0 0 "[ . 1 . 2]" 1
315 1 12 ASN HD21 1 14 HIS H . . 5.500 4.268 2.988 4.909 . 0 0 "[ . 1 . 2]" 1
316 1 12 ASN HD21 1 15 SER H . . 5.320 5.138 3.458 5.407 0.087 9 0 "[ . 1 . 2]" 1
317 1 12 ASN HD21 1 76 ASP HA . . 5.500 4.608 4.277 5.186 . 0 0 "[ . 1 . 2]" 1
318 1 12 ASN HD21 1 76 ASP HB2 . . 4.440 3.666 1.952 3.948 . 0 0 "[ . 1 . 2]" 1
319 1 12 ASN HD21 1 76 ASP HB3 . . 4.000 2.485 1.882 2.769 . 0 0 "[ . 1 . 2]" 1
320 1 12 ASN HD21 1 78 LYS H . . 5.500 5.282 4.430 5.996 0.496 17 0 "[ . 1 . 2]" 1
321 1 12 ASN HD21 1 78 LYS HD2 . . 5.500 4.933 2.403 5.582 0.082 4 0 "[ . 1 . 2]" 1
322 1 12 ASN HD21 1 78 LYS QG . . 4.950 3.228 1.984 4.033 . 0 0 "[ . 1 . 2]" 1
323 1 12 ASN HD22 1 14 HIS H . . 5.500 5.267 4.125 5.579 0.079 15 0 "[ . 1 . 2]" 1
324 1 12 ASN HD22 1 76 ASP HA . . 5.500 5.350 4.447 5.580 0.080 1 0 "[ . 1 . 2]" 1
325 1 12 ASN HD22 1 76 ASP HB2 . . 5.130 4.837 1.953 5.210 0.080 2 0 "[ . 1 . 2]" 1
326 1 12 ASN HD22 1 76 ASP HB3 . . 4.150 3.484 2.439 3.700 . 0 0 "[ . 1 . 2]" 1
327 1 12 ASN HD22 1 78 LYS QG . . 5.490 3.418 2.923 4.258 . 0 0 "[ . 1 . 2]" 1
328 1 13 PRO HA 1 45 LEU HB3 . . 4.700 2.914 2.620 3.235 . 0 0 "[ . 1 . 2]" 1
329 1 13 PRO HA 1 46 ASN QB . . 4.010 3.656 3.098 3.983 . 0 0 "[ . 1 . 2]" 1
330 1 13 PRO HA 1 46 ASN HD21 . . 3.860 3.168 2.728 3.774 . 0 0 "[ . 1 . 2]" 1
331 1 13 PRO HA 1 46 ASN HD22 . . 4.480 3.395 2.418 4.414 . 0 0 "[ . 1 . 2]" 1
332 1 13 PRO HB2 1 14 HIS H . . 4.080 3.385 2.802 3.789 . 0 0 "[ . 1 . 2]" 1
333 1 13 PRO HB2 1 14 HIS HD2 . . 5.020 3.866 2.487 4.897 . 0 0 "[ . 1 . 2]" 1
334 1 13 PRO HB2 1 45 LEU MD1 . . 4.030 2.285 2.014 3.001 . 0 0 "[ . 1 . 2]" 1
335 1 13 PRO HB2 1 45 LEU MD2 . . 4.180 2.099 2.007 2.272 . 0 0 "[ . 1 . 2]" 1
336 1 13 PRO HB3 1 14 HIS H . . 4.650 4.215 4.005 4.450 . 0 0 "[ . 1 . 2]" 1
337 1 13 PRO HB3 1 45 LEU HB2 . . 4.580 3.924 3.415 4.561 . 0 0 "[ . 1 . 2]" 1
338 1 13 PRO HB3 1 45 LEU HB3 . . 3.460 2.777 2.418 3.319 . 0 0 "[ . 1 . 2]" 1
339 1 13 PRO HB3 1 45 LEU MD1 . . 3.880 2.515 2.157 3.163 . 0 0 "[ . 1 . 2]" 1
340 1 13 PRO HB3 1 45 LEU MD2 . . 4.180 3.428 2.824 3.869 . 0 0 "[ . 1 . 2]" 1
341 1 13 PRO HB3 1 45 LEU HG . . 5.280 5.007 4.763 5.351 0.071 4 0 "[ . 1 . 2]" 1
342 1 13 PRO HB3 1 46 ASN H . . 4.650 4.099 3.140 4.712 0.062 18 0 "[ . 1 . 2]" 1
343 1 13 PRO HB3 1 46 ASN HD21 . . 5.500 5.416 4.969 6.000 0.500 13 0 "[ . 1 . 2]" 1
344 1 13 PRO HD2 1 14 HIS H . . 4.030 2.867 2.268 3.394 . 0 0 "[ . 1 . 2]" 1
345 1 13 PRO HD2 1 14 HIS HD2 . . 5.050 4.751 3.824 5.125 0.075 5 0 "[ . 1 . 2]" 1
346 1 13 PRO HG2 1 14 HIS H . . 4.290 2.498 2.210 2.875 . 0 0 "[ . 1 . 2]" 1
347 1 13 PRO HG2 1 14 HIS HD2 . . 4.750 3.046 2.220 3.660 . 0 0 "[ . 1 . 2]" 1
348 1 13 PRO HG2 1 15 SER H . . 5.500 5.083 4.905 5.502 0.002 8 0 "[ . 1 . 2]" 1
349 1 14 HIS H 1 14 HIS HB2 . . 3.660 2.325 2.057 2.744 . 0 0 "[ . 1 . 2]" 1
350 1 14 HIS H 1 14 HIS HB3 . . 3.300 3.500 3.081 3.614 0.314 20 0 "[ . 1 . 2]" 1
351 1 14 HIS H 1 14 HIS HD2 . . 4.380 3.149 2.415 3.988 . 0 0 "[ . 1 . 2]" 1
352 1 14 HIS H 1 15 SER H . . 3.240 2.771 2.376 3.058 . 0 0 "[ . 1 . 2]" 1
353 1 14 HIS H 1 45 LEU HB3 . . 5.500 5.320 4.571 5.577 0.077 12 0 "[ . 1 . 2]" 1
354 1 14 HIS H 1 45 LEU MD2 . . 5.110 4.097 3.398 4.673 . 0 0 "[ . 1 . 2]" 1
355 1 14 HIS HA 1 14 HIS HD2 . . 5.070 3.222 2.294 4.524 . 0 0 "[ . 1 . 2]" 1
356 1 14 HIS HA 1 45 LEU MD2 . . 3.710 3.483 2.518 3.804 0.094 13 0 "[ . 1 . 2]" 1
357 1 14 HIS HB2 1 15 SER H . . 4.760 3.524 2.668 4.008 . 0 0 "[ . 1 . 2]" 1
358 1 14 HIS HB3 1 15 SER H . . 4.290 4.037 3.408 4.441 0.151 20 0 "[ . 1 . 2]" 1
359 1 14 HIS HD2 1 45 LEU MD1 . . 5.350 4.922 3.816 5.452 0.102 3 0 "[ . 1 . 2]" 1
360 1 14 HIS HD2 1 45 LEU MD2 . . 4.600 3.608 2.107 4.695 0.095 19 0 "[ . 1 . 2]" 1
361 1 15 SER H 1 15 SER HB2 . . 3.240 2.510 2.110 3.599 0.359 8 0 "[ . 1 . 2]" 1
362 1 15 SER H 1 15 SER HB3 . . 3.530 3.295 2.392 3.604 0.074 7 0 "[ . 1 . 2]" 1
363 1 15 SER H 1 16 THR HA . . 5.500 5.243 4.541 5.582 0.082 3 0 "[ . 1 . 2]" 1
364 1 15 SER H 1 46 ASN HD21 . . 4.350 3.373 2.911 3.893 . 0 0 "[ . 1 . 2]" 1
365 1 15 SER H 1 46 ASN HD22 . . 4.060 3.122 2.718 3.886 . 0 0 "[ . 1 . 2]" 1
366 1 15 SER HB2 1 16 THR H . . 4.150 3.642 2.233 4.221 0.071 13 0 "[ . 1 . 2]" 1
367 1 15 SER HB2 1 20 ILE HG13 . . 5.420 4.314 2.294 5.458 0.038 11 0 "[ . 1 . 2]" 1
368 1 15 SER HB2 1 46 ASN HD21 . . 4.300 3.518 2.561 4.664 0.364 3 0 "[ . 1 . 2]" 1
369 1 15 SER HB2 1 46 ASN HD22 . . 4.380 3.341 2.416 4.439 0.059 20 0 "[ . 1 . 2]" 1
370 1 15 SER HB3 1 16 THR H . . 3.650 2.815 2.325 3.670 0.020 8 0 "[ . 1 . 2]" 1
371 1 15 SER HB3 1 20 ILE MD . . 4.280 2.430 2.032 3.430 . 0 0 "[ . 1 . 2]" 1
372 1 15 SER HB3 1 20 ILE HG13 . . 4.430 3.292 2.128 4.490 0.060 14 0 "[ . 1 . 2]" 1
373 1 15 SER HB3 1 46 ASN HD21 . . 4.840 4.191 2.691 5.096 0.256 15 0 "[ . 1 . 2]" 1
374 1 15 SER HB3 1 46 ASN HD22 . . 5.020 3.988 2.506 5.062 0.042 7 0 "[ . 1 . 2]" 1
375 1 16 THR H 1 16 THR MG . . 3.370 2.705 2.185 3.479 0.109 6 0 "[ . 1 . 2]" 1
376 1 16 THR H 1 17 MET H . . 5.490 3.547 1.866 4.670 . 0 0 "[ . 1 . 2]" 1
377 1 16 THR H 1 19 SER HB2 . . 5.010 3.571 2.348 5.600 0.590 13 1 "[ . 1 + . 2]" 1
378 1 16 THR H 1 20 ILE HG13 . . 5.440 3.885 2.760 5.336 . 0 0 "[ . 1 . 2]" 1
379 1 16 THR H 1 37 VAL QG . . 5.120 4.717 4.277 4.903 . 0 0 "[ . 1 . 2]" 1
380 1 16 THR H 1 46 ASN HD21 . . 5.500 5.047 3.670 6.010 0.510 15 1 "[ . 1 + 2]" 1
381 1 16 THR HA 1 16 THR MG . . 3.290 2.950 2.158 3.305 0.015 16 0 "[ . 1 . 2]" 1
382 1 16 THR HA 1 17 MET H . . 3.500 3.052 2.404 3.577 0.077 7 0 "[ . 1 . 2]" 1
383 1 16 THR HA 1 17 MET HA . . 4.820 4.584 4.260 4.812 . 0 0 "[ . 1 . 2]" 1
384 1 16 THR HA 1 37 VAL QG . . 4.590 3.110 2.510 3.527 . 0 0 "[ . 1 . 2]" 1
385 1 16 THR HB 1 37 VAL QG . . 5.300 4.565 3.008 5.110 . 0 0 "[ . 1 . 2]" 1
386 1 16 THR MG 1 17 MET H . . 4.380 2.808 1.749 4.062 . 0 0 "[ . 1 . 2]" 1
387 1 16 THR MG 1 18 ASP H . . 4.820 3.288 2.432 4.910 0.090 8 0 "[ . 1 . 2]" 1
388 1 16 THR MG 1 18 ASP HB2 . . 5.500 4.157 2.777 5.596 0.096 8 0 "[ . 1 . 2]" 1
389 1 16 THR MG 1 19 SER H . . 5.130 3.193 1.724 5.110 . 0 0 "[ . 1 . 2]" 1
390 1 16 THR MG 1 37 VAL QG . . 5.500 4.416 2.233 5.104 . 0 0 "[ . 1 . 2]" 1
391 1 17 MET H 1 17 MET QB . . 3.570 2.606 2.117 3.291 . 0 0 "[ . 1 . 2]" 1
392 1 17 MET H 1 17 MET QG . . 4.700 3.237 1.928 4.211 . 0 0 "[ . 1 . 2]" 1
393 1 17 MET H 1 18 ASP H . . 3.880 2.301 1.713 2.723 . 0 0 "[ . 1 . 2]" 1
394 1 17 MET H 1 19 SER H . . 5.370 3.376 2.612 4.275 . 0 0 "[ . 1 . 2]" 1
395 1 17 MET H 1 20 ILE MD . . 5.500 4.104 3.131 5.309 . 0 0 "[ . 1 . 2]" 1
396 1 17 MET H 1 21 LEU H . . 5.500 5.482 5.096 5.604 0.104 1 0 "[ . 1 . 2]" 1
397 1 17 MET H 1 37 VAL QG . . 5.410 3.621 1.964 4.729 . 0 0 "[ . 1 . 2]" 1
398 1 17 MET HA 1 17 MET QG . . 3.870 2.869 2.218 3.407 . 0 0 "[ . 1 . 2]" 1
399 1 17 MET HA 1 18 ASP HA . . 4.920 4.797 4.696 4.968 0.048 2 0 "[ . 1 . 2]" 1
400 1 17 MET HA 1 20 ILE HB . . 3.260 3.011 2.364 3.340 0.080 11 0 "[ . 1 . 2]" 1
401 1 17 MET HA 1 20 ILE MD . . 3.700 2.621 2.069 3.528 . 0 0 "[ . 1 . 2]" 1
402 1 17 MET HA 1 21 LEU H . . 4.420 3.892 3.182 4.398 . 0 0 "[ . 1 . 2]" 1
403 1 17 MET HA 1 37 VAL QG . . 3.570 2.979 2.162 3.539 . 0 0 "[ . 1 . 2]" 1
404 1 17 MET QB 1 18 ASP H . . 3.900 2.746 1.996 3.547 . 0 0 "[ . 1 . 2]" 1
405 1 17 MET QB 1 19 SER H . . 5.500 4.691 4.296 4.969 . 0 0 "[ . 1 . 2]" 1
406 1 17 MET QB 1 20 ILE MD . . 5.340 4.138 3.405 4.890 . 0 0 "[ . 1 . 2]" 1
407 1 17 MET QB 1 21 LEU QD . . 4.530 3.175 2.064 3.994 . 0 0 "[ . 1 . 2]" 1
408 1 17 MET QB 1 37 VAL QG . . 3.490 2.280 1.947 3.078 . 0 0 "[ . 1 . 2]" 1
409 1 17 MET QG 1 18 ASP H . . 4.480 2.715 1.840 3.707 . 0 0 "[ . 1 . 2]" 1
410 1 17 MET QG 1 18 ASP HA . . 4.920 3.356 3.010 3.785 . 0 0 "[ . 1 . 2]" 1
411 1 17 MET QG 1 21 LEU H . . 5.400 4.336 3.511 4.988 . 0 0 "[ . 1 . 2]" 1
412 1 17 MET QG 1 21 LEU QD . . 3.690 2.298 1.889 2.701 . 0 0 "[ . 1 . 2]" 1
413 1 17 MET QG 1 21 LEU HG . . 4.220 3.598 2.328 4.205 . 0 0 "[ . 1 . 2]" 1
414 1 17 MET QG 1 35 VAL MG1 . . 5.320 3.360 2.027 4.670 . 0 0 "[ . 1 . 2]" 1
415 1 18 ASP H 1 18 ASP HB2 . . 3.150 2.241 2.022 2.484 . 0 0 "[ . 1 . 2]" 1
416 1 18 ASP H 1 18 ASP HB3 . . 3.290 2.765 2.254 3.371 0.081 7 0 "[ . 1 . 2]" 1
417 1 18 ASP H 1 21 LEU HB2 . . 5.500 4.881 4.120 5.374 . 0 0 "[ . 1 . 2]" 1
418 1 18 ASP HA 1 21 LEU H . . 3.940 3.476 2.925 4.005 0.065 15 0 "[ . 1 . 2]" 1
419 1 18 ASP HA 1 21 LEU HB2 . . 3.350 2.678 2.110 4.188 0.838 19 1 "[ . 1 . +2]" 1
420 1 18 ASP HA 1 21 LEU QD . . 3.890 2.840 2.041 3.839 . 0 0 "[ . 1 . 2]" 1
421 1 18 ASP HA 1 21 LEU HG . . 4.790 4.117 3.340 4.828 0.038 12 0 "[ . 1 . 2]" 1
422 1 18 ASP HB3 1 19 SER H . . 3.520 3.024 2.502 3.590 0.070 7 0 "[ . 1 . 2]" 1
423 1 19 SER H 1 19 SER HB2 . . 3.550 2.702 2.150 3.621 0.071 14 0 "[ . 1 . 2]" 1
424 1 19 SER H 1 20 ILE HA . . 5.500 5.221 4.809 5.521 0.021 13 0 "[ . 1 . 2]" 1
425 1 19 SER HA 1 75 ILE MG . . 5.410 4.170 3.264 4.911 . 0 0 "[ . 1 . 2]" 1
426 1 19 SER HB2 1 20 ILE H . . 4.060 3.351 2.218 4.496 0.436 7 0 "[ . 1 . 2]" 1
427 1 19 SER HB2 1 20 ILE HA . . 5.390 4.870 3.799 6.070 0.680 7 2 "[ -. + 1 . 2]" 1
428 1 20 ILE H 1 20 ILE HB . . 3.200 2.570 2.394 2.905 . 0 0 "[ . 1 . 2]" 1
429 1 20 ILE H 1 20 ILE MD . . 3.950 3.342 2.226 4.056 0.106 20 0 "[ . 1 . 2]" 1
430 1 20 ILE H 1 20 ILE HG12 . . 4.370 3.769 3.008 4.272 . 0 0 "[ . 1 . 2]" 1
431 1 20 ILE H 1 20 ILE HG13 . . 3.370 2.509 1.952 3.083 . 0 0 "[ . 1 . 2]" 1
432 1 20 ILE H 1 20 ILE MG . . 4.110 3.824 3.722 3.995 . 0 0 "[ . 1 . 2]" 1
433 1 20 ILE H 1 21 LEU H . . 3.380 2.362 1.822 2.837 . 0 0 "[ . 1 . 2]" 1
434 1 20 ILE H 1 22 GLY H . . 4.210 3.882 3.209 4.284 0.074 3 0 "[ . 1 . 2]" 1
435 1 20 ILE H 1 23 ALA H . . 5.120 5.031 4.618 5.192 0.072 10 0 "[ . 1 . 2]" 1
436 1 20 ILE HA 1 20 ILE MD . . 3.840 3.878 3.638 3.934 0.094 17 0 "[ . 1 . 2]" 1
437 1 20 ILE HA 1 20 ILE HG12 . . 3.830 2.830 2.525 3.405 . 0 0 "[ . 1 . 2]" 1
438 1 20 ILE HA 1 20 ILE HG13 . . 3.660 2.924 2.452 3.255 . 0 0 "[ . 1 . 2]" 1
439 1 20 ILE HA 1 20 ILE MG . . 3.230 2.436 2.273 2.631 . 0 0 "[ . 1 . 2]" 1
440 1 20 ILE HA 1 22 GLY H . . 5.500 4.152 3.747 4.498 . 0 0 "[ . 1 . 2]" 1
441 1 20 ILE HA 1 23 ALA H . . 4.250 3.593 2.888 4.050 . 0 0 "[ . 1 . 2]" 1
442 1 20 ILE HA 1 23 ALA MB . . 3.600 3.119 2.254 3.695 0.095 1 0 "[ . 1 . 2]" 1
443 1 20 ILE HA 1 24 LEU H . . 5.040 3.677 2.898 4.799 . 0 0 "[ . 1 . 2]" 1
444 1 20 ILE HA 1 75 ILE MD . . 3.550 2.648 2.138 3.445 . 0 0 "[ . 1 . 2]" 1
445 1 20 ILE HA 1 75 ILE MG . . 3.500 3.434 3.044 3.588 0.088 20 0 "[ . 1 . 2]" 1
446 1 20 ILE HB 1 21 LEU H . . 3.400 2.639 2.360 3.053 . 0 0 "[ . 1 . 2]" 1
447 1 20 ILE MD 1 21 LEU H . . 4.920 4.291 3.688 4.923 0.003 3 0 "[ . 1 . 2]" 1
448 1 20 ILE HG12 1 75 ILE MD . . 2.400 2.415 2.170 2.497 0.097 11 0 "[ . 1 . 2]" 1
449 1 20 ILE MG 1 21 LEU H . . 3.720 3.570 3.363 3.793 0.073 3 0 "[ . 1 . 2]" 1
450 1 20 ILE MG 1 21 LEU HA . . 4.080 3.612 3.334 3.962 . 0 0 "[ . 1 . 2]" 1
451 1 20 ILE MG 1 75 ILE MD . . 2.400 2.253 1.962 2.487 0.087 14 0 "[ . 1 . 2]" 1
452 1 21 LEU H 1 21 LEU HB2 . . 3.380 2.336 2.062 2.469 . 0 0 "[ . 1 . 2]" 1
453 1 21 LEU H 1 21 LEU HB3 . . 3.680 3.495 2.545 3.631 . 0 0 "[ . 1 . 2]" 1
454 1 21 LEU H 1 21 LEU QD . . 4.160 3.098 2.215 3.630 . 0 0 "[ . 1 . 2]" 1
455 1 21 LEU H 1 22 GLY H . . 3.560 2.871 2.661 3.111 . 0 0 "[ . 1 . 2]" 1
456 1 21 LEU H 1 23 ALA H . . 4.990 4.338 4.070 4.639 . 0 0 "[ . 1 . 2]" 1
457 1 21 LEU H 1 24 LEU H . . 5.500 4.906 4.721 5.099 . 0 0 "[ . 1 . 2]" 1
458 1 21 LEU HA 1 21 LEU QD . . 2.880 2.126 2.006 2.295 . 0 0 "[ . 1 . 2]" 1
459 1 21 LEU HA 1 21 LEU HG . . 3.990 3.069 2.583 3.742 . 0 0 "[ . 1 . 2]" 1
460 1 21 LEU HA 1 24 LEU H . . 3.980 3.835 3.312 4.074 0.094 12 0 "[ . 1 . 2]" 1
461 1 21 LEU HA 1 24 LEU HB3 . . 4.180 3.912 2.693 4.259 0.079 11 0 "[ . 1 . 2]" 1
462 1 21 LEU HB2 1 22 GLY H . . 3.570 3.160 2.650 3.998 0.428 19 0 "[ . 1 . 2]" 1
463 1 21 LEU HB2 1 22 GLY QA . . 4.680 4.374 3.947 5.237 0.557 19 1 "[ . 1 . +2]" 1
464 1 21 LEU HB3 1 21 LEU QD . . 3.140 2.192 2.093 2.375 . 0 0 "[ . 1 . 2]" 1
465 1 21 LEU HB3 1 22 GLY H . . 3.920 3.619 2.989 3.995 0.075 6 0 "[ . 1 . 2]" 1
466 1 21 LEU QD 1 22 GLY H . . 4.890 4.287 4.081 4.535 . 0 0 "[ . 1 . 2]" 1
467 1 21 LEU QD 1 30 LEU H . . 4.350 2.854 2.172 3.988 . 0 0 "[ . 1 . 2]" 1
468 1 21 LEU QD 1 30 LEU HB2 . . 2.760 2.072 1.954 2.186 . 0 0 "[ . 1 . 2]" 1
469 1 21 LEU QD 1 30 LEU QD . . 2.400 2.407 2.032 2.494 0.094 14 0 "[ . 1 . 2]" 1
470 1 21 LEU QD 1 32 SER H . . 4.750 3.018 2.199 4.237 . 0 0 "[ . 1 . 2]" 1
471 1 21 LEU QD 1 32 SER HA . . 3.340 2.284 2.073 2.678 . 0 0 "[ . 1 . 2]" 1
472 1 21 LEU QD 1 32 SER HB3 . . 4.210 3.548 2.508 4.670 0.460 8 0 "[ . 1 . 2]" 1
473 1 21 LEU QD 1 33 SER H . . 5.500 4.851 4.486 5.284 . 0 0 "[ . 1 . 2]" 1
474 1 22 GLY H 1 23 ALA H . . 3.480 2.600 2.099 3.078 . 0 0 "[ . 1 . 2]" 1
475 1 22 GLY H 1 23 ALA MB . . 5.260 4.088 3.703 4.527 . 0 0 "[ . 1 . 2]" 1
476 1 22 GLY H 1 24 LEU H . . 5.210 4.122 3.776 4.466 . 0 0 "[ . 1 . 2]" 1
477 1 22 GLY QA 1 23 ALA H . . 3.410 2.927 2.706 2.999 . 0 0 "[ . 1 . 2]" 1
478 1 22 GLY QA 1 23 ALA HA . . 4.290 4.088 3.972 4.133 . 0 0 "[ . 1 . 2]" 1
479 1 22 GLY QA 1 23 ALA MB . . 4.580 3.878 3.654 4.224 . 0 0 "[ . 1 . 2]" 1
480 1 22 GLY QA 1 25 ALA H . . 4.830 4.749 4.135 4.910 0.080 10 0 "[ . 1 . 2]" 1
481 1 22 GLY QA 1 25 ALA MB . . 3.760 3.541 2.592 3.876 0.116 8 0 "[ . 1 . 2]" 1
482 1 23 ALA H 1 23 ALA MB . . 2.910 2.454 2.188 2.661 . 0 0 "[ . 1 . 2]" 1
483 1 23 ALA H 1 24 LEU HA . . 5.250 4.730 4.482 5.168 . 0 0 "[ . 1 . 2]" 1
484 1 23 ALA H 1 24 LEU HB3 . . 4.600 4.426 4.130 4.678 0.078 3 0 "[ . 1 . 2]" 1
485 1 23 ALA MB 1 24 LEU H . . 3.530 2.918 2.120 3.458 . 0 0 "[ . 1 . 2]" 1
486 1 23 ALA MB 1 24 LEU HA . . 4.140 4.105 3.726 4.257 0.117 8 0 "[ . 1 . 2]" 1
487 1 23 ALA MB 1 73 LEU QD . . 3.770 2.722 2.143 3.806 0.036 13 0 "[ . 1 . 2]" 1
488 1 23 ALA MB 1 75 ILE MD . . 3.180 3.252 2.942 3.308 0.128 10 0 "[ . 1 . 2]" 1
489 1 23 ALA MB 1 75 ILE HG12 . . 3.110 2.065 1.990 2.176 . 0 0 "[ . 1 . 2]" 1
490 1 23 ALA MB 1 75 ILE HG13 . . 3.010 2.641 2.159 3.078 0.068 6 0 "[ . 1 . 2]" 1
491 1 23 ALA MB 1 75 ILE MG . . 3.100 2.236 1.966 2.818 . 0 0 "[ . 1 . 2]" 1
492 1 24 LEU H 1 24 LEU HB2 . . 3.810 2.607 2.263 2.975 . 0 0 "[ . 1 . 2]" 1
493 1 24 LEU H 1 24 LEU HB3 . . 3.070 2.709 2.430 2.956 . 0 0 "[ . 1 . 2]" 1
494 1 24 LEU H 1 24 LEU MD2 . . 4.690 4.394 4.175 4.623 . 0 0 "[ . 1 . 2]" 1
495 1 24 LEU H 1 26 PRO HD2 . . 5.500 5.382 4.993 5.567 0.067 19 0 "[ . 1 . 2]" 1
496 1 24 LEU H 1 73 LEU QD . . 5.500 4.913 4.329 5.441 . 0 0 "[ . 1 . 2]" 1
497 1 24 LEU H 1 75 ILE MD . . 4.070 4.041 3.724 4.179 0.109 20 0 "[ . 1 . 2]" 1
498 1 24 LEU HA 1 24 LEU MD1 . . 3.010 2.633 2.125 3.803 0.793 6 5 "[ * .+ 1- * *]" 1
499 1 24 LEU HA 1 24 LEU MD2 . . 4.570 3.488 2.065 3.922 . 0 0 "[ . 1 . 2]" 1
500 1 24 LEU HA 1 24 LEU HG . . 3.560 2.689 2.313 3.420 . 0 0 "[ . 1 . 2]" 1
501 1 24 LEU HA 1 25 ALA MB . . 4.740 4.628 4.456 4.781 0.041 7 0 "[ . 1 . 2]" 1
502 1 24 LEU HA 1 26 PRO HD2 . . 4.140 3.569 2.892 4.066 . 0 0 "[ . 1 . 2]" 1
503 1 24 LEU HA 1 73 LEU QD . . 5.430 3.925 3.144 4.800 . 0 0 "[ . 1 . 2]" 1
504 1 24 LEU HB2 1 24 LEU MD1 . . 3.220 2.335 2.194 3.003 . 0 0 "[ . 1 . 2]" 1
505 1 24 LEU HB2 1 24 LEU MD2 . . 3.240 2.731 2.367 3.273 0.033 15 0 "[ . 1 . 2]" 1
506 1 24 LEU HB2 1 75 ILE MD . . 3.360 2.398 2.148 2.909 . 0 0 "[ . 1 . 2]" 1
507 1 24 LEU HB3 1 24 LEU MD2 . . 3.490 2.367 2.209 3.197 . 0 0 "[ . 1 . 2]" 1
508 1 24 LEU HB3 1 25 ALA H . . 4.300 4.150 3.948 4.359 0.059 20 0 "[ . 1 . 2]" 1
509 1 24 LEU HB3 1 25 ALA MB . . 5.110 4.276 3.711 4.641 . 0 0 "[ . 1 . 2]" 1
510 1 24 LEU MD1 1 25 ALA H . . 5.320 5.055 4.445 5.759 0.439 2 0 "[ . 1 . 2]" 1
511 1 24 LEU MD1 1 26 PRO HD2 . . 5.500 4.782 3.670 5.798 0.298 20 0 "[ . 1 . 2]" 1
512 1 24 LEU MD1 1 73 LEU H . . 4.410 2.919 2.160 4.702 0.292 20 0 "[ . 1 . 2]" 1
513 1 24 LEU MD1 1 73 LEU HB3 . . 4.930 3.247 2.093 5.185 0.255 11 0 "[ . 1 . 2]" 1
514 1 25 ALA H 1 25 ALA MB . . 2.870 2.430 2.260 2.629 . 0 0 "[ . 1 . 2]" 1
515 1 25 ALA H 1 26 PRO HD2 . . 3.930 3.413 3.092 3.637 . 0 0 "[ . 1 . 2]" 1
516 1 25 ALA H 1 26 PRO HD3 . . 3.660 2.677 2.473 2.868 . 0 0 "[ . 1 . 2]" 1
517 1 25 ALA H 1 27 TYR H . . 5.500 5.252 4.968 5.543 0.043 18 0 "[ . 1 . 2]" 1
518 1 25 ALA HA 1 27 TYR H . . 4.100 3.316 2.917 3.875 . 0 0 "[ . 1 . 2]" 1
519 1 25 ALA HA 1 28 ALA H . . 3.910 3.287 2.519 3.987 0.077 3 0 "[ . 1 . 2]" 1
520 1 25 ALA HA 1 29 VAL HA . . 3.860 3.815 3.575 3.936 0.076 18 0 "[ . 1 . 2]" 1
521 1 25 ALA HA 1 30 LEU H . . 5.210 5.012 3.764 5.288 0.078 17 0 "[ . 1 . 2]" 1
522 1 25 ALA HA 1 30 LEU QD . . 5.480 4.858 4.042 5.318 . 0 0 "[ . 1 . 2]" 1
523 1 25 ALA MB 1 26 PRO HA . . 4.350 4.414 4.382 4.437 0.087 11 0 "[ . 1 . 2]" 1
524 1 25 ALA MB 1 26 PRO HD2 . . 3.930 4.028 3.999 4.043 0.113 16 0 "[ . 1 . 2]" 1
525 1 25 ALA MB 1 27 TYR H . . 4.960 4.335 3.952 4.879 . 0 0 "[ . 1 . 2]" 1
526 1 25 ALA MB 1 30 LEU H . . 5.300 3.587 2.802 4.564 . 0 0 "[ . 1 . 2]" 1
527 1 26 PRO HB2 1 27 TYR H . . 4.310 3.599 3.017 3.918 . 0 0 "[ . 1 . 2]" 1
528 1 26 PRO HB2 1 27 TYR QD . . 4.690 3.541 3.152 3.891 . 0 0 "[ . 1 . 2]" 1
529 1 26 PRO HB2 1 27 TYR QE . . 4.670 3.218 2.509 3.908 . 0 0 "[ . 1 . 2]" 1
530 1 26 PRO HB3 1 27 TYR H . . 4.630 4.311 3.973 4.482 . 0 0 "[ . 1 . 2]" 1
531 1 26 PRO HB3 1 27 TYR QD . . 4.930 4.839 4.505 5.015 0.085 15 0 "[ . 1 . 2]" 1
532 1 26 PRO HB3 1 27 TYR QE . . 5.010 4.439 4.063 5.019 0.009 13 0 "[ . 1 . 2]" 1
533 1 26 PRO HD2 1 27 TYR H . . 3.920 2.758 2.365 3.004 . 0 0 "[ . 1 . 2]" 1
534 1 26 PRO HD2 1 27 TYR QD . . 4.660 3.915 3.571 4.346 . 0 0 "[ . 1 . 2]" 1
535 1 26 PRO HD2 1 27 TYR QE . . 4.880 4.830 4.004 4.969 0.089 18 0 "[ . 1 . 2]" 1
536 1 26 PRO HD3 1 27 TYR H . . 4.440 3.958 3.710 4.114 . 0 0 "[ . 1 . 2]" 1
537 1 26 PRO HG2 1 27 TYR QE . . 4.670 2.852 2.435 3.105 . 0 0 "[ . 1 . 2]" 1
538 1 27 TYR H 1 27 TYR QB . . 3.710 2.715 2.388 3.004 . 0 0 "[ . 1 . 2]" 1
539 1 27 TYR H 1 27 TYR QD . . 3.940 3.077 2.435 3.486 . 0 0 "[ . 1 . 2]" 1
540 1 27 TYR H 1 27 TYR QE . . 5.010 4.659 4.129 4.935 . 0 0 "[ . 1 . 2]" 1
541 1 27 TYR H 1 28 ALA H . . 2.920 2.158 1.829 2.717 . 0 0 "[ . 1 . 2]" 1
542 1 27 TYR H 1 28 ALA MB . . 5.500 4.192 3.805 4.726 . 0 0 "[ . 1 . 2]" 1
543 1 27 TYR H 1 62 LEU QD . . 5.050 4.561 3.664 5.008 . 0 0 "[ . 1 . 2]" 1
544 1 27 TYR HA 1 27 TYR QD . . 2.910 2.734 2.376 2.971 0.061 10 0 "[ . 1 . 2]" 1
545 1 27 TYR HA 1 28 ALA MB . . 4.940 4.785 4.507 5.025 0.085 4 0 "[ . 1 . 2]" 1
546 1 27 TYR QB 1 28 ALA H . . 3.880 2.753 2.017 3.143 . 0 0 "[ . 1 . 2]" 1
547 1 27 TYR QB 1 28 ALA MB . . 4.680 3.420 2.940 3.692 . 0 0 "[ . 1 . 2]" 1
548 1 27 TYR QB 1 62 LEU QD . . 3.680 2.765 1.903 3.515 . 0 0 "[ . 1 . 2]" 1
549 1 27 TYR QB 1 65 ILE MD . . 4.350 3.745 3.031 4.164 . 0 0 "[ . 1 . 2]" 1
550 1 27 TYR QB 1 65 ILE MG . . 3.580 3.152 2.678 3.407 . 0 0 "[ . 1 . 2]" 1
551 1 27 TYR QB 1 66 LEU QD . . 4.450 2.942 2.183 3.509 . 0 0 "[ . 1 . 2]" 1
552 1 27 TYR QD 1 28 ALA H . . 4.640 4.061 3.159 4.500 . 0 0 "[ . 1 . 2]" 1
553 1 27 TYR QD 1 62 LEU QD . . 4.960 3.977 2.780 4.699 . 0 0 "[ . 1 . 2]" 1
554 1 27 TYR QD 1 66 LEU QD . . 4.170 2.392 1.954 3.695 . 0 0 "[ . 1 . 2]" 1
555 1 27 TYR QE 1 65 ILE MG . . 4.690 4.305 3.401 4.816 0.126 10 0 "[ . 1 . 2]" 1
556 1 27 TYR QE 1 66 LEU QD . . 5.060 3.263 2.130 5.020 . 0 0 "[ . 1 . 2]" 1
557 1 27 TYR QE 1 69 LEU QD . . 3.380 2.353 2.018 3.003 . 0 0 "[ . 1 . 2]" 1
558 1 28 ALA H 1 28 ALA MB . . 3.440 2.518 2.261 2.686 . 0 0 "[ . 1 . 2]" 1
559 1 28 ALA H 1 29 VAL H . . 4.550 4.165 3.803 4.520 . 0 0 "[ . 1 . 2]" 1
560 1 28 ALA H 1 29 VAL HA . . 5.200 4.753 4.247 5.267 0.067 15 0 "[ . 1 . 2]" 1
561 1 28 ALA H 1 62 LEU QD . . 4.040 3.495 2.839 4.039 . 0 0 "[ . 1 . 2]" 1
562 1 28 ALA HA 1 29 VAL H . . 2.630 2.187 2.071 2.444 . 0 0 "[ . 1 . 2]" 1
563 1 28 ALA HA 1 29 VAL HB . . 4.620 4.625 4.463 4.689 0.069 7 0 "[ . 1 . 2]" 1
564 1 28 ALA MB 1 29 VAL H . . 3.290 3.127 2.416 3.391 0.101 15 0 "[ . 1 . 2]" 1
565 1 28 ALA MB 1 29 VAL HA . . 5.260 4.241 3.931 4.407 . 0 0 "[ . 1 . 2]" 1
566 1 28 ALA MB 1 29 VAL MG2 . . 5.040 4.345 3.963 4.765 . 0 0 "[ . 1 . 2]" 1
567 1 28 ALA MB 1 30 LEU H . . 4.330 4.232 3.620 4.436 0.106 1 0 "[ . 1 . 2]" 1
568 1 28 ALA MB 1 62 LEU QB . . 3.760 3.517 2.961 3.698 . 0 0 "[ . 1 . 2]" 1
569 1 28 ALA MB 1 62 LEU QD . . 3.060 1.981 1.669 2.228 . 0 0 "[ . 1 . 2]" 1
570 1 28 ALA MB 1 62 LEU HG . . 3.070 2.421 2.047 3.198 0.128 19 0 "[ . 1 . 2]" 1
571 1 28 ALA MB 1 66 LEU QD . . 4.360 3.394 2.100 4.148 . 0 0 "[ . 1 . 2]" 1
572 1 29 VAL H 1 29 VAL HB . . 2.960 2.679 2.503 2.964 0.004 17 0 "[ . 1 . 2]" 1
573 1 29 VAL H 1 29 VAL MG1 . . 4.180 3.868 3.802 3.972 . 0 0 "[ . 1 . 2]" 1
574 1 29 VAL H 1 29 VAL MG2 . . 3.170 2.542 2.342 2.846 . 0 0 "[ . 1 . 2]" 1
575 1 29 VAL H 1 30 LEU H . . 4.290 3.989 3.471 4.364 0.074 16 0 "[ . 1 . 2]" 1
576 1 29 VAL H 1 30 LEU HA . . 5.500 4.698 3.947 5.142 . 0 0 "[ . 1 . 2]" 1
577 1 29 VAL H 1 30 LEU QD . . 5.060 4.132 2.957 4.946 . 0 0 "[ . 1 . 2]" 1
578 1 29 VAL HA 1 29 VAL MG1 . . 3.070 2.310 2.222 2.406 . 0 0 "[ . 1 . 2]" 1
579 1 29 VAL HA 1 29 VAL MG2 . . 3.060 2.563 2.376 2.683 . 0 0 "[ . 1 . 2]" 1
580 1 29 VAL HA 1 30 LEU H . . 2.580 2.203 2.096 2.322 . 0 0 "[ . 1 . 2]" 1
581 1 29 VAL HB 1 30 LEU H . . 4.740 4.396 4.120 4.518 . 0 0 "[ . 1 . 2]" 1
582 1 29 VAL MG1 1 30 LEU H . . 3.700 3.354 2.717 3.774 0.074 20 0 "[ . 1 . 2]" 1
583 1 29 VAL MG2 1 30 LEU H . . 4.400 4.361 4.104 4.474 0.074 12 0 "[ . 1 . 2]" 1
584 1 30 LEU H 1 30 LEU HB2 . . 3.450 2.523 2.407 2.636 . 0 0 "[ . 1 . 2]" 1
585 1 30 LEU H 1 30 LEU HB3 . . 4.040 3.630 3.563 3.730 . 0 0 "[ . 1 . 2]" 1
586 1 30 LEU H 1 30 LEU QD . . 4.220 2.594 1.922 3.355 . 0 0 "[ . 1 . 2]" 1
587 1 30 LEU H 1 30 LEU HG . . 3.970 3.152 2.053 4.055 0.085 16 0 "[ . 1 . 2]" 1
588 1 30 LEU H 1 31 SER H . . 4.730 4.642 4.474 4.714 . 0 0 "[ . 1 . 2]" 1
589 1 30 LEU HA 1 30 LEU QD . . 3.030 2.213 2.049 2.567 . 0 0 "[ . 1 . 2]" 1
590 1 30 LEU HA 1 30 LEU HG . . 3.960 3.422 2.909 3.825 . 0 0 "[ . 1 . 2]" 1
591 1 30 LEU HA 1 31 SER H . . 2.930 2.428 2.236 2.708 . 0 0 "[ . 1 . 2]" 1
592 1 30 LEU HB2 1 30 LEU QD . . 3.240 2.221 2.112 2.332 . 0 0 "[ . 1 . 2]" 1
593 1 30 LEU HB2 1 31 SER H . . 3.900 3.585 3.109 3.964 0.064 2 0 "[ . 1 . 2]" 1
594 1 30 LEU HB3 1 31 SER H . . 3.390 2.450 2.027 2.916 . 0 0 "[ . 1 . 2]" 1
595 1 30 LEU HB3 1 34 ASN HB2 . . 4.110 2.422 2.051 3.484 . 0 0 "[ . 1 . 2]" 1
596 1 30 LEU HB3 1 34 ASN HB3 . . 4.950 3.541 2.916 4.455 . 0 0 "[ . 1 . 2]" 1
597 1 30 LEU QD 1 31 SER H . . 4.210 3.438 3.125 3.810 . 0 0 "[ . 1 . 2]" 1
598 1 30 LEU QD 1 34 ASN HB2 . . 3.700 3.115 2.661 3.652 . 0 0 "[ . 1 . 2]" 1
599 1 30 LEU QD 1 34 ASN HB3 . . 3.590 3.022 2.617 3.534 . 0 0 "[ . 1 . 2]" 1
600 1 30 LEU QD 1 34 ASN QD . . 4.820 3.607 2.779 4.141 . 0 0 "[ . 1 . 2]" 1
601 1 30 LEU QD 1 52 ILE HG12 . . 3.020 2.667 2.204 3.037 0.017 7 0 "[ . 1 . 2]" 1
602 1 30 LEU QD 1 52 ILE MG . . 2.400 2.014 1.917 2.191 . 0 0 "[ . 1 . 2]" 1
603 1 31 SER H 1 31 SER HB2 . . 4.000 2.461 2.047 2.957 . 0 0 "[ . 1 . 2]" 1
604 1 31 SER H 1 31 SER HB3 . . 3.800 3.367 2.577 3.827 0.027 3 0 "[ . 1 . 2]" 1
605 1 31 SER H 1 32 SER H . . 5.440 3.736 2.761 4.598 . 0 0 "[ . 1 . 2]" 1
606 1 31 SER H 1 34 ASN H . . 4.030 3.812 3.437 4.101 0.071 1 0 "[ . 1 . 2]" 1
607 1 31 SER H 1 34 ASN HB2 . . 3.920 3.082 2.329 3.615 . 0 0 "[ . 1 . 2]" 1
608 1 31 SER H 1 34 ASN HB3 . . 4.430 4.324 3.832 4.513 0.083 10 0 "[ . 1 . 2]" 1
609 1 31 SER H 1 34 ASN QD . . 5.500 4.066 3.389 4.515 . 0 0 "[ . 1 . 2]" 1
610 1 31 SER H 1 35 VAL H . . 5.500 5.261 4.094 5.571 0.071 18 0 "[ . 1 . 2]" 1
611 1 31 SER H 1 35 VAL MG2 . . 5.380 4.254 3.560 5.025 . 0 0 "[ . 1 . 2]" 1
612 1 31 SER HB2 1 32 SER H . . 4.690 3.858 1.959 4.617 . 0 0 "[ . 1 . 2]" 1
613 1 31 SER HB2 1 34 ASN H . . 4.730 3.778 2.893 4.804 0.074 8 0 "[ . 1 . 2]" 1
614 1 31 SER HB3 1 34 ASN H . . 3.820 4.029 2.731 4.801 0.981 4 8 "[** +. ** - . ** 2]" 1
615 1 31 SER HB3 1 34 ASN QD . . 5.460 5.210 3.770 6.232 0.772 16 4 "[ * - 1 * .+ 2]" 1
616 1 32 SER H 1 32 SER HB2 . . 4.130 3.228 2.294 3.918 . 0 0 "[ . 1 . 2]" 1
617 1 32 SER H 1 32 SER HB3 . . 4.120 3.355 2.094 4.070 . 0 0 "[ . 1 . 2]" 1
618 1 32 SER H 1 33 SER H . . 4.600 3.231 2.150 4.130 . 0 0 "[ . 1 . 2]" 1
619 1 32 SER H 1 34 ASN H . . 5.500 4.082 2.481 4.664 . 0 0 "[ . 1 . 2]" 1
620 1 32 SER H 1 35 VAL HB . . 5.500 5.398 5.008 5.575 0.075 12 0 "[ . 1 . 2]" 1
621 1 32 SER HA 1 32 SER HB3 . . 2.980 2.618 2.314 3.049 0.069 4 0 "[ . 1 . 2]" 1
622 1 32 SER HA 1 35 VAL H . . 3.950 3.593 3.035 4.007 0.057 10 0 "[ . 1 . 2]" 1
623 1 32 SER HA 1 35 VAL HB . . 4.070 3.349 2.536 4.125 0.055 4 0 "[ . 1 . 2]" 1
624 1 32 SER HA 1 35 VAL MG2 . . 4.410 3.416 2.682 3.997 . 0 0 "[ . 1 . 2]" 1
625 1 32 SER HB3 1 33 SER H . . 4.110 3.458 2.179 4.196 0.086 13 0 "[ . 1 . 2]" 1
626 1 33 SER H 1 33 SER HB2 . . 3.290 2.894 2.136 3.599 0.309 1 0 "[ . 1 . 2]" 1
627 1 33 SER H 1 33 SER HB3 . . 3.660 2.721 2.269 3.564 . 0 0 "[ . 1 . 2]" 1
628 1 33 SER H 1 35 VAL H . . 5.500 4.213 3.895 4.409 . 0 0 "[ . 1 . 2]" 1
629 1 33 SER HA 1 33 SER HB2 . . 2.830 2.541 2.257 2.925 0.095 5 0 "[ . 1 . 2]" 1
630 1 33 SER HA 1 35 VAL H . . 4.400 3.875 3.427 4.467 0.067 16 0 "[ . 1 . 2]" 1
631 1 34 ASN H 1 34 ASN HB2 . . 3.410 2.526 2.287 2.744 . 0 0 "[ . 1 . 2]" 1
632 1 34 ASN H 1 34 ASN HB3 . . 3.850 3.598 3.509 3.683 . 0 0 "[ . 1 . 2]" 1
633 1 34 ASN H 1 34 ASN QD . . 5.440 3.944 3.564 4.331 . 0 0 "[ . 1 . 2]" 1
634 1 34 ASN H 1 35 VAL H . . 3.040 2.740 2.356 2.998 . 0 0 "[ . 1 . 2]" 1
635 1 34 ASN H 1 35 VAL HB . . 5.500 5.024 4.596 5.461 . 0 0 "[ . 1 . 2]" 1
636 1 34 ASN H 1 35 VAL MG2 . . 4.460 3.913 3.436 4.438 . 0 0 "[ . 1 . 2]" 1
637 1 34 ASN H 1 53 GLN H . . 5.500 5.490 5.163 5.583 0.083 10 0 "[ . 1 . 2]" 1
638 1 34 ASN HA 1 34 ASN QD . . 3.400 2.932 2.317 3.300 . 0 0 "[ . 1 . 2]" 1
639 1 34 ASN HB2 1 35 VAL H . . 4.230 2.961 2.512 3.864 . 0 0 "[ . 1 . 2]" 1
640 1 34 ASN HB2 1 35 VAL MG2 . . 3.790 2.680 2.137 3.389 . 0 0 "[ . 1 . 2]" 1
641 1 34 ASN HB2 1 53 GLN H . . 4.550 4.191 3.849 4.605 0.055 3 0 "[ . 1 . 2]" 1
642 1 34 ASN HB3 1 35 VAL H . . 4.740 3.916 3.600 4.484 . 0 0 "[ . 1 . 2]" 1
643 1 34 ASN HB3 1 35 VAL MG2 . . 3.900 3.500 3.041 3.938 0.038 8 0 "[ . 1 . 2]" 1
644 1 34 ASN HB3 1 52 ILE MG . . 4.330 2.774 2.248 3.396 . 0 0 "[ . 1 . 2]" 1
645 1 34 ASN HB3 1 53 GLN H . . 4.090 2.744 2.475 3.162 . 0 0 "[ . 1 . 2]" 1
646 1 34 ASN HB3 1 54 LEU MD2 . . 4.160 4.068 2.971 4.909 0.749 15 1 "[ . 1 + 2]" 1
647 1 34 ASN QD 1 53 GLN H . . 5.500 3.744 3.459 3.890 . 0 0 "[ . 1 . 2]" 1
648 1 34 ASN QD 1 54 LEU H . . 5.500 4.583 3.956 4.804 . 0 0 "[ . 1 . 2]" 1
649 1 34 ASN QD 1 54 LEU HA . . 4.560 2.830 1.870 3.297 . 0 0 "[ . 1 . 2]" 1
650 1 34 ASN QD 1 54 LEU MD2 . . 3.960 2.841 2.341 3.416 . 0 0 "[ . 1 . 2]" 1
651 1 35 VAL H 1 35 VAL HB . . 3.230 2.588 2.451 2.930 . 0 0 "[ . 1 . 2]" 1
652 1 35 VAL H 1 35 VAL MG1 . . 4.150 3.826 3.772 3.978 . 0 0 "[ . 1 . 2]" 1
653 1 35 VAL H 1 35 VAL MG2 . . 3.490 2.448 2.194 2.949 . 0 0 "[ . 1 . 2]" 1
654 1 35 VAL H 1 36 ARG H . . 4.790 4.188 3.745 4.621 . 0 0 "[ . 1 . 2]" 1
655 1 35 VAL H 1 53 GLN H . . 5.500 4.908 4.680 5.476 . 0 0 "[ . 1 . 2]" 1
656 1 35 VAL HA 1 35 VAL MG1 . . 3.080 2.330 2.161 2.426 . 0 0 "[ . 1 . 2]" 1
657 1 35 VAL HA 1 35 VAL MG2 . . 3.210 2.379 2.232 2.508 . 0 0 "[ . 1 . 2]" 1
658 1 35 VAL HA 1 36 ARG H . . 3.010 2.161 2.095 2.249 . 0 0 "[ . 1 . 2]" 1
659 1 35 VAL HA 1 52 ILE HG12 . . 4.620 3.530 2.379 4.218 . 0 0 "[ . 1 . 2]" 1
660 1 35 VAL HB 1 36 ARG H . . 4.780 4.359 3.917 4.542 . 0 0 "[ . 1 . 2]" 1
661 1 35 VAL HB 1 52 ILE HG12 . . 5.440 5.055 4.460 5.489 0.049 14 0 "[ . 1 . 2]" 1
662 1 35 VAL MG1 1 36 ARG H . . 3.390 3.126 2.379 3.479 0.089 10 0 "[ . 1 . 2]" 1
663 1 35 VAL MG1 1 36 ARG HA . . 4.360 4.199 3.488 4.444 0.084 6 0 "[ . 1 . 2]" 1
664 1 35 VAL MG1 1 37 VAL H . . 4.110 3.884 3.008 4.202 0.092 4 0 "[ . 1 . 2]" 1
665 1 35 VAL MG1 1 37 VAL QG . . 2.400 2.153 1.993 2.402 0.002 2 0 "[ . 1 . 2]" 1
666 1 35 VAL MG1 1 52 ILE HG12 . . 3.520 3.092 2.374 3.594 0.074 14 0 "[ . 1 . 2]" 1
667 1 35 VAL MG2 1 36 ARG H . . 4.380 4.156 3.910 4.389 0.009 10 0 "[ . 1 . 2]" 1
668 1 35 VAL MG2 1 52 ILE HG12 . . 3.290 2.280 2.097 2.631 . 0 0 "[ . 1 . 2]" 1
669 1 35 VAL MG2 1 53 GLN H . . 4.760 4.302 3.617 4.860 0.100 7 0 "[ . 1 . 2]" 1
670 1 36 ARG H 1 36 ARG QB . . 3.510 2.246 2.041 2.582 . 0 0 "[ . 1 . 2]" 1
671 1 36 ARG H 1 36 ARG HB3 . . 3.550 3.237 2.738 3.575 0.025 14 0 "[ . 1 . 2]" 1
672 1 36 ARG H 1 36 ARG QD . . 5.500 4.568 4.231 4.910 . 0 0 "[ . 1 . 2]" 1
673 1 36 ARG H 1 36 ARG HG2 . . 4.610 3.894 3.185 4.529 . 0 0 "[ . 1 . 2]" 1
674 1 36 ARG H 1 36 ARG HG3 . . 4.650 4.390 3.997 4.721 0.071 18 0 "[ . 1 . 2]" 1
675 1 36 ARG H 1 37 VAL H . . 4.620 4.230 3.801 4.445 . 0 0 "[ . 1 . 2]" 1
676 1 36 ARG H 1 37 VAL HA . . 5.500 5.269 4.820 5.555 0.055 8 0 "[ . 1 . 2]" 1
677 1 36 ARG H 1 50 ALA MB . . 4.770 4.007 3.201 4.806 0.036 12 0 "[ . 1 . 2]" 1
678 1 36 ARG H 1 51 PHE H . . 3.630 2.978 2.525 3.281 . 0 0 "[ . 1 . 2]" 1
679 1 36 ARG H 1 51 PHE HB2 . . 4.310 3.179 2.799 3.400 . 0 0 "[ . 1 . 2]" 1
680 1 36 ARG HA 1 36 ARG QD . . 3.080 2.597 2.039 3.015 . 0 0 "[ . 1 . 2]" 1
681 1 36 ARG HA 1 36 ARG HG2 . . 3.930 2.392 2.128 2.608 . 0 0 "[ . 1 . 2]" 1
682 1 36 ARG HA 1 36 ARG HG3 . . 3.880 3.589 3.432 3.694 . 0 0 "[ . 1 . 2]" 1
683 1 36 ARG HA 1 37 VAL H . . 2.990 2.189 2.123 2.268 . 0 0 "[ . 1 . 2]" 1
684 1 36 ARG HA 1 37 VAL QG . . 4.160 3.956 3.754 4.115 . 0 0 "[ . 1 . 2]" 1
685 1 36 ARG QB 1 36 ARG QD . . 3.150 2.313 2.120 2.494 . 0 0 "[ . 1 . 2]" 1
686 1 36 ARG QB 1 51 PHE HB3 . . 3.390 3.476 3.461 3.488 0.098 10 0 "[ . 1 . 2]" 1
687 1 36 ARG QB 1 51 PHE QD . . 4.130 2.394 2.155 3.170 . 0 0 "[ . 1 . 2]" 1
688 1 36 ARG HB3 1 51 PHE H . . 4.070 3.477 2.810 3.959 . 0 0 "[ . 1 . 2]" 1
689 1 36 ARG HB3 1 51 PHE QD . . 4.540 2.446 2.176 3.214 . 0 0 "[ . 1 . 2]" 1
690 1 36 ARG HB3 1 51 PHE QE . . 5.500 4.443 4.085 5.051 . 0 0 "[ . 1 . 2]" 1
691 1 36 ARG QD 1 37 VAL H . . 5.500 3.346 2.443 4.464 . 0 0 "[ . 1 . 2]" 1
692 1 36 ARG QD 1 51 PHE QD . . 5.270 3.838 2.800 4.400 . 0 0 "[ . 1 . 2]" 1
693 1 36 ARG QD 1 51 PHE QE . . 5.500 4.891 3.745 5.401 . 0 0 "[ . 1 . 2]" 1
694 1 37 VAL H 1 37 VAL HB . . 3.130 2.656 2.472 2.879 . 0 0 "[ . 1 . 2]" 1
695 1 37 VAL H 1 37 VAL QG . . 3.420 2.660 2.451 2.940 . 0 0 "[ . 1 . 2]" 1
696 1 37 VAL H 1 38 ILE H . . 5.390 4.125 3.870 4.367 . 0 0 "[ . 1 . 2]" 1
697 1 37 VAL H 1 38 ILE HA . . 5.050 4.815 4.481 5.095 0.045 19 0 "[ . 1 . 2]" 1
698 1 37 VAL H 1 39 LYS QE . . 5.500 4.630 3.659 5.590 0.090 9 0 "[ . 1 . 2]" 1
699 1 37 VAL H 1 50 ALA MB . . 5.500 4.387 3.845 4.983 . 0 0 "[ . 1 . 2]" 1
700 1 37 VAL HA 1 37 VAL QG . . 3.130 2.143 2.057 2.203 . 0 0 "[ . 1 . 2]" 1
701 1 37 VAL HA 1 38 ILE H . . 2.990 2.209 2.093 2.319 . 0 0 "[ . 1 . 2]" 1
702 1 37 VAL HA 1 50 ALA HA . . 3.370 3.024 2.644 3.404 0.034 13 0 "[ . 1 . 2]" 1
703 1 37 VAL HA 1 50 ALA MB . . 3.340 2.932 2.286 3.406 0.066 16 0 "[ . 1 . 2]" 1
704 1 37 VAL HA 1 51 PHE H . . 4.450 4.089 3.723 4.506 0.056 13 0 "[ . 1 . 2]" 1
705 1 37 VAL HB 1 38 ILE H . . 4.650 4.424 4.200 4.565 . 0 0 "[ . 1 . 2]" 1
706 1 37 VAL HB 1 50 ALA MB . . 4.510 4.442 4.189 4.610 0.100 13 0 "[ . 1 . 2]" 1
707 1 37 VAL QG 1 38 ILE H . . 3.710 3.150 2.625 3.483 . 0 0 "[ . 1 . 2]" 1
708 1 37 VAL QG 1 39 LYS QB . . 5.500 4.382 3.225 5.006 . 0 0 "[ . 1 . 2]" 1
709 1 37 VAL QG 1 39 LYS QD . . 5.090 3.346 2.171 4.751 . 0 0 "[ . 1 . 2]" 1
710 1 37 VAL QG 1 39 LYS QE . . 4.010 2.912 2.224 3.637 . 0 0 "[ . 1 . 2]" 1
711 1 37 VAL QG 1 46 ASN QB . . 3.440 2.309 2.073 2.811 . 0 0 "[ . 1 . 2]" 1
712 1 37 VAL QG 1 46 ASN HD22 . . 4.430 4.028 3.335 4.850 0.420 4 0 "[ . 1 . 2]" 1
713 1 37 VAL QG 1 47 ARG H . . 5.330 3.653 3.293 4.431 . 0 0 "[ . 1 . 2]" 1
714 1 37 VAL QG 1 48 GLY H . . 5.500 4.325 3.695 5.085 . 0 0 "[ . 1 . 2]" 1
715 1 37 VAL QG 1 49 PHE H . . 5.500 4.527 4.028 4.982 . 0 0 "[ . 1 . 2]" 1
716 1 37 VAL QG 1 50 ALA HA . . 4.370 3.399 2.645 3.902 . 0 0 "[ . 1 . 2]" 1
717 1 37 VAL QG 1 50 ALA MB . . 2.860 2.024 1.876 2.139 . 0 0 "[ . 1 . 2]" 1
718 1 37 VAL QG 1 51 PHE H . . 4.330 3.910 2.975 4.282 . 0 0 "[ . 1 . 2]" 1
719 1 38 ILE H 1 38 ILE HB . . 3.240 2.553 2.362 2.892 . 0 0 "[ . 1 . 2]" 1
720 1 38 ILE H 1 38 ILE HG12 . . 3.590 3.500 3.175 3.663 0.073 4 0 "[ . 1 . 2]" 1
721 1 38 ILE H 1 38 ILE HG13 . . 3.600 2.250 2.055 2.456 . 0 0 "[ . 1 . 2]" 1
722 1 38 ILE H 1 39 LYS H . . 5.210 4.552 4.300 4.639 . 0 0 "[ . 1 . 2]" 1
723 1 38 ILE H 1 50 ALA HA . . 5.490 3.892 3.532 4.178 . 0 0 "[ . 1 . 2]" 1
724 1 38 ILE H 1 50 ALA MB . . 4.770 4.446 3.587 4.854 0.084 16 0 "[ . 1 . 2]" 1
725 1 38 ILE HA 1 38 ILE HG12 . . 3.640 2.815 2.518 3.715 0.075 6 0 "[ . 1 . 2]" 1
726 1 38 ILE HA 1 38 ILE MG . . 3.130 2.355 2.175 2.463 . 0 0 "[ . 1 . 2]" 1
727 1 38 ILE HA 1 39 LYS H . . 2.710 2.271 2.173 2.407 . 0 0 "[ . 1 . 2]" 1
728 1 38 ILE HB 1 38 ILE MD . . 3.250 2.331 2.176 2.553 . 0 0 "[ . 1 . 2]" 1
729 1 38 ILE HB 1 39 LYS H . . 5.290 4.100 3.710 4.463 . 0 0 "[ . 1 . 2]" 1
730 1 38 ILE MD 1 47 ARG QB . . 4.390 3.592 2.867 4.243 . 0 0 "[ . 1 . 2]" 1
731 1 38 ILE MD 1 47 ARG QD . . 3.640 3.497 2.211 3.765 0.125 2 0 "[ . 1 . 2]" 1
732 1 38 ILE MD 1 47 ARG QG . . 3.940 3.442 2.420 4.063 0.123 19 0 "[ . 1 . 2]" 1
733 1 38 ILE MD 1 51 PHE QE . . 3.670 2.350 2.109 2.824 . 0 0 "[ . 1 . 2]" 1
734 1 38 ILE HG13 1 50 ALA HA . . 5.390 4.756 3.886 5.220 . 0 0 "[ . 1 . 2]" 1
735 1 38 ILE HG13 1 51 PHE QD . . 4.000 3.603 2.896 4.028 0.028 16 0 "[ . 1 . 2]" 1
736 1 38 ILE MG 1 39 LYS H . . 4.200 2.638 2.093 3.267 . 0 0 "[ . 1 . 2]" 1
737 1 38 ILE MG 1 47 ARG QG . . 4.280 2.581 2.114 3.762 . 0 0 "[ . 1 . 2]" 1
738 1 39 LYS H 1 39 LYS QB . . 3.400 2.695 2.332 3.200 . 0 0 "[ . 1 . 2]" 1
739 1 39 LYS H 1 39 LYS QD . . 3.650 2.875 2.288 3.728 0.078 20 0 "[ . 1 . 2]" 1
740 1 39 LYS H 1 39 LYS QE . . 5.500 4.404 3.261 4.915 . 0 0 "[ . 1 . 2]" 1
741 1 39 LYS H 1 39 LYS HG2 . . 5.500 3.763 2.289 4.593 . 0 0 "[ . 1 . 2]" 1
742 1 39 LYS H 1 39 LYS HG3 . . 4.180 3.495 2.660 3.931 . 0 0 "[ . 1 . 2]" 1
743 1 39 LYS H 1 46 ASN HA . . 5.450 4.630 4.318 4.855 . 0 0 "[ . 1 . 2]" 1
744 1 39 LYS HA 1 40 ASP H . . 2.840 2.309 2.208 2.406 . 0 0 "[ . 1 . 2]" 1
745 1 39 LYS HA 1 46 ASN HA . . 2.910 2.023 1.895 2.304 . 0 0 "[ . 1 . 2]" 1
746 1 39 LYS HA 1 47 ARG H . . 3.940 3.507 2.966 3.953 0.013 20 0 "[ . 1 . 2]" 1
747 1 39 LYS QB 1 39 LYS QD . . 2.400 2.267 2.111 2.434 0.034 9 0 "[ . 1 . 2]" 1
748 1 39 LYS QB 1 44 GLN HA . . 4.720 3.584 3.013 4.245 . 0 0 "[ . 1 . 2]" 1
749 1 39 LYS QB 1 46 ASN HA . . 5.180 3.438 2.328 3.947 . 0 0 "[ . 1 . 2]" 1
750 1 39 LYS HG2 1 46 ASN HA . . 4.910 4.232 2.894 4.986 0.076 9 0 "[ . 1 . 2]" 1
751 1 39 LYS HG3 1 46 ASN HA . . 5.050 3.792 2.324 5.125 0.075 5 0 "[ . 1 . 2]" 1
752 1 40 ASP H 1 40 ASP HB2 . . 3.380 2.268 2.106 2.515 . 0 0 "[ . 1 . 2]" 1
753 1 40 ASP H 1 40 ASP HB3 . . 3.340 2.777 2.371 3.430 0.090 6 0 "[ . 1 . 2]" 1
754 1 40 ASP H 1 43 THR H . . 5.430 5.305 4.986 5.511 0.081 1 0 "[ . 1 . 2]" 1
755 1 40 ASP H 1 44 GLN HA . . 5.220 4.258 3.642 5.104 . 0 0 "[ . 1 . 2]" 1
756 1 40 ASP H 1 45 LEU H . . 4.540 3.649 2.728 4.347 . 0 0 "[ . 1 . 2]" 1
757 1 40 ASP H 1 45 LEU MD1 . . 5.500 5.605 5.588 5.620 0.120 19 0 "[ . 1 . 2]" 1
758 1 40 ASP H 1 46 ASN H . . 4.520 4.595 4.528 4.618 0.098 9 0 "[ . 1 . 2]" 1
759 1 40 ASP H 1 46 ASN HA . . 3.800 3.331 2.838 3.858 0.058 18 0 "[ . 1 . 2]" 1
760 1 40 ASP H 1 47 ARG H . . 5.310 4.734 4.166 5.235 . 0 0 "[ . 1 . 2]" 1
761 1 40 ASP H 1 47 ARG HA . . 5.490 5.151 4.391 5.551 0.061 18 0 "[ . 1 . 2]" 1
762 1 40 ASP H 1 47 ARG QD . . 5.060 4.995 4.315 5.156 0.096 10 0 "[ . 1 . 2]" 1
763 1 40 ASP H 1 47 ARG QG . . 4.170 3.872 3.348 4.257 0.087 4 0 "[ . 1 . 2]" 1
764 1 40 ASP HA 1 41 LYS H . . 3.520 2.689 2.265 3.511 . 0 0 "[ . 1 . 2]" 1
765 1 40 ASP HA 1 41 LYS HA . . 5.250 4.656 4.378 5.303 0.053 11 0 "[ . 1 . 2]" 1
766 1 40 ASP HA 1 41 LYS QB . . 5.130 4.420 3.898 4.950 . 0 0 "[ . 1 . 2]" 1
767 1 40 ASP HA 1 42 GLN H . . 4.600 4.320 3.951 4.702 0.102 7 0 "[ . 1 . 2]" 1
768 1 40 ASP HA 1 47 ARG QD . . 4.140 3.923 3.305 4.238 0.098 12 0 "[ . 1 . 2]" 1
769 1 40 ASP HB2 1 41 LYS H . . 5.210 3.863 3.433 4.384 . 0 0 "[ . 1 . 2]" 1
770 1 40 ASP HB2 1 43 THR H . . 4.690 3.992 3.277 4.394 . 0 0 "[ . 1 . 2]" 1
771 1 40 ASP HB2 1 43 THR MG . . 5.130 3.970 2.691 5.163 0.033 14 0 "[ . 1 . 2]" 1
772 1 40 ASP HB2 1 45 LEU H . . 4.180 3.604 2.452 4.261 0.081 15 0 "[ . 1 . 2]" 1
773 1 40 ASP HB2 1 47 ARG HA . . 5.410 4.858 3.736 5.421 0.011 3 0 "[ . 1 . 2]" 1
774 1 40 ASP HB3 1 41 LYS H . . 5.500 3.109 2.101 4.004 . 0 0 "[ . 1 . 2]" 1
775 1 40 ASP HB3 1 42 GLN H . . 3.340 3.306 2.458 3.424 0.084 1 0 "[ . 1 . 2]" 1
776 1 40 ASP HB3 1 43 THR H . . 4.350 2.677 2.127 3.164 . 0 0 "[ . 1 . 2]" 1
777 1 40 ASP HB3 1 43 THR MG . . 4.760 3.428 1.993 4.226 . 0 0 "[ . 1 . 2]" 1
778 1 40 ASP HB3 1 44 GLN H . . 4.990 2.794 1.939 4.186 . 0 0 "[ . 1 . 2]" 1
779 1 40 ASP HB3 1 44 GLN HA . . 5.100 3.922 2.977 5.167 0.067 14 0 "[ . 1 . 2]" 1
780 1 40 ASP HB3 1 45 LEU H . . 4.150 3.062 2.030 4.163 0.013 14 0 "[ . 1 . 2]" 1
781 1 41 LYS H 1 41 LYS QD . . 5.440 4.399 2.085 5.139 . 0 0 "[ . 1 . 2]" 1
782 1 41 LYS H 1 41 LYS HG2 . . 4.580 3.909 2.513 5.002 0.422 7 0 "[ . 1 . 2]" 1
783 1 41 LYS H 1 42 GLN H . . 3.760 2.432 1.809 3.677 . 0 0 "[ . 1 . 2]" 1
784 1 41 LYS H 1 43 THR H . . 5.370 3.856 2.804 4.645 . 0 0 "[ . 1 . 2]" 1
785 1 41 LYS H 1 43 THR MG . . 5.500 5.068 4.382 5.606 0.106 14 0 "[ . 1 . 2]" 1
786 1 41 LYS HA 1 41 LYS QD . . 4.380 3.717 2.118 4.194 . 0 0 "[ . 1 . 2]" 1
787 1 41 LYS HA 1 41 LYS HG2 . . 4.130 2.658 2.182 3.728 . 0 0 "[ . 1 . 2]" 1
788 1 41 LYS HA 1 42 GLN HA . . 4.580 4.594 4.357 4.656 0.076 1 0 "[ . 1 . 2]" 1
789 1 41 LYS HA 1 43 THR H . . 4.960 4.964 4.457 5.047 0.087 17 0 "[ . 1 . 2]" 1
790 1 41 LYS HA 1 44 GLN H . . 4.840 4.040 3.083 4.858 0.018 7 0 "[ . 1 . 2]" 1
791 1 41 LYS HA 1 44 GLN HE21 . . 4.290 3.976 2.650 4.490 0.200 11 0 "[ . 1 . 2]" 1
792 1 41 LYS HA 1 44 GLN HE22 . . 4.420 3.488 2.636 4.472 0.052 20 0 "[ . 1 . 2]" 1
793 1 41 LYS QB 1 42 GLN H . . 3.620 3.000 2.407 3.665 0.045 6 0 "[ . 1 . 2]" 1
794 1 41 LYS QB 1 42 GLN QE . . 5.500 4.365 2.668 5.354 . 0 0 "[ . 1 . 2]" 1
795 1 41 LYS QB 1 43 THR H . . 5.500 5.034 4.278 5.570 0.070 15 0 "[ . 1 . 2]" 1
796 1 41 LYS QB 1 44 GLN HE21 . . 5.500 5.080 3.642 5.786 0.286 10 0 "[ . 1 . 2]" 1
797 1 41 LYS QD 1 41 LYS HE2 . . 2.740 2.350 2.159 2.538 . 0 0 "[ . 1 . 2]" 1
798 1 41 LYS QD 1 41 LYS HG2 . . 2.430 2.354 2.141 2.552 0.122 12 0 "[ . 1 . 2]" 1
799 1 41 LYS HG2 1 42 GLN H . . 5.070 4.795 2.184 5.225 0.155 6 0 "[ . 1 . 2]" 1
800 1 42 GLN H 1 42 GLN HB2 . . 3.140 2.336 2.074 2.777 . 0 0 "[ . 1 . 2]" 1
801 1 42 GLN H 1 42 GLN QG . . 3.850 3.396 2.367 3.954 0.104 8 0 "[ . 1 . 2]" 1
802 1 42 GLN H 1 43 THR H . . 3.220 2.356 1.999 2.927 . 0 0 "[ . 1 . 2]" 1
803 1 42 GLN H 1 43 THR MG . . 4.430 3.905 3.426 4.450 0.020 14 0 "[ . 1 . 2]" 1
804 1 42 GLN H 1 44 GLN H . . 4.480 3.428 2.510 4.097 . 0 0 "[ . 1 . 2]" 1
805 1 42 GLN HA 1 42 GLN HB2 . . 2.850 2.911 2.729 2.948 0.098 1 0 "[ . 1 . 2]" 1
806 1 42 GLN HA 1 42 GLN QE . . 5.500 3.395 1.881 4.979 . 0 0 "[ . 1 . 2]" 1
807 1 42 GLN HA 1 42 GLN QG . . 3.440 2.445 2.127 3.004 . 0 0 "[ . 1 . 2]" 1
808 1 42 GLN HB2 1 42 GLN QG . . 2.400 2.322 2.176 2.463 0.063 18 0 "[ . 1 . 2]" 1
809 1 42 GLN HB2 1 43 THR H . . 3.460 2.891 2.409 3.528 0.068 8 0 "[ . 1 . 2]" 1
810 1 42 GLN HB2 1 43 THR MG . . 3.760 3.468 2.569 3.842 0.082 7 0 "[ . 1 . 2]" 1
811 1 42 GLN QG 1 43 THR H . . 5.200 4.276 3.850 4.693 . 0 0 "[ . 1 . 2]" 1
812 1 42 GLN QG 1 43 THR MG . . 4.820 4.451 3.710 4.906 0.086 9 0 "[ . 1 . 2]" 1
813 1 43 THR H 1 43 THR MG . . 3.270 2.225 2.048 2.481 . 0 0 "[ . 1 . 2]" 1
814 1 43 THR H 1 44 GLN H . . 3.450 2.458 2.115 2.742 . 0 0 "[ . 1 . 2]" 1
815 1 43 THR H 1 44 GLN HA . . 4.650 4.613 4.272 4.724 0.074 2 0 "[ . 1 . 2]" 1
816 1 43 THR HA 1 43 THR MG . . 3.320 2.562 2.288 3.294 . 0 0 "[ . 1 . 2]" 1
817 1 43 THR HA 1 44 GLN HG2 . . 4.910 4.136 3.782 4.625 . 0 0 "[ . 1 . 2]" 1
818 1 43 THR HA 1 45 LEU HG . . 5.120 4.162 3.839 4.519 . 0 0 "[ . 1 . 2]" 1
819 1 43 THR HB 1 44 GLN H . . 4.700 4.210 3.991 4.375 . 0 0 "[ . 1 . 2]" 1
820 1 43 THR HB 1 45 LEU H . . 4.010 3.556 2.755 4.114 0.104 16 0 "[ . 1 . 2]" 1
821 1 43 THR HB 1 45 LEU MD1 . . 3.720 2.659 1.920 3.794 0.074 20 0 "[ . 1 . 2]" 1
822 1 43 THR HB 1 45 LEU MD2 . . 5.500 4.127 3.480 4.905 . 0 0 "[ . 1 . 2]" 1
823 1 43 THR HB 1 45 LEU HG . . 3.550 2.776 2.051 3.651 0.101 9 0 "[ . 1 . 2]" 1
824 1 43 THR MG 1 44 GLN H . . 4.750 3.846 2.692 4.223 . 0 0 "[ . 1 . 2]" 1
825 1 43 THR MG 1 45 LEU H . . 4.940 3.810 1.646 4.832 . 0 0 "[ . 1 . 2]" 1
826 1 43 THR MG 1 45 LEU MD1 . . 3.860 2.991 2.098 3.789 . 0 0 "[ . 1 . 2]" 1
827 1 44 GLN H 1 44 GLN HB2 . . 3.950 3.705 3.532 3.870 . 0 0 "[ . 1 . 2]" 1
828 1 44 GLN H 1 44 GLN HE21 . . 5.500 3.653 2.839 5.103 . 0 0 "[ . 1 . 2]" 1
829 1 44 GLN H 1 44 GLN HE22 . . 5.500 4.478 3.307 5.559 0.059 5 0 "[ . 1 . 2]" 1
830 1 44 GLN H 1 44 GLN HG2 . . 4.560 3.071 2.751 3.348 . 0 0 "[ . 1 . 2]" 1
831 1 44 GLN H 1 44 GLN HG3 . . 4.610 4.482 4.308 4.655 0.045 15 0 "[ . 1 . 2]" 1
832 1 44 GLN H 1 45 LEU H . . 3.850 2.856 2.633 3.094 . 0 0 "[ . 1 . 2]" 1
833 1 44 GLN H 1 45 LEU HA . . 5.500 5.450 5.352 5.572 0.072 14 0 "[ . 1 . 2]" 1
834 1 44 GLN H 1 45 LEU HG . . 4.960 4.482 4.135 4.746 . 0 0 "[ . 1 . 2]" 1
835 1 44 GLN HA 1 44 GLN HG2 . . 3.320 3.184 2.830 3.391 0.071 14 0 "[ . 1 . 2]" 1
836 1 44 GLN HA 1 44 GLN HG3 . . 3.840 3.791 3.709 3.909 0.069 4 0 "[ . 1 . 2]" 1
837 1 45 LEU H 1 45 LEU HB2 . . 4.140 2.603 2.417 2.832 . 0 0 "[ . 1 . 2]" 1
838 1 45 LEU H 1 45 LEU MD1 . . 4.430 3.560 3.200 4.003 . 0 0 "[ . 1 . 2]" 1
839 1 45 LEU H 1 45 LEU MD2 . . 4.220 3.336 2.828 4.019 . 0 0 "[ . 1 . 2]" 1
840 1 45 LEU H 1 45 LEU HG . . 3.330 2.307 1.875 2.917 . 0 0 "[ . 1 . 2]" 1
841 1 45 LEU H 1 46 ASN H . . 5.400 4.503 4.373 4.648 . 0 0 "[ . 1 . 2]" 1
842 1 45 LEU HA 1 45 LEU MD1 . . 4.320 3.922 3.873 3.987 . 0 0 "[ . 1 . 2]" 1
843 1 45 LEU HA 1 45 LEU MD2 . . 2.840 2.326 2.209 2.571 . 0 0 "[ . 1 . 2]" 1
844 1 45 LEU HA 1 45 LEU HG . . 4.140 3.216 2.851 3.418 . 0 0 "[ . 1 . 2]" 1
845 1 45 LEU HA 1 46 ASN H . . 2.910 2.473 2.189 2.772 . 0 0 "[ . 1 . 2]" 1
846 1 45 LEU HB2 1 46 ASN H . . 3.740 3.265 2.822 3.805 0.065 9 0 "[ . 1 . 2]" 1
847 1 45 LEU HB3 1 46 ASN H . . 3.630 2.275 1.852 2.782 . 0 0 "[ . 1 . 2]" 1
848 1 45 LEU HB3 1 46 ASN HD22 . . 5.500 5.385 5.149 5.668 0.168 8 0 "[ . 1 . 2]" 1
849 1 45 LEU MD1 1 46 ASN H . . 4.820 4.317 3.842 4.742 . 0 0 "[ . 1 . 2]" 1
850 1 45 LEU MD2 1 46 ASN H . . 4.050 3.670 3.467 3.960 . 0 0 "[ . 1 . 2]" 1
851 1 46 ASN H 1 46 ASN HD22 . . 4.970 3.780 3.337 4.397 . 0 0 "[ . 1 . 2]" 1
852 1 46 ASN H 1 47 ARG H . . 5.110 4.571 4.335 4.724 . 0 0 "[ . 1 . 2]" 1
853 1 46 ASN HA 1 46 ASN HD22 . . 5.500 5.001 4.548 5.443 . 0 0 "[ . 1 . 2]" 1
854 1 46 ASN HA 1 47 ARG H . . 3.290 2.471 2.310 2.664 . 0 0 "[ . 1 . 2]" 1
855 1 46 ASN HA 1 48 GLY H . . 5.410 4.149 3.865 4.464 . 0 0 "[ . 1 . 2]" 1
856 1 46 ASN QB 1 46 ASN HD22 . . 3.800 3.245 3.206 3.293 . 0 0 "[ . 1 . 2]" 1
857 1 46 ASN QB 1 47 ARG H . . 3.820 2.354 1.838 2.603 . 0 0 "[ . 1 . 2]" 1
858 1 46 ASN QB 1 47 ARG QB . . 4.810 4.235 3.944 4.544 . 0 0 "[ . 1 . 2]" 1
859 1 46 ASN QB 1 48 GLY H . . 4.700 2.588 2.070 3.543 . 0 0 "[ . 1 . 2]" 1
860 1 46 ASN HD21 1 47 ARG H . . 5.500 5.317 4.447 5.569 0.069 5 0 "[ . 1 . 2]" 1
861 1 46 ASN HD22 1 48 GLY H . . 5.500 4.950 3.756 5.579 0.079 3 0 "[ . 1 . 2]" 1
862 1 47 ARG H 1 47 ARG QB . . 3.690 2.457 2.224 2.650 . 0 0 "[ . 1 . 2]" 1
863 1 47 ARG H 1 47 ARG QD . . 5.180 4.404 3.723 4.956 . 0 0 "[ . 1 . 2]" 1
864 1 47 ARG H 1 47 ARG QG . . 3.620 2.712 2.372 3.259 . 0 0 "[ . 1 . 2]" 1
865 1 47 ARG H 1 48 GLY H . . 4.010 2.591 2.067 3.006 . 0 0 "[ . 1 . 2]" 1
866 1 47 ARG H 1 48 GLY HA2 . . 5.500 4.827 4.332 5.129 . 0 0 "[ . 1 . 2]" 1
867 1 47 ARG H 1 49 PHE H . . 5.110 3.857 3.445 4.393 . 0 0 "[ . 1 . 2]" 1
868 1 47 ARG HA 1 47 ARG QD . . 3.750 3.555 2.540 3.860 0.110 5 0 "[ . 1 . 2]" 1
869 1 47 ARG HA 1 47 ARG QG . . 3.240 2.456 2.095 2.940 . 0 0 "[ . 1 . 2]" 1
870 1 47 ARG HA 1 49 PHE H . . 5.500 4.722 4.441 5.010 . 0 0 "[ . 1 . 2]" 1
871 1 47 ARG QB 1 48 GLY H . . 5.250 3.446 3.164 3.837 . 0 0 "[ . 1 . 2]" 1
872 1 47 ARG QB 1 49 PHE H . . 5.500 3.226 2.902 3.599 . 0 0 "[ . 1 . 2]" 1
873 1 47 ARG QB 1 49 PHE QD . . 4.360 3.629 3.369 4.082 . 0 0 "[ . 1 . 2]" 1
874 1 47 ARG QB 1 49 PHE HZ . . 4.330 3.053 2.502 3.667 . 0 0 "[ . 1 . 2]" 1
875 1 47 ARG QD 1 49 PHE HZ . . 4.500 3.593 2.401 4.527 0.027 12 0 "[ . 1 . 2]" 1
876 1 47 ARG QG 1 48 GLY H . . 5.500 4.498 4.333 4.606 . 0 0 "[ . 1 . 2]" 1
877 1 47 ARG QG 1 49 PHE HZ . . 4.820 4.263 2.891 4.912 0.092 12 0 "[ . 1 . 2]" 1
878 1 48 GLY H 1 49 PHE H . . 3.810 2.638 2.377 3.061 . 0 0 "[ . 1 . 2]" 1
879 1 49 PHE H 1 50 ALA H . . 5.050 4.361 4.288 4.483 . 0 0 "[ . 1 . 2]" 1
880 1 49 PHE HA 1 50 ALA H . . 3.000 2.499 2.444 2.599 . 0 0 "[ . 1 . 2]" 1
881 1 49 PHE HA 1 50 ALA MB . . 4.640 3.913 3.665 4.132 . 0 0 "[ . 1 . 2]" 1
882 1 49 PHE QB 1 50 ALA H . . 3.510 2.392 2.235 2.528 . 0 0 "[ . 1 . 2]" 1
883 1 49 PHE QD 1 50 ALA H . . 5.270 3.488 3.042 3.786 . 0 0 "[ . 1 . 2]" 1
884 1 49 PHE QD 1 50 ALA HA . . 5.500 3.542 2.966 4.413 . 0 0 "[ . 1 . 2]" 1
885 1 50 ALA H 1 50 ALA MB . . 3.470 2.746 2.602 2.860 . 0 0 "[ . 1 . 2]" 1
886 1 50 ALA H 1 51 PHE H . . 4.390 4.360 4.309 4.410 0.020 3 0 "[ . 1 . 2]" 1
887 1 50 ALA HA 1 51 PHE H . . 3.070 2.483 2.351 2.587 . 0 0 "[ . 1 . 2]" 1
888 1 50 ALA MB 1 51 PHE H . . 3.180 2.367 2.081 2.570 . 0 0 "[ . 1 . 2]" 1
889 1 50 ALA MB 1 52 ILE HG13 . . 4.460 4.135 3.242 4.544 0.084 2 0 "[ . 1 . 2]" 1
890 1 51 PHE H 1 51 PHE HB2 . . 3.430 2.596 2.412 2.785 . 0 0 "[ . 1 . 2]" 1
891 1 51 PHE H 1 51 PHE QD . . 4.540 2.957 2.656 3.637 . 0 0 "[ . 1 . 2]" 1
892 1 51 PHE H 1 51 PHE QE . . 5.500 4.896 4.653 5.172 . 0 0 "[ . 1 . 2]" 1
893 1 51 PHE H 1 52 ILE H . . 4.240 4.239 3.956 4.329 0.089 3 0 "[ . 1 . 2]" 1
894 1 51 PHE H 1 52 ILE HG13 . . 4.820 4.623 3.799 4.896 0.076 6 0 "[ . 1 . 2]" 1
895 1 51 PHE HA 1 51 PHE QD . . 3.890 2.869 2.293 3.246 . 0 0 "[ . 1 . 2]" 1
896 1 51 PHE HA 1 51 PHE QE . . 4.840 4.744 4.440 4.921 0.081 8 0 "[ . 1 . 2]" 1
897 1 51 PHE HA 1 52 ILE H . . 2.840 2.229 2.150 2.309 . 0 0 "[ . 1 . 2]" 1
898 1 51 PHE HA 1 52 ILE HB . . 4.890 4.541 4.327 4.680 . 0 0 "[ . 1 . 2]" 1
899 1 51 PHE HA 1 52 ILE HG13 . . 5.360 3.892 3.483 4.333 . 0 0 "[ . 1 . 2]" 1
900 1 51 PHE HB3 1 52 ILE H . . 3.930 3.317 2.547 3.941 0.011 12 0 "[ . 1 . 2]" 1
901 1 51 PHE HB3 1 53 GLN HE21 . . 5.500 3.043 2.537 3.841 . 0 0 "[ . 1 . 2]" 1
902 1 51 PHE QD 1 52 ILE H . . 5.030 4.332 3.886 4.960 . 0 0 "[ . 1 . 2]" 1
903 1 51 PHE QD 1 53 GLN HE21 . . 5.500 4.817 4.358 5.507 0.007 5 0 "[ . 1 . 2]" 1
904 1 51 PHE QD 1 53 GLN HE22 . . 4.450 4.126 3.114 4.529 0.079 19 0 "[ . 1 . 2]" 1
905 1 52 ILE H 1 52 ILE HB . . 3.410 2.495 2.352 2.699 . 0 0 "[ . 1 . 2]" 1
906 1 52 ILE H 1 52 ILE MD . . 4.570 3.705 2.893 4.203 . 0 0 "[ . 1 . 2]" 1
907 1 52 ILE H 1 52 ILE HG12 . . 4.230 3.914 3.605 4.228 . 0 0 "[ . 1 . 2]" 1
908 1 52 ILE H 1 52 ILE HG13 . . 3.820 2.686 2.345 3.012 . 0 0 "[ . 1 . 2]" 1
909 1 52 ILE H 1 52 ILE MG . . 4.160 3.813 3.751 3.923 . 0 0 "[ . 1 . 2]" 1
910 1 52 ILE H 1 53 GLN H . . 5.070 4.400 4.092 4.636 . 0 0 "[ . 1 . 2]" 1
911 1 52 ILE HA 1 52 ILE MD . . 4.190 3.952 3.867 3.993 . 0 0 "[ . 1 . 2]" 1
912 1 52 ILE HA 1 52 ILE HG12 . . 3.800 2.744 2.527 3.082 . 0 0 "[ . 1 . 2]" 1
913 1 52 ILE HA 1 52 ILE HG13 . . 3.890 3.019 2.761 3.232 . 0 0 "[ . 1 . 2]" 1
914 1 52 ILE HA 1 52 ILE MG . . 3.170 2.453 2.357 2.604 . 0 0 "[ . 1 . 2]" 1
915 1 52 ILE HA 1 53 GLN H . . 2.820 2.239 2.140 2.460 . 0 0 "[ . 1 . 2]" 1
916 1 52 ILE HB 1 52 ILE MD . . 3.310 2.406 2.232 2.540 . 0 0 "[ . 1 . 2]" 1
917 1 52 ILE HB 1 53 GLN H . . 4.970 4.189 4.041 4.404 . 0 0 "[ . 1 . 2]" 1
918 1 52 ILE HB 1 53 GLN HE21 . . 5.270 4.934 4.574 5.346 0.076 13 0 "[ . 1 . 2]" 1
919 1 52 ILE MD 1 52 ILE MG . . 2.400 2.103 2.032 2.337 . 0 0 "[ . 1 . 2]" 1
920 1 52 ILE HG12 1 52 ILE MG . . 2.960 2.401 2.226 2.543 . 0 0 "[ . 1 . 2]" 1
921 1 52 ILE HG12 1 53 GLN H . . 4.710 4.659 4.461 4.787 0.077 20 0 "[ . 1 . 2]" 1
922 1 52 ILE MG 1 53 GLN H . . 3.290 2.758 2.538 3.093 . 0 0 "[ . 1 . 2]" 1
923 1 52 ILE MG 1 53 GLN HA . . 4.930 3.740 3.274 4.165 . 0 0 "[ . 1 . 2]" 1
924 1 52 ILE MG 1 54 LEU HG . . 2.990 2.434 2.096 3.088 0.098 7 0 "[ . 1 . 2]" 1
925 1 53 GLN H 1 53 GLN HB2 . . 3.500 2.586 2.310 3.676 0.176 20 0 "[ . 1 . 2]" 1
926 1 53 GLN H 1 53 GLN HB3 . . 3.570 3.585 3.358 3.651 0.081 8 0 "[ . 1 . 2]" 1
927 1 53 GLN H 1 53 GLN HE21 . . 5.500 3.264 2.016 4.092 . 0 0 "[ . 1 . 2]" 1
928 1 53 GLN H 1 53 GLN QG . . 4.030 3.747 2.598 4.055 0.025 13 0 "[ . 1 . 2]" 1
929 1 53 GLN H 1 54 LEU H . . 4.760 4.168 3.473 4.480 . 0 0 "[ . 1 . 2]" 1
930 1 53 GLN HA 1 53 GLN HE21 . . 5.500 3.020 2.353 3.688 . 0 0 "[ . 1 . 2]" 1
931 1 53 GLN HA 1 53 GLN HE22 . . 5.390 4.433 3.814 5.152 . 0 0 "[ . 1 . 2]" 1
932 1 53 GLN HA 1 53 GLN QG . . 3.370 2.478 2.235 3.473 0.103 20 0 "[ . 1 . 2]" 1
933 1 53 GLN HA 1 54 LEU H . . 2.770 2.203 2.133 2.275 . 0 0 "[ . 1 . 2]" 1
934 1 53 GLN HB3 1 53 GLN HE22 . . 5.030 4.909 3.628 5.112 0.082 2 0 "[ . 1 . 2]" 1
935 1 53 GLN HB3 1 54 LEU H . . 4.130 3.622 2.953 4.189 0.059 13 0 "[ . 1 . 2]" 1
936 1 53 GLN HE22 1 53 GLN QG . . 3.680 3.416 3.323 3.580 . 0 0 "[ . 1 . 2]" 1
937 1 53 GLN QG 1 54 LEU H . . 4.350 4.113 3.800 4.412 0.062 2 0 "[ . 1 . 2]" 1
938 1 54 LEU H 1 54 LEU HB2 . . 3.530 2.503 2.190 2.767 . 0 0 "[ . 1 . 2]" 1
939 1 54 LEU H 1 54 LEU HB3 . . 4.020 3.590 3.352 3.790 . 0 0 "[ . 1 . 2]" 1
940 1 54 LEU H 1 54 LEU MD1 . . 4.910 4.199 3.620 4.630 . 0 0 "[ . 1 . 2]" 1
941 1 54 LEU H 1 54 LEU MD2 . . 5.010 4.335 4.103 4.653 . 0 0 "[ . 1 . 2]" 1
942 1 54 LEU H 1 54 LEU HG . . 4.780 3.701 3.042 4.072 . 0 0 "[ . 1 . 2]" 1
943 1 54 LEU H 1 59 ALA H . . 5.260 5.186 4.745 5.329 0.069 10 0 "[ . 1 . 2]" 1
944 1 54 LEU H 1 59 ALA MB . . 3.770 3.185 2.683 3.501 . 0 0 "[ . 1 . 2]" 1
945 1 54 LEU HA 1 55 SER H . . 3.080 2.617 2.417 2.983 . 0 0 "[ . 1 . 2]" 1
946 1 54 LEU HA 1 59 ALA H . . 5.420 5.287 5.009 5.450 0.030 11 0 "[ . 1 . 2]" 1
947 1 54 LEU HA 1 59 ALA MB . . 4.410 4.420 4.084 4.511 0.101 2 0 "[ . 1 . 2]" 1
948 1 54 LEU HB2 1 55 SER H . . 3.800 3.616 3.122 3.844 0.044 3 0 "[ . 1 . 2]" 1
949 1 54 LEU HB2 1 58 GLU HB2 . . 4.200 4.102 3.266 4.280 0.080 15 0 "[ . 1 . 2]" 1
950 1 54 LEU HB2 1 59 ALA H . . 4.330 3.473 2.705 3.892 . 0 0 "[ . 1 . 2]" 1
951 1 54 LEU HB2 1 59 ALA HA . . 4.400 2.945 2.485 3.388 . 0 0 "[ . 1 . 2]" 1
952 1 54 LEU HB3 1 54 LEU MD2 . . 3.240 2.349 2.174 2.468 . 0 0 "[ . 1 . 2]" 1
953 1 54 LEU HB3 1 55 SER H . . 3.510 2.212 1.783 2.464 . 0 0 "[ . 1 . 2]" 1
954 1 54 LEU HB3 1 58 GLU HB2 . . 3.730 2.531 2.169 2.676 . 0 0 "[ . 1 . 2]" 1
955 1 54 LEU HB3 1 59 ALA H . . 3.940 2.786 2.579 3.458 . 0 0 "[ . 1 . 2]" 1
956 1 54 LEU HB3 1 59 ALA HA . . 4.830 3.334 2.988 4.348 . 0 0 "[ . 1 . 2]" 1
957 1 54 LEU MD1 1 55 SER H . . 4.980 4.077 3.506 4.415 . 0 0 "[ . 1 . 2]" 1
958 1 54 LEU MD1 1 58 GLU H . . 5.500 5.281 4.730 5.925 0.425 15 0 "[ . 1 . 2]" 1
959 1 54 LEU MD1 1 58 GLU HB2 . . 4.580 3.465 2.654 4.009 . 0 0 "[ . 1 . 2]" 1
960 1 54 LEU MD1 1 58 GLU HB3 . . 4.020 2.932 2.201 4.171 0.151 15 0 "[ . 1 . 2]" 1
961 1 54 LEU MD1 1 58 GLU HG3 . . 5.230 4.977 4.050 5.634 0.404 15 0 "[ . 1 . 2]" 1
962 1 54 LEU MD1 1 59 ALA H . . 4.520 3.564 3.281 3.967 . 0 0 "[ . 1 . 2]" 1
963 1 54 LEU MD1 1 59 ALA HA . . 3.230 2.265 2.112 2.572 . 0 0 "[ . 1 . 2]" 1
964 1 54 LEU MD1 1 59 ALA MB . . 3.760 3.065 2.265 3.352 . 0 0 "[ . 1 . 2]" 1
965 1 54 LEU MD2 1 55 SER H . . 4.430 2.709 2.064 3.354 . 0 0 "[ . 1 . 2]" 1
966 1 54 LEU MD2 1 58 GLU HB2 . . 4.530 3.000 2.131 3.963 . 0 0 "[ . 1 . 2]" 1
967 1 54 LEU MD2 1 59 ALA H . . 4.660 4.327 3.498 4.745 0.085 7 0 "[ . 1 . 2]" 1
968 1 54 LEU MD2 1 59 ALA HA . . 4.400 4.358 3.328 4.506 0.106 11 0 "[ . 1 . 2]" 1
969 1 55 SER H 1 55 SER QB . . 3.340 2.126 1.923 2.463 . 0 0 "[ . 1 . 2]" 1
970 1 55 SER H 1 58 GLU H . . 4.740 4.259 3.763 4.680 . 0 0 "[ . 1 . 2]" 1
971 1 55 SER H 1 58 GLU HB2 . . 3.970 2.471 1.926 2.943 . 0 0 "[ . 1 . 2]" 1
972 1 55 SER H 1 59 ALA H . . 4.580 3.781 2.880 4.232 . 0 0 "[ . 1 . 2]" 1
973 1 55 SER HA 1 56 THR H . . 3.210 2.401 2.221 2.575 . 0 0 "[ . 1 . 2]" 1
974 1 55 SER QB 1 56 THR H . . 3.820 3.087 2.579 3.536 . 0 0 "[ . 1 . 2]" 1
975 1 55 SER QB 1 57 ILE H . . 4.410 3.277 2.543 4.237 . 0 0 "[ . 1 . 2]" 1
976 1 55 SER QB 1 58 GLU H . . 5.070 2.365 2.079 2.947 . 0 0 "[ . 1 . 2]" 1
977 1 55 SER QB 1 58 GLU HA . . 4.530 4.312 4.075 4.502 . 0 0 "[ . 1 . 2]" 1
978 1 55 SER QB 1 58 GLU HB2 . . 5.010 2.303 2.081 2.710 . 0 0 "[ . 1 . 2]" 1
979 1 55 SER QB 1 58 GLU HG3 . . 3.410 2.149 1.982 2.447 . 0 0 "[ . 1 . 2]" 1
980 1 55 SER QB 1 59 ALA H . . 5.500 3.720 3.426 4.101 . 0 0 "[ . 1 . 2]" 1
981 1 56 THR H 1 56 THR HB . . 3.910 3.099 2.306 3.596 . 0 0 "[ . 1 . 2]" 1
982 1 56 THR H 1 56 THR MG . . 3.700 2.809 1.916 3.716 0.016 15 0 "[ . 1 . 2]" 1
983 1 56 THR H 1 57 ILE H . . 3.940 2.963 2.721 3.190 . 0 0 "[ . 1 . 2]" 1
984 1 56 THR H 1 57 ILE MD . . 5.500 5.358 4.659 5.601 0.101 8 0 "[ . 1 . 2]" 1
985 1 56 THR H 1 59 ALA H . . 5.500 4.915 4.694 5.340 . 0 0 "[ . 1 . 2]" 1
986 1 56 THR H 1 59 ALA MB . . 5.500 4.934 4.564 5.578 0.078 1 0 "[ . 1 . 2]" 1
987 1 56 THR HA 1 59 ALA MB . . 4.590 3.489 2.722 4.679 0.089 18 0 "[ . 1 . 2]" 1
988 1 56 THR HB 1 57 ILE H . . 3.860 2.902 2.146 3.939 0.079 16 0 "[ . 1 . 2]" 1
989 1 56 THR MG 1 57 ILE H . . 3.870 3.699 3.052 3.964 0.094 16 0 "[ . 1 . 2]" 1
990 1 57 ILE H 1 57 ILE HB . . 3.020 2.560 2.441 2.782 . 0 0 "[ . 1 . 2]" 1
991 1 57 ILE H 1 57 ILE MD . . 4.130 3.351 2.505 3.976 . 0 0 "[ . 1 . 2]" 1
992 1 57 ILE H 1 57 ILE HG12 . . 3.570 2.788 1.844 3.828 0.258 1 0 "[ . 1 . 2]" 1
993 1 57 ILE H 1 57 ILE HG13 . . 3.770 2.788 1.959 3.651 . 0 0 "[ . 1 . 2]" 1
994 1 57 ILE H 1 57 ILE MG . . 3.800 3.783 3.740 3.875 0.075 16 0 "[ . 1 . 2]" 1
995 1 57 ILE H 1 58 GLU H . . 3.560 2.589 1.957 3.074 . 0 0 "[ . 1 . 2]" 1
996 1 57 ILE H 1 59 ALA H . . 4.880 4.356 3.763 4.574 . 0 0 "[ . 1 . 2]" 1
997 1 57 ILE HA 1 57 ILE MD . . 3.770 3.130 2.110 3.863 0.093 3 0 "[ . 1 . 2]" 1
998 1 57 ILE HA 1 57 ILE HG12 . . 3.860 2.878 2.489 3.510 . 0 0 "[ . 1 . 2]" 1
999 1 57 ILE HA 1 57 ILE HG13 . . 3.530 3.419 2.980 3.902 0.372 9 0 "[ . 1 . 2]" 1
1000 1 57 ILE HA 1 57 ILE MG . . 3.270 2.383 2.275 2.464 . 0 0 "[ . 1 . 2]" 1
1001 1 57 ILE HA 1 60 ALA H . . 4.120 3.718 3.351 4.179 0.059 17 0 "[ . 1 . 2]" 1
1002 1 57 ILE HA 1 60 ALA MB . . 3.650 2.781 2.366 3.276 . 0 0 "[ . 1 . 2]" 1
1003 1 57 ILE HB 1 57 ILE MD . . 3.620 2.806 2.367 3.306 . 0 0 "[ . 1 . 2]" 1
1004 1 57 ILE HB 1 58 GLU H . . 3.370 2.630 2.301 3.062 . 0 0 "[ . 1 . 2]" 1
1005 1 57 ILE HB 1 58 GLU HG2 . . 4.090 3.598 3.215 4.163 0.073 2 0 "[ . 1 . 2]" 1
1006 1 57 ILE MD 1 57 ILE MG . . 2.400 2.121 2.042 2.237 . 0 0 "[ . 1 . 2]" 1
1007 1 57 ILE HG12 1 58 GLU H . . 4.770 4.574 3.822 5.122 0.352 8 0 "[ . 1 . 2]" 1
1008 1 57 ILE HG13 1 57 ILE MG . . 3.480 2.828 2.234 3.291 . 0 0 "[ . 1 . 2]" 1
1009 1 57 ILE HG13 1 58 GLU H . . 5.070 4.498 4.064 5.133 0.063 12 0 "[ . 1 . 2]" 1
1010 1 57 ILE MG 1 58 GLU H . . 3.680 3.544 3.122 3.769 0.089 1 0 "[ . 1 . 2]" 1
1011 1 57 ILE MG 1 58 GLU HA . . 4.250 3.560 3.070 4.027 . 0 0 "[ . 1 . 2]" 1
1012 1 57 ILE MG 1 58 GLU HG2 . . 4.860 4.175 3.662 4.653 . 0 0 "[ . 1 . 2]" 1
1013 1 57 ILE MG 1 60 ALA H . . 5.500 4.893 4.659 5.105 . 0 0 "[ . 1 . 2]" 1
1014 1 57 ILE MG 1 61 GLN H . . 5.120 3.792 3.614 3.998 . 0 0 "[ . 1 . 2]" 1
1015 1 57 ILE MG 1 61 GLN HE21 . . 4.790 2.731 1.888 3.362 . 0 0 "[ . 1 . 2]" 1
1016 1 57 ILE MG 1 61 GLN HE22 . . 4.920 3.089 2.691 3.744 . 0 0 "[ . 1 . 2]" 1
1017 1 57 ILE MG 1 61 GLN HG3 . . 4.530 2.427 2.125 3.190 . 0 0 "[ . 1 . 2]" 1
1018 1 58 GLU H 1 58 GLU HB2 . . 3.620 2.505 2.315 2.723 . 0 0 "[ . 1 . 2]" 1
1019 1 58 GLU H 1 58 GLU HB3 . . 3.710 3.596 3.535 3.657 . 0 0 "[ . 1 . 2]" 1
1020 1 58 GLU H 1 58 GLU HG2 . . 3.440 2.419 1.916 3.316 . 0 0 "[ . 1 . 2]" 1
1021 1 58 GLU H 1 58 GLU HG3 . . 3.570 3.198 2.092 3.632 0.062 19 0 "[ . 1 . 2]" 1
1022 1 58 GLU H 1 59 ALA H . . 3.340 2.833 2.685 2.944 . 0 0 "[ . 1 . 2]" 1
1023 1 58 GLU H 1 59 ALA MB . . 4.470 4.429 4.304 4.544 0.074 17 0 "[ . 1 . 2]" 1
1024 1 58 GLU HA 1 58 GLU HG2 . . 3.410 2.781 2.208 3.242 . 0 0 "[ . 1 . 2]" 1
1025 1 58 GLU HA 1 61 GLN HE21 . . 5.500 2.990 2.101 5.559 0.059 14 0 "[ . 1 . 2]" 1
1026 1 58 GLU HA 1 61 GLN HE22 . . 5.500 4.283 3.429 5.578 0.078 15 0 "[ . 1 . 2]" 1
1027 1 58 GLU HB2 1 59 ALA H . . 3.740 2.480 2.370 2.654 . 0 0 "[ . 1 . 2]" 1
1028 1 58 GLU HB2 1 60 ALA H . . 5.500 5.103 4.945 5.271 . 0 0 "[ . 1 . 2]" 1
1029 1 58 GLU HB3 1 59 ALA H . . 4.040 3.479 3.031 3.717 . 0 0 "[ . 1 . 2]" 1
1030 1 58 GLU HG2 1 59 ALA H . . 4.790 4.452 4.049 4.867 0.077 3 0 "[ . 1 . 2]" 1
1031 1 58 GLU HG3 1 59 ALA H . . 4.650 4.633 4.259 4.729 0.079 1 0 "[ . 1 . 2]" 1
1032 1 59 ALA H 1 59 ALA MB . . 2.950 2.214 2.121 2.264 . 0 0 "[ . 1 . 2]" 1
1033 1 59 ALA H 1 60 ALA H . . 3.580 2.817 2.646 2.953 . 0 0 "[ . 1 . 2]" 1
1034 1 59 ALA H 1 61 GLN H . . 4.870 4.353 4.207 4.469 . 0 0 "[ . 1 . 2]" 1
1035 1 59 ALA H 1 62 LEU H . . 5.370 4.917 4.816 5.060 . 0 0 "[ . 1 . 2]" 1
1036 1 59 ALA HA 1 62 LEU H . . 4.290 4.057 3.889 4.294 0.004 8 0 "[ . 1 . 2]" 1
1037 1 59 ALA HA 1 62 LEU QB . . 4.230 3.176 2.758 3.639 . 0 0 "[ . 1 . 2]" 1
1038 1 59 ALA MB 1 60 ALA H . . 3.170 2.292 2.146 2.590 . 0 0 "[ . 1 . 2]" 1
1039 1 60 ALA H 1 60 ALA MB . . 2.860 2.207 2.159 2.249 . 0 0 "[ . 1 . 2]" 1
1040 1 60 ALA H 1 62 LEU H . . 5.200 4.512 4.332 4.721 . 0 0 "[ . 1 . 2]" 1
1041 1 60 ALA H 1 63 LEU H . . 5.500 4.871 4.734 4.986 . 0 0 "[ . 1 . 2]" 1
1042 1 60 ALA HA 1 63 LEU H . . 3.840 3.866 3.719 3.913 0.073 10 0 "[ . 1 . 2]" 1
1043 1 60 ALA HA 1 63 LEU QB . . 3.790 2.906 2.591 3.226 . 0 0 "[ . 1 . 2]" 1
1044 1 60 ALA HA 1 64 GLN H . . 4.670 4.381 4.018 4.743 0.073 11 0 "[ . 1 . 2]" 1
1045 1 60 ALA HA 1 84 PHE HE1 . . 3.820 3.330 2.429 3.896 0.076 11 0 "[ . 1 . 2]" 1
1046 1 60 ALA MB 1 61 GLN H . . 3.230 2.473 2.270 2.843 . 0 0 "[ . 1 . 2]" 1
1047 1 60 ALA MB 1 61 GLN HA . . 4.680 3.875 3.715 4.108 . 0 0 "[ . 1 . 2]" 1
1048 1 60 ALA MB 1 61 GLN HE21 . . 5.500 5.320 2.573 5.592 0.092 17 0 "[ . 1 . 2]" 1
1049 1 60 ALA MB 1 84 PHE HE1 . . 4.350 3.767 2.638 4.408 0.058 6 0 "[ . 1 . 2]" 1
1050 1 61 GLN H 1 61 GLN HB2 . . 3.190 2.376 2.253 2.632 . 0 0 "[ . 1 . 2]" 1
1051 1 61 GLN H 1 61 GLN HB3 . . 3.570 3.584 3.539 3.615 0.045 13 0 "[ . 1 . 2]" 1
1052 1 61 GLN H 1 61 GLN HG2 . . 3.690 3.580 2.554 3.756 0.066 10 0 "[ . 1 . 2]" 1
1053 1 61 GLN H 1 61 GLN HG3 . . 3.680 2.616 2.333 3.773 0.093 15 0 "[ . 1 . 2]" 1
1054 1 61 GLN H 1 62 LEU H . . 3.390 2.807 2.623 2.980 . 0 0 "[ . 1 . 2]" 1
1055 1 61 GLN H 1 62 LEU QB . . 5.160 4.438 4.229 4.672 . 0 0 "[ . 1 . 2]" 1
1056 1 61 GLN H 1 63 LEU H . . 4.750 4.253 4.105 4.389 . 0 0 "[ . 1 . 2]" 1
1057 1 61 GLN HA 1 61 GLN HB3 . . 2.760 2.563 2.383 2.629 . 0 0 "[ . 1 . 2]" 1
1058 1 61 GLN HA 1 61 GLN HG2 . . 3.440 2.466 2.240 3.629 0.189 15 0 "[ . 1 . 2]" 1
1059 1 61 GLN HA 1 61 GLN HG3 . . 3.570 3.035 2.852 3.494 . 0 0 "[ . 1 . 2]" 1
1060 1 61 GLN HA 1 64 GLN H . . 3.790 3.726 3.299 3.871 0.081 10 0 "[ . 1 . 2]" 1
1061 1 61 GLN HB2 1 61 GLN HG3 . . 2.950 2.494 2.425 2.680 . 0 0 "[ . 1 . 2]" 1
1062 1 61 GLN HB2 1 62 LEU H . . 3.610 2.419 2.252 2.730 . 0 0 "[ . 1 . 2]" 1
1063 1 61 GLN HB3 1 62 LEU H . . 3.780 3.245 3.082 3.583 . 0 0 "[ . 1 . 2]" 1
1064 1 61 GLN HB3 1 65 ILE MD . . 4.850 3.425 2.437 3.827 . 0 0 "[ . 1 . 2]" 1
1065 1 61 GLN HG2 1 62 LEU H . . 5.260 4.878 4.186 5.071 . 0 0 "[ . 1 . 2]" 1
1066 1 61 GLN HG2 1 65 ILE MD . . 5.500 5.283 4.253 6.111 0.611 15 1 "[ . 1 + 2]" 1
1067 1 61 GLN HG3 1 62 LEU H . . 4.840 4.513 4.360 4.931 0.091 15 0 "[ . 1 . 2]" 1
1068 1 62 LEU H 1 62 LEU QB . . 3.240 2.127 2.037 2.204 . 0 0 "[ . 1 . 2]" 1
1069 1 62 LEU H 1 62 LEU HG . . 4.740 4.452 4.231 4.592 . 0 0 "[ . 1 . 2]" 1
1070 1 62 LEU H 1 63 LEU H . . 3.430 2.801 2.583 2.945 . 0 0 "[ . 1 . 2]" 1
1071 1 62 LEU H 1 64 GLN H . . 4.500 4.345 4.118 4.554 0.054 9 0 "[ . 1 . 2]" 1
1072 1 62 LEU H 1 65 ILE H . . 5.500 5.026 4.826 5.206 . 0 0 "[ . 1 . 2]" 1
1073 1 62 LEU H 1 65 ILE MD . . 5.460 4.213 3.632 4.583 . 0 0 "[ . 1 . 2]" 1
1074 1 62 LEU HA 1 62 LEU QD . . 2.910 2.172 1.995 2.860 . 0 0 "[ . 1 . 2]" 1
1075 1 62 LEU HA 1 62 LEU HG . . 3.690 3.617 2.429 3.751 0.061 11 0 "[ . 1 . 2]" 1
1076 1 62 LEU HA 1 65 ILE H . . 3.860 3.511 3.317 3.765 . 0 0 "[ . 1 . 2]" 1
1077 1 62 LEU HA 1 65 ILE HB . . 3.340 3.051 2.655 3.401 0.061 10 0 "[ . 1 . 2]" 1
1078 1 62 LEU HA 1 65 ILE MD . . 3.550 2.214 2.094 2.514 . 0 0 "[ . 1 . 2]" 1
1079 1 62 LEU HA 1 65 ILE HG13 . . 4.900 3.182 2.502 3.972 . 0 0 "[ . 1 . 2]" 1
1080 1 62 LEU HA 1 65 ILE MG . . 4.870 4.251 4.003 4.582 . 0 0 "[ . 1 . 2]" 1
1081 1 62 LEU HA 1 66 LEU H . . 4.550 4.396 3.888 4.627 0.077 15 0 "[ . 1 . 2]" 1
1082 1 62 LEU QB 1 63 LEU H . . 3.950 2.575 2.453 2.668 . 0 0 "[ . 1 . 2]" 1
1083 1 62 LEU QD 1 65 ILE H . . 5.190 4.005 3.783 4.631 . 0 0 "[ . 1 . 2]" 1
1084 1 62 LEU QD 1 66 LEU H . . 4.340 3.334 2.926 3.731 . 0 0 "[ . 1 . 2]" 1
1085 1 62 LEU QD 1 66 LEU QD . . 3.510 1.856 1.667 1.935 . 0 0 "[ . 1 . 2]" 1
1086 1 62 LEU QD 1 66 LEU HG . . 3.880 3.190 2.014 3.955 0.075 6 0 "[ . 1 . 2]" 1
1087 1 62 LEU HG 1 63 LEU H . . 4.740 4.751 3.948 4.825 0.085 4 0 "[ . 1 . 2]" 1
1088 1 62 LEU HG 1 63 LEU HA . . 5.430 5.437 4.099 5.521 0.091 7 0 "[ . 1 . 2]" 1
1089 1 63 LEU H 1 63 LEU QB . . 3.170 2.212 2.167 2.264 . 0 0 "[ . 1 . 2]" 1
1090 1 63 LEU H 1 63 LEU QD . . 4.210 3.734 3.683 3.805 . 0 0 "[ . 1 . 2]" 1
1091 1 63 LEU H 1 63 LEU HG . . 4.410 4.463 4.437 4.480 0.070 18 0 "[ . 1 . 2]" 1
1092 1 63 LEU H 1 64 GLN H . . 3.320 2.831 2.668 2.988 . 0 0 "[ . 1 . 2]" 1
1093 1 63 LEU H 1 64 GLN HB2 . . 4.990 5.035 4.924 5.071 0.081 14 0 "[ . 1 . 2]" 1
1094 1 63 LEU H 1 64 GLN HE21 . . 5.370 5.090 4.083 5.449 0.079 4 0 "[ . 1 . 2]" 1
1095 1 63 LEU H 1 65 ILE H . . 4.450 4.251 4.128 4.382 . 0 0 "[ . 1 . 2]" 1
1096 1 63 LEU HA 1 63 LEU QD . . 3.140 2.597 2.329 3.011 . 0 0 "[ . 1 . 2]" 1
1097 1 63 LEU HA 1 63 LEU HG . . 3.860 2.859 2.423 3.788 . 0 0 "[ . 1 . 2]" 1
1098 1 63 LEU HA 1 65 ILE H . . 5.150 4.287 4.047 4.683 . 0 0 "[ . 1 . 2]" 1
1099 1 63 LEU HA 1 66 LEU HB2 . . 3.610 2.970 2.211 3.582 . 0 0 "[ . 1 . 2]" 1
1100 1 63 LEU HA 1 66 LEU QD . . 4.280 2.852 2.306 3.430 . 0 0 "[ . 1 . 2]" 1
1101 1 63 LEU HA 1 66 LEU HG . . 4.810 4.168 2.991 4.899 0.089 1 0 "[ . 1 . 2]" 1
1102 1 63 LEU HA 1 67 GLN HG3 . . 5.260 4.234 3.694 4.976 . 0 0 "[ . 1 . 2]" 1
1103 1 63 LEU HA 1 82 VAL MG1 . . 4.190 3.788 3.436 4.244 0.054 10 0 "[ . 1 . 2]" 1
1104 1 63 LEU QB 1 64 GLN H . . 3.420 2.553 2.313 2.762 . 0 0 "[ . 1 . 2]" 1
1105 1 63 LEU QB 1 64 GLN QG . . 4.330 3.452 2.903 4.158 . 0 0 "[ . 1 . 2]" 1
1106 1 63 LEU QD 1 64 GLN H . . 4.760 3.442 2.833 3.833 . 0 0 "[ . 1 . 2]" 1
1107 1 63 LEU QD 1 64 GLN HA . . 4.080 3.386 2.032 3.955 . 0 0 "[ . 1 . 2]" 1
1108 1 63 LEU QD 1 64 GLN HE21 . . 5.500 3.077 1.764 5.254 . 0 0 "[ . 1 . 2]" 1
1109 1 63 LEU QD 1 64 GLN QG . . 5.500 3.264 2.347 4.389 . 0 0 "[ . 1 . 2]" 1
1110 1 63 LEU QD 1 67 GLN HE21 . . 4.820 2.362 1.752 3.031 . 0 0 "[ . 1 . 2]" 1
1111 1 63 LEU QD 1 67 GLN HE22 . . 4.720 2.595 2.057 3.304 . 0 0 "[ . 1 . 2]" 1
1112 1 63 LEU QD 1 67 GLN HG2 . . 4.870 3.774 2.146 4.290 . 0 0 "[ . 1 . 2]" 1
1113 1 63 LEU QD 1 67 GLN HG3 . . 4.090 3.060 1.924 3.556 . 0 0 "[ . 1 . 2]" 1
1114 1 63 LEU QD 1 82 VAL HB . . 4.390 3.883 3.257 4.306 . 0 0 "[ . 1 . 2]" 1
1115 1 63 LEU QD 1 82 VAL MG1 . . 3.100 2.119 1.966 2.328 . 0 0 "[ . 1 . 2]" 1
1116 1 63 LEU QD 1 83 GLU HA . . 4.000 3.895 3.472 3.976 . 0 0 "[ . 1 . 2]" 1
1117 1 63 LEU QD 1 84 PHE H . . 4.530 3.904 3.020 4.200 . 0 0 "[ . 1 . 2]" 1
1118 1 63 LEU QD 1 84 PHE HA . . 5.040 3.076 2.281 3.623 . 0 0 "[ . 1 . 2]" 1
1119 1 63 LEU QD 1 84 PHE HB2 . . 4.540 2.028 1.914 2.250 . 0 0 "[ . 1 . 2]" 1
1120 1 63 LEU QD 1 84 PHE HB3 . . 3.520 3.046 2.821 3.247 . 0 0 "[ . 1 . 2]" 1
1121 1 63 LEU QD 1 84 PHE HD1 . . 3.750 2.718 2.249 3.620 . 0 0 "[ . 1 . 2]" 1
1122 1 63 LEU HG 1 64 GLN H . . 5.060 4.024 3.513 4.505 . 0 0 "[ . 1 . 2]" 1
1123 1 63 LEU HG 1 64 GLN HA . . 4.690 3.983 3.288 4.795 0.105 18 0 "[ . 1 . 2]" 1
1124 1 63 LEU HG 1 67 GLN HE21 . . 5.500 3.077 2.190 4.199 . 0 0 "[ . 1 . 2]" 1
1125 1 63 LEU HG 1 67 GLN HE22 . . 5.500 3.867 2.868 5.573 0.073 17 0 "[ . 1 . 2]" 1
1126 1 63 LEU HG 1 67 GLN HG2 . . 4.780 4.127 2.837 4.839 0.059 18 0 "[ . 1 . 2]" 1
1127 1 63 LEU HG 1 67 GLN HG3 . . 4.160 2.845 2.189 4.231 0.071 17 0 "[ . 1 . 2]" 1
1128 1 64 GLN H 1 64 GLN HB2 . . 2.780 2.467 2.318 2.671 . 0 0 "[ . 1 . 2]" 1
1129 1 64 GLN H 1 64 GLN QG . . 3.620 2.387 2.073 2.590 . 0 0 "[ . 1 . 2]" 1
1130 1 64 GLN H 1 65 ILE H . . 3.350 2.677 2.490 2.780 . 0 0 "[ . 1 . 2]" 1
1131 1 64 GLN H 1 65 ILE MD . . 5.070 5.102 4.974 5.148 0.078 7 0 "[ . 1 . 2]" 1
1132 1 64 GLN H 1 66 LEU H . . 5.380 4.516 4.157 4.900 . 0 0 "[ . 1 . 2]" 1
1133 1 64 GLN H 1 67 GLN H . . 5.400 4.897 4.664 5.177 . 0 0 "[ . 1 . 2]" 1
1134 1 64 GLN HA 1 64 GLN QG . . 3.680 2.792 2.363 3.311 . 0 0 "[ . 1 . 2]" 1
1135 1 64 GLN HA 1 67 GLN H . . 3.820 3.362 2.947 3.688 . 0 0 "[ . 1 . 2]" 1
1136 1 64 GLN HA 1 67 GLN HB2 . . 4.180 2.574 2.132 3.384 . 0 0 "[ . 1 . 2]" 1
1137 1 64 GLN HA 1 67 GLN HE21 . . 5.500 5.534 5.241 5.591 0.091 3 0 "[ . 1 . 2]" 1
1138 1 64 GLN HB2 1 64 GLN HE22 . . 5.500 4.556 3.351 5.259 . 0 0 "[ . 1 . 2]" 1
1139 1 64 GLN HB2 1 64 GLN QG . . 2.730 2.255 2.116 2.420 . 0 0 "[ . 1 . 2]" 1
1140 1 64 GLN HB2 1 65 ILE H . . 3.170 2.823 2.356 3.138 . 0 0 "[ . 1 . 2]" 1
1141 1 64 GLN HB2 1 65 ILE HA . . 5.000 4.466 4.119 4.744 . 0 0 "[ . 1 . 2]" 1
1142 1 64 GLN HB2 1 65 ILE HG13 . . 3.710 3.511 3.019 3.780 0.070 6 0 "[ . 1 . 2]" 1
1143 1 64 GLN HE21 1 65 ILE H . . 5.370 5.164 4.661 5.449 0.079 16 0 "[ . 1 . 2]" 1
1144 1 64 GLN QG 1 65 ILE H . . 5.140 4.211 3.918 4.380 . 0 0 "[ . 1 . 2]" 1
1145 1 65 ILE H 1 65 ILE HB . . 3.010 2.554 2.461 2.664 . 0 0 "[ . 1 . 2]" 1
1146 1 65 ILE H 1 65 ILE MD . . 3.850 3.528 3.356 3.643 . 0 0 "[ . 1 . 2]" 1
1147 1 65 ILE H 1 65 ILE HG12 . . 3.930 3.460 3.116 3.685 . 0 0 "[ . 1 . 2]" 1
1148 1 65 ILE H 1 65 ILE HG13 . . 3.330 2.151 1.959 2.285 . 0 0 "[ . 1 . 2]" 1
1149 1 65 ILE H 1 65 ILE MG . . 3.950 3.811 3.768 3.882 . 0 0 "[ . 1 . 2]" 1
1150 1 65 ILE H 1 66 LEU H . . 3.350 2.793 2.560 3.159 . 0 0 "[ . 1 . 2]" 1
1151 1 65 ILE H 1 66 LEU QD . . 5.500 4.175 3.657 5.083 . 0 0 "[ . 1 . 2]" 1
1152 1 65 ILE H 1 67 GLN H . . 4.750 3.921 3.714 4.350 . 0 0 "[ . 1 . 2]" 1
1153 1 65 ILE H 1 68 ALA MB . . 5.380 5.042 4.564 5.439 0.059 10 0 "[ . 1 . 2]" 1
1154 1 65 ILE HA 1 65 ILE MD . . 3.920 3.919 3.863 3.961 0.041 10 0 "[ . 1 . 2]" 1
1155 1 65 ILE HA 1 65 ILE HG12 . . 3.530 2.645 2.513 2.769 . 0 0 "[ . 1 . 2]" 1
1156 1 65 ILE HA 1 65 ILE HG13 . . 3.620 3.018 2.866 3.248 . 0 0 "[ . 1 . 2]" 1
1157 1 65 ILE HA 1 65 ILE MG . . 3.220 2.451 2.342 2.561 . 0 0 "[ . 1 . 2]" 1
1158 1 65 ILE HA 1 67 GLN H . . 4.380 4.053 3.815 4.380 . 0 0 "[ . 1 . 2]" 1
1159 1 65 ILE HA 1 68 ALA H . . 4.700 3.992 3.461 4.335 . 0 0 "[ . 1 . 2]" 1
1160 1 65 ILE HA 1 68 ALA MB . . 3.670 3.102 2.310 3.750 0.080 6 0 "[ . 1 . 2]" 1
1161 1 65 ILE HB 1 65 ILE MD . . 3.500 2.359 2.245 2.469 . 0 0 "[ . 1 . 2]" 1
1162 1 65 ILE HB 1 66 LEU H . . 2.940 2.441 2.210 2.690 . 0 0 "[ . 1 . 2]" 1
1163 1 65 ILE MD 1 65 ILE MG . . 2.960 2.113 2.074 2.147 . 0 0 "[ . 1 . 2]" 1
1164 1 65 ILE MD 1 66 LEU H . . 4.530 4.388 4.190 4.571 0.041 17 0 "[ . 1 . 2]" 1
1165 1 65 ILE HG12 1 65 ILE MG . . 3.410 2.401 2.304 2.585 . 0 0 "[ . 1 . 2]" 1
1166 1 65 ILE HG13 1 66 LEU H . . 4.810 4.246 3.895 4.505 . 0 0 "[ . 1 . 2]" 1
1167 1 65 ILE MG 1 66 LEU H . . 3.730 3.282 3.003 3.567 . 0 0 "[ . 1 . 2]" 1
1168 1 65 ILE MG 1 66 LEU HA . . 4.030 3.612 3.335 3.863 . 0 0 "[ . 1 . 2]" 1
1169 1 65 ILE MG 1 66 LEU QD . . 3.490 2.948 2.518 3.557 0.067 14 0 "[ . 1 . 2]" 1
1170 1 65 ILE MG 1 67 GLN H . . 4.880 4.842 4.582 4.962 0.082 8 0 "[ . 1 . 2]" 1
1171 1 66 LEU H 1 66 LEU HB2 . . 3.300 2.508 2.254 2.786 . 0 0 "[ . 1 . 2]" 1
1172 1 66 LEU H 1 66 LEU HB3 . . 3.650 3.615 3.510 3.674 0.024 17 0 "[ . 1 . 2]" 1
1173 1 66 LEU H 1 66 LEU QD . . 3.630 2.353 1.888 3.110 . 0 0 "[ . 1 . 2]" 1
1174 1 66 LEU H 1 67 GLN HG3 . . 5.500 4.840 4.487 5.577 0.077 6 0 "[ . 1 . 2]" 1
1175 1 66 LEU H 1 68 ALA H . . 5.180 4.427 4.220 4.569 . 0 0 "[ . 1 . 2]" 1
1176 1 66 LEU H 1 69 LEU QD . . 4.870 3.708 3.250 4.021 . 0 0 "[ . 1 . 2]" 1
1177 1 66 LEU HA 1 66 LEU QD . . 2.910 2.108 1.999 2.337 . 0 0 "[ . 1 . 2]" 1
1178 1 66 LEU HA 1 69 LEU H . . 4.180 3.812 3.469 4.259 0.079 1 0 "[ . 1 . 2]" 1
1179 1 66 LEU HA 1 69 LEU QD . . 3.350 2.117 1.739 2.865 . 0 0 "[ . 1 . 2]" 1
1180 1 66 LEU HA 1 69 LEU HG . . 3.110 2.533 2.155 3.208 0.098 10 0 "[ . 1 . 2]" 1
1181 1 66 LEU HB2 1 67 GLN H . . 3.680 3.187 2.622 3.530 . 0 0 "[ . 1 . 2]" 1
1182 1 66 LEU HB3 1 67 GLN H . . 3.990 3.926 3.524 4.061 0.071 5 0 "[ . 1 . 2]" 1
1183 1 67 GLN H 1 67 GLN HB2 . . 3.420 2.416 2.304 2.640 . 0 0 "[ . 1 . 2]" 1
1184 1 67 GLN H 1 67 GLN HG2 . . 3.830 3.534 2.479 3.892 0.062 2 0 "[ . 1 . 2]" 1
1185 1 67 GLN H 1 67 GLN HG3 . . 3.480 2.920 2.551 3.560 0.080 18 0 "[ . 1 . 2]" 1
1186 1 67 GLN H 1 68 ALA H . . 3.290 2.583 2.275 2.925 . 0 0 "[ . 1 . 2]" 1
1187 1 67 GLN H 1 68 ALA HA . . 5.450 5.113 4.846 5.418 . 0 0 "[ . 1 . 2]" 1
1188 1 67 GLN H 1 68 ALA MB . . 4.380 3.934 3.603 4.441 0.061 15 0 "[ . 1 . 2]" 1
1189 1 67 GLN H 1 69 LEU H . . 4.870 4.335 3.892 4.744 . 0 0 "[ . 1 . 2]" 1
1190 1 67 GLN H 1 69 LEU QD . . 4.580 4.136 3.414 4.469 . 0 0 "[ . 1 . 2]" 1
1191 1 67 GLN HA 1 67 GLN HE21 . . 5.500 4.892 4.356 5.253 . 0 0 "[ . 1 . 2]" 1
1192 1 67 GLN HA 1 67 GLN HG2 . . 3.210 2.429 2.272 2.923 . 0 0 "[ . 1 . 2]" 1
1193 1 67 GLN HA 1 67 GLN HG3 . . 3.650 3.187 2.808 3.729 0.079 18 0 "[ . 1 . 2]" 1
1194 1 67 GLN HA 1 68 ALA HA . . 4.450 4.482 4.272 4.541 0.091 16 0 "[ . 1 . 2]" 1
1195 1 67 GLN HA 1 68 ALA MB . . 5.500 4.665 4.540 4.957 . 0 0 "[ . 1 . 2]" 1
1196 1 67 GLN HB3 1 68 ALA H . . 4.350 4.348 3.979 4.428 0.078 2 0 "[ . 1 . 2]" 1
1197 1 67 GLN HB3 1 68 ALA MB . . 5.400 4.618 4.272 5.024 . 0 0 "[ . 1 . 2]" 1
1198 1 67 GLN HE21 1 82 VAL HB . . 5.500 3.772 3.166 5.422 . 0 0 "[ . 1 . 2]" 1
1199 1 67 GLN HE21 1 82 VAL MG1 . . 5.480 3.200 2.438 4.269 . 0 0 "[ . 1 . 2]" 1
1200 1 67 GLN HE21 1 83 GLU HA . . 5.260 4.549 3.648 5.325 0.065 3 0 "[ . 1 . 2]" 1
1201 1 67 GLN HE21 1 84 PHE H . . 5.500 5.434 4.572 5.583 0.083 16 0 "[ . 1 . 2]" 1
1202 1 67 GLN HE22 1 67 GLN HG2 . . 3.600 3.632 3.528 3.702 0.102 6 0 "[ . 1 . 2]" 1
1203 1 67 GLN HE22 1 67 GLN HG3 . . 3.800 3.638 3.439 3.852 0.052 4 0 "[ . 1 . 2]" 1
1204 1 67 GLN HE22 1 82 VAL HB . . 5.100 4.721 2.496 5.188 0.088 8 0 "[ . 1 . 2]" 1
1205 1 67 GLN HE22 1 82 VAL MG1 . . 5.010 4.122 3.198 4.903 . 0 0 "[ . 1 . 2]" 1
1206 1 67 GLN HE22 1 83 GLU HA . . 5.060 4.501 3.347 5.138 0.078 19 0 "[ . 1 . 2]" 1
1207 1 67 GLN HE22 1 84 PHE H . . 5.500 5.097 3.513 5.547 0.047 18 0 "[ . 1 . 2]" 1
1208 1 67 GLN HG2 1 68 ALA H . . 5.070 5.041 4.606 5.154 0.084 4 0 "[ . 1 . 2]" 1
1209 1 67 GLN HG2 1 82 VAL MG1 . . 4.630 4.024 3.105 4.701 0.071 3 0 "[ . 1 . 2]" 1
1210 1 67 GLN HG3 1 82 VAL MG1 . . 4.430 3.842 2.930 4.502 0.072 17 0 "[ . 1 . 2]" 1
1211 1 68 ALA H 1 68 ALA MB . . 2.820 2.491 2.282 2.750 . 0 0 "[ . 1 . 2]" 1
1212 1 68 ALA H 1 69 LEU H . . 3.160 2.112 1.764 2.443 . 0 0 "[ . 1 . 2]" 1
1213 1 68 ALA H 1 69 LEU QD . . 5.440 3.207 2.243 3.978 . 0 0 "[ . 1 . 2]" 1
1214 1 68 ALA H 1 69 LEU HG . . 5.330 3.509 2.614 4.937 . 0 0 "[ . 1 . 2]" 1
1215 1 68 ALA MB 1 69 LEU H . . 3.720 3.079 2.476 3.583 . 0 0 "[ . 1 . 2]" 1
1216 1 68 ALA MB 1 69 LEU HA . . 4.470 4.086 3.675 4.453 . 0 0 "[ . 1 . 2]" 1
1217 1 69 LEU H 1 69 LEU HB2 . . 4.040 3.728 3.505 3.997 . 0 0 "[ . 1 . 2]" 1
1218 1 69 LEU H 1 69 LEU HB3 . . 4.120 2.930 2.419 3.516 . 0 0 "[ . 1 . 2]" 1
1219 1 69 LEU H 1 69 LEU QD . . 3.940 2.503 1.663 3.308 . 0 0 "[ . 1 . 2]" 1
1220 1 69 LEU H 1 69 LEU HG . . 3.280 2.535 2.033 3.367 0.087 10 0 "[ . 1 . 2]" 1
1221 1 69 LEU H 1 70 HIS H . . 4.440 4.387 4.144 4.503 0.063 11 0 "[ . 1 . 2]" 1
1222 1 69 LEU HA 1 69 LEU HG . . 3.900 3.812 3.657 4.013 0.113 10 0 "[ . 1 . 2]" 1
1223 1 69 LEU HA 1 70 HIS H . . 2.800 2.636 2.110 2.840 0.040 4 0 "[ . 1 . 2]" 1
1224 1 69 LEU HB2 1 69 LEU QD . . 3.230 2.167 2.088 2.525 . 0 0 "[ . 1 . 2]" 1
1225 1 69 LEU HB2 1 70 HIS H . . 3.700 2.102 1.911 3.017 . 0 0 "[ . 1 . 2]" 1
1226 1 69 LEU QD 1 70 HIS H . . 4.040 2.631 2.133 3.628 . 0 0 "[ . 1 . 2]" 1
1227 1 69 LEU QD 1 71 PRO HD2 . . 5.500 4.984 4.562 5.460 . 0 0 "[ . 1 . 2]" 1
1228 1 69 LEU QD 1 71 PRO HD3 . . 5.270 5.036 4.263 5.501 0.231 18 0 "[ . 1 . 2]" 1
1229 1 69 LEU HG 1 70 HIS H . . 4.780 4.134 3.643 4.663 . 0 0 "[ . 1 . 2]" 1
1230 1 70 HIS H 1 70 HIS HD2 . . 4.990 3.255 2.544 4.613 . 0 0 "[ . 1 . 2]" 1
1231 1 71 PRO HA 1 72 PRO HD2 . . 2.980 2.552 2.323 2.718 . 0 0 "[ . 1 . 2]" 1
1232 1 71 PRO HA 1 72 PRO HD3 . . 3.210 2.413 2.206 2.720 . 0 0 "[ . 1 . 2]" 1
1233 1 71 PRO HB2 1 72 PRO HD2 . . 3.460 2.369 2.173 2.801 . 0 0 "[ . 1 . 2]" 1
1234 1 71 PRO HB2 1 72 PRO HD3 . . 4.260 3.737 3.519 4.171 . 0 0 "[ . 1 . 2]" 1
1235 1 71 PRO HB2 1 79 THR MG . . 3.880 3.321 2.881 3.989 0.109 18 0 "[ . 1 . 2]" 1
1236 1 71 PRO HB3 1 72 PRO HD2 . . 3.850 2.895 2.648 3.115 . 0 0 "[ . 1 . 2]" 1
1237 1 71 PRO HB3 1 72 PRO HD3 . . 4.270 3.923 3.730 4.315 0.045 18 0 "[ . 1 . 2]" 1
1238 1 72 PRO HA 1 73 LEU H . . 2.800 2.230 2.071 2.369 . 0 0 "[ . 1 . 2]" 1
1239 1 72 PRO HB2 1 73 LEU H . . 3.680 3.044 2.507 3.391 . 0 0 "[ . 1 . 2]" 1
1240 1 72 PRO HB2 1 79 THR MG . . 3.500 3.413 2.230 3.612 0.112 11 0 "[ . 1 . 2]" 1
1241 1 72 PRO HB3 1 73 LEU H . . 3.550 3.538 3.250 3.628 0.078 5 0 "[ . 1 . 2]" 1
1242 1 72 PRO HD2 1 79 THR MG . . 5.500 3.243 2.593 3.729 . 0 0 "[ . 1 . 2]" 1
1243 1 72 PRO HD3 1 73 LEU H . . 5.500 5.431 5.338 5.549 0.049 7 0 "[ . 1 . 2]" 1
1244 1 72 PRO HD3 1 79 THR MG . . 4.540 4.431 3.977 4.641 0.101 16 0 "[ . 1 . 2]" 1
1245 1 72 PRO HG2 1 79 THR MG . . 3.910 2.192 1.990 2.339 . 0 0 "[ . 1 . 2]" 1
1246 1 72 PRO HG3 1 79 THR MG . . 4.160 3.670 3.177 3.948 . 0 0 "[ . 1 . 2]" 1
1247 1 73 LEU H 1 73 LEU HB2 . . 3.170 2.281 1.973 2.699 . 0 0 "[ . 1 . 2]" 1
1248 1 73 LEU H 1 73 LEU HB3 . . 3.150 2.643 2.358 3.121 . 0 0 "[ . 1 . 2]" 1
1249 1 73 LEU H 1 73 LEU QD . . 4.300 3.618 3.261 3.768 . 0 0 "[ . 1 . 2]" 1
1250 1 73 LEU H 1 74 THR H . . 4.390 4.459 4.400 4.476 0.086 5 0 "[ . 1 . 2]" 1
1251 1 73 LEU HA 1 73 LEU QD . . 2.990 2.335 2.005 2.940 . 0 0 "[ . 1 . 2]" 1
1252 1 73 LEU HA 1 74 THR H . . 2.670 2.243 2.056 2.561 . 0 0 "[ . 1 . 2]" 1
1253 1 73 LEU HA 1 74 THR HA . . 4.530 4.484 4.412 4.600 0.070 8 0 "[ . 1 . 2]" 1
1254 1 73 LEU HB2 1 74 THR H . . 4.520 4.275 3.738 4.633 0.113 12 0 "[ . 1 . 2]" 1
1255 1 73 LEU HB3 1 74 THR H . . 4.720 3.813 2.425 4.347 . 0 0 "[ . 1 . 2]" 1
1256 1 73 LEU QD 1 74 THR H . . 3.210 2.220 1.648 3.044 . 0 0 "[ . 1 . 2]" 1
1257 1 73 LEU HG 1 74 THR H . . 4.700 4.153 3.123 4.780 0.080 20 0 "[ . 1 . 2]" 1
1258 1 74 THR H 1 74 THR HB . . 3.620 3.210 2.812 3.583 . 0 0 "[ . 1 . 2]" 1
1259 1 74 THR H 1 74 THR MG . . 3.900 2.116 1.894 2.684 . 0 0 "[ . 1 . 2]" 1
1260 1 74 THR H 1 79 THR HA . . 5.250 4.518 3.983 4.894 . 0 0 "[ . 1 . 2]" 1
1261 1 74 THR HA 1 74 THR MG . . 3.240 3.230 3.165 3.281 0.041 12 0 "[ . 1 . 2]" 1
1262 1 74 THR HA 1 75 ILE H . . 2.860 2.281 2.172 2.441 . 0 0 "[ . 1 . 2]" 1
1263 1 74 THR HA 1 75 ILE HG12 . . 5.430 5.126 4.847 5.389 . 0 0 "[ . 1 . 2]" 1
1264 1 74 THR HA 1 78 LYS H . . 4.670 4.245 3.829 4.758 0.088 17 0 "[ . 1 . 2]" 1
1265 1 74 THR HA 1 79 THR HA . . 3.230 3.249 3.067 3.309 0.079 20 0 "[ . 1 . 2]" 1
1266 1 74 THR HA 1 79 THR MG . . 4.800 4.287 4.012 4.586 . 0 0 "[ . 1 . 2]" 1
1267 1 74 THR HA 1 80 ILE H . . 3.910 3.525 3.042 3.932 0.022 4 0 "[ . 1 . 2]" 1
1268 1 74 THR HA 1 80 ILE MD . . 4.850 4.008 3.499 4.632 . 0 0 "[ . 1 . 2]" 1
1269 1 74 THR HA 1 80 ILE QG . . 3.740 3.081 2.446 3.579 . 0 0 "[ . 1 . 2]" 1
1270 1 74 THR HB 1 75 ILE H . . 3.990 3.790 3.615 3.927 . 0 0 "[ . 1 . 2]" 1
1271 1 74 THR HB 1 77 GLY H . . 4.630 4.598 3.802 4.707 0.077 19 0 "[ . 1 . 2]" 1
1272 1 74 THR HB 1 77 GLY HA2 . . 4.330 4.391 4.305 4.413 0.083 15 0 "[ . 1 . 2]" 1
1273 1 74 THR HB 1 78 LYS H . . 4.470 3.638 3.264 4.247 . 0 0 "[ . 1 . 2]" 1
1274 1 74 THR HB 1 79 THR HA . . 4.960 2.168 1.980 2.313 . 0 0 "[ . 1 . 2]" 1
1275 1 74 THR HB 1 79 THR HB . . 4.750 4.719 4.253 4.830 0.080 11 0 "[ . 1 . 2]" 1
1276 1 74 THR HB 1 79 THR MG . . 4.530 3.202 2.737 3.575 . 0 0 "[ . 1 . 2]" 1
1277 1 74 THR MG 1 77 GLY H . . 3.620 3.497 2.861 3.725 0.105 9 0 "[ . 1 . 2]" 1
1278 1 74 THR MG 1 77 GLY HA2 . . 4.160 3.033 2.439 3.370 . 0 0 "[ . 1 . 2]" 1
1279 1 74 THR MG 1 77 GLY HA3 . . 4.850 4.560 3.923 4.882 0.032 16 0 "[ . 1 . 2]" 1
1280 1 74 THR MG 1 78 LYS H . . 3.880 3.970 3.881 3.999 0.119 4 0 "[ . 1 . 2]" 1
1281 1 74 THR MG 1 79 THR H . . 5.070 4.385 3.875 4.751 . 0 0 "[ . 1 . 2]" 1
1282 1 74 THR MG 1 79 THR HA . . 3.650 3.549 3.216 3.728 0.078 3 0 "[ . 1 . 2]" 1
1283 1 74 THR MG 1 79 THR MG . . 3.210 3.296 2.918 3.348 0.138 14 0 "[ . 1 . 2]" 1
1284 1 75 ILE H 1 75 ILE HB . . 3.900 3.034 2.785 3.169 . 0 0 "[ . 1 . 2]" 1
1285 1 75 ILE H 1 75 ILE MD . . 5.200 2.236 2.067 2.480 . 0 0 "[ . 1 . 2]" 1
1286 1 75 ILE H 1 75 ILE HG12 . . 4.200 4.245 4.064 4.291 0.091 13 0 "[ . 1 . 2]" 1
1287 1 75 ILE H 1 75 ILE HG13 . . 5.140 3.310 2.984 3.464 . 0 0 "[ . 1 . 2]" 1
1288 1 75 ILE H 1 76 ASP H . . 4.830 2.291 2.055 2.936 . 0 0 "[ . 1 . 2]" 1
1289 1 75 ILE H 1 77 GLY H . . 4.680 3.938 3.348 4.172 . 0 0 "[ . 1 . 2]" 1
1290 1 75 ILE H 1 78 LYS H . . 3.640 3.552 3.235 3.726 0.086 13 0 "[ . 1 . 2]" 1
1291 1 75 ILE H 1 78 LYS HD2 . . 3.600 2.624 2.075 3.630 0.030 20 0 "[ . 1 . 2]" 1
1292 1 75 ILE HA 1 75 ILE MD . . 4.290 3.745 3.683 3.806 . 0 0 "[ . 1 . 2]" 1
1293 1 75 ILE HA 1 75 ILE HG12 . . 4.100 3.837 3.736 3.920 . 0 0 "[ . 1 . 2]" 1
1294 1 75 ILE HA 1 75 ILE HG13 . . 3.480 2.920 2.790 3.050 . 0 0 "[ . 1 . 2]" 1
1295 1 75 ILE HA 1 75 ILE MG . . 3.190 2.213 2.116 2.334 . 0 0 "[ . 1 . 2]" 1
1296 1 75 ILE HA 1 76 ASP H . . 3.110 3.008 2.523 3.140 0.030 8 0 "[ . 1 . 2]" 1
1297 1 75 ILE HG13 1 76 ASP H . . 4.950 4.949 4.779 5.005 0.055 9 0 "[ . 1 . 2]" 1
1298 1 75 ILE MG 1 76 ASP H . . 4.240 4.314 3.987 4.350 0.110 8 0 "[ . 1 . 2]" 1
1299 1 75 ILE MG 1 76 ASP HA . . 5.200 4.728 4.425 4.955 . 0 0 "[ . 1 . 2]" 1
1300 1 75 ILE MG 1 76 ASP HB2 . . 4.380 4.383 3.915 4.487 0.107 9 0 "[ . 1 . 2]" 1
1301 1 76 ASP H 1 77 GLY H . . 3.750 1.909 1.693 2.124 . 0 0 "[ . 1 . 2]" 1
1302 1 76 ASP H 1 77 GLY HA2 . . 5.500 3.881 3.761 3.975 . 0 0 "[ . 1 . 2]" 1
1303 1 76 ASP H 1 78 LYS H . . 4.820 2.794 2.583 3.148 . 0 0 "[ . 1 . 2]" 1
1304 1 76 ASP HA 1 77 GLY H . . 3.320 2.935 2.762 3.368 0.048 1 0 "[ . 1 . 2]" 1
1305 1 76 ASP HA 1 78 LYS H . . 4.600 4.476 4.247 4.687 0.087 1 0 "[ . 1 . 2]" 1
1306 1 76 ASP HB2 1 77 GLY H . . 5.500 4.587 3.992 4.724 . 0 0 "[ . 1 . 2]" 1
1307 1 76 ASP HB2 1 78 LYS H . . 4.660 4.587 4.196 4.746 0.086 9 0 "[ . 1 . 2]" 1
1308 1 76 ASP HB2 1 78 LYS HD2 . . 5.500 3.348 2.152 4.184 . 0 0 "[ . 1 . 2]" 1
1309 1 76 ASP HB3 1 77 GLY H . . 5.210 4.254 3.376 4.413 . 0 0 "[ . 1 . 2]" 1
1310 1 77 GLY H 1 78 LYS H . . 3.550 2.813 1.778 3.215 . 0 0 "[ . 1 . 2]" 1
1311 1 77 GLY H 1 78 LYS HD2 . . 4.750 4.081 2.998 4.812 0.062 8 0 "[ . 1 . 2]" 1
1312 1 78 LYS H 1 78 LYS HB2 . . 3.690 3.585 3.436 3.773 0.083 9 0 "[ . 1 . 2]" 1
1313 1 78 LYS H 1 78 LYS HB3 . . 3.640 3.346 2.903 3.522 . 0 0 "[ . 1 . 2]" 1
1314 1 78 LYS H 1 78 LYS HE2 . . 4.820 4.603 3.992 4.890 0.070 7 0 "[ . 1 . 2]" 1
1315 1 78 LYS H 1 78 LYS HE3 . . 4.390 4.178 3.679 4.842 0.452 15 0 "[ . 1 . 2]" 1
1316 1 78 LYS H 1 78 LYS QG . . 3.590 2.379 2.065 3.334 . 0 0 "[ . 1 . 2]" 1
1317 1 78 LYS H 1 79 THR H . . 4.770 4.197 3.924 4.446 . 0 0 "[ . 1 . 2]" 1
1318 1 78 LYS H 1 80 ILE MD . . 5.500 4.761 4.489 5.195 . 0 0 "[ . 1 . 2]" 1
1319 1 78 LYS HA 1 79 THR H . . 2.950 2.298 2.229 2.386 . 0 0 "[ . 1 . 2]" 1
1320 1 78 LYS HB2 1 78 LYS HE2 . . 4.550 4.106 2.524 5.507 0.957 9 1 "[ . +1 . 2]" 1
1321 1 78 LYS HB2 1 79 THR H . . 4.110 3.883 3.629 4.125 0.015 20 0 "[ . 1 . 2]" 1
1322 1 78 LYS HB2 1 80 ILE MD . . 3.930 3.214 2.747 3.668 . 0 0 "[ . 1 . 2]" 1
1323 1 78 LYS HB3 1 79 THR H . . 4.810 4.334 4.153 4.684 . 0 0 "[ . 1 . 2]" 1
1324 1 78 LYS HE2 1 78 LYS QG . . 3.770 2.712 2.202 3.448 . 0 0 "[ . 1 . 2]" 1
1325 1 79 THR H 1 79 THR HB . . 3.100 2.852 2.573 3.115 0.015 12 0 "[ . 1 . 2]" 1
1326 1 79 THR H 1 79 THR MG . . 3.960 3.719 3.545 3.850 . 0 0 "[ . 1 . 2]" 1
1327 1 79 THR H 1 80 ILE H . . 4.770 4.515 4.407 4.619 . 0 0 "[ . 1 . 2]" 1
1328 1 79 THR H 1 80 ILE MD . . 5.500 5.038 4.512 5.477 . 0 0 "[ . 1 . 2]" 1
1329 1 79 THR HA 1 79 THR MG . . 3.150 2.203 2.089 2.308 . 0 0 "[ . 1 . 2]" 1
1330 1 79 THR HA 1 80 ILE H . . 2.770 2.186 2.067 2.264 . 0 0 "[ . 1 . 2]" 1
1331 1 79 THR HA 1 80 ILE MD . . 5.500 4.163 3.635 4.527 . 0 0 "[ . 1 . 2]" 1
1332 1 79 THR HA 1 80 ILE QG . . 3.950 3.692 3.496 3.807 . 0 0 "[ . 1 . 2]" 1
1333 1 79 THR HB 1 80 ILE H . . 4.670 4.081 3.800 4.315 . 0 0 "[ . 1 . 2]" 1
1334 1 79 THR MG 1 80 ILE H . . 3.450 2.844 2.623 3.069 . 0 0 "[ . 1 . 2]" 1
1335 1 79 THR MG 1 81 ASN QD . . 5.500 4.516 3.980 4.962 . 0 0 "[ . 1 . 2]" 1
1336 1 80 ILE H 1 80 ILE HB . . 3.330 2.479 2.359 2.578 . 0 0 "[ . 1 . 2]" 1
1337 1 80 ILE H 1 80 ILE MD . . 4.180 3.088 2.756 3.469 . 0 0 "[ . 1 . 2]" 1
1338 1 80 ILE H 1 80 ILE QG . . 3.680 2.129 1.954 2.317 . 0 0 "[ . 1 . 2]" 1
1339 1 80 ILE H 1 80 ILE MG . . 3.860 3.767 3.707 3.812 . 0 0 "[ . 1 . 2]" 1
1340 1 80 ILE H 1 81 ASN H . . 5.020 4.623 4.426 4.717 . 0 0 "[ . 1 . 2]" 1
1341 1 80 ILE HA 1 80 ILE MD . . 3.090 2.220 2.091 2.341 . 0 0 "[ . 1 . 2]" 1
1342 1 80 ILE HA 1 80 ILE MG . . 3.310 2.448 2.305 2.538 . 0 0 "[ . 1 . 2]" 1
1343 1 80 ILE HA 1 81 ASN H . . 2.800 2.348 2.063 2.481 . 0 0 "[ . 1 . 2]" 1
1344 1 80 ILE HA 1 81 ASN QB . . 4.720 4.049 3.813 4.235 . 0 0 "[ . 1 . 2]" 1
1345 1 80 ILE HB 1 81 ASN H . . 3.920 3.752 3.473 4.007 0.087 18 0 "[ . 1 . 2]" 1
1346 1 80 ILE MD 1 80 ILE MG . . 3.050 2.125 2.021 2.245 . 0 0 "[ . 1 . 2]" 1
1347 1 80 ILE MD 1 81 ASN H . . 4.260 3.744 3.519 3.919 . 0 0 "[ . 1 . 2]" 1
1348 1 80 ILE QG 1 80 ILE MG . . 3.050 2.183 2.131 2.254 . 0 0 "[ . 1 . 2]" 1
1349 1 80 ILE MG 1 81 ASN H . . 3.400 2.171 1.922 2.561 . 0 0 "[ . 1 . 2]" 1
1350 1 80 ILE MG 1 81 ASN QB . . 5.110 3.904 3.670 4.179 . 0 0 "[ . 1 . 2]" 1
1351 1 81 ASN H 1 81 ASN QB . . 3.350 2.423 2.020 2.691 . 0 0 "[ . 1 . 2]" 1
1352 1 81 ASN H 1 81 ASN QD . . 5.500 3.678 2.928 4.210 . 0 0 "[ . 1 . 2]" 1
1353 1 81 ASN H 1 82 VAL H . . 4.650 4.462 4.333 4.626 . 0 0 "[ . 1 . 2]" 1
1354 1 81 ASN HA 1 81 ASN QD . . 4.420 2.748 1.866 3.778 . 0 0 "[ . 1 . 2]" 1
1355 1 81 ASN HA 1 82 VAL H . . 2.650 2.400 2.258 2.549 . 0 0 "[ . 1 . 2]" 1
1356 1 81 ASN QB 1 82 VAL H . . 3.960 2.707 2.139 2.918 . 0 0 "[ . 1 . 2]" 1
1357 1 81 ASN QD 1 82 VAL H . . 5.250 4.327 3.586 4.710 . 0 0 "[ . 1 . 2]" 1
1358 1 82 VAL H 1 82 VAL HB . . 3.190 2.739 2.573 2.915 . 0 0 "[ . 1 . 2]" 1
1359 1 82 VAL H 1 82 VAL MG2 . . 3.300 2.681 2.460 2.886 . 0 0 "[ . 1 . 2]" 1
1360 1 82 VAL H 1 83 GLU H . . 4.560 4.396 4.244 4.494 . 0 0 "[ . 1 . 2]" 1
1361 1 82 VAL HA 1 82 VAL MG1 . . 3.150 2.360 2.256 2.437 . 0 0 "[ . 1 . 2]" 1
1362 1 82 VAL HA 1 82 VAL MG2 . . 3.050 2.556 2.444 2.657 . 0 0 "[ . 1 . 2]" 1
1363 1 82 VAL HA 1 83 GLU H . . 2.800 2.269 2.213 2.371 . 0 0 "[ . 1 . 2]" 1
1364 1 82 VAL HA 1 83 GLU HG2 . . 5.470 5.304 3.739 6.297 0.827 7 7 "[ * * + ** -* 2]" 1
1365 1 82 VAL MG1 1 83 GLU H . . 3.670 2.497 2.344 2.737 . 0 0 "[ . 1 . 2]" 1
1366 1 82 VAL MG1 1 83 GLU HA . . 4.220 3.609 2.994 4.111 . 0 0 "[ . 1 . 2]" 1
1367 1 82 VAL MG2 1 83 GLU H . . 4.870 4.196 4.017 4.313 . 0 0 "[ . 1 . 2]" 1
1368 1 83 GLU H 1 83 GLU HB2 . . 4.010 2.695 2.396 3.760 . 0 0 "[ . 1 . 2]" 1
1369 1 83 GLU H 1 83 GLU HB3 . . 3.610 3.612 3.505 3.805 0.195 15 0 "[ . 1 . 2]" 1
1370 1 83 GLU H 1 83 GLU HG2 . . 4.390 4.137 2.905 4.690 0.300 7 0 "[ . 1 . 2]" 1
1371 1 83 GLU H 1 83 GLU HG3 . . 4.610 4.255 2.775 4.699 0.089 9 0 "[ . 1 . 2]" 1
1372 1 83 GLU HA 1 83 GLU HG2 . . 3.880 2.612 2.298 3.497 . 0 0 "[ . 1 . 2]" 1
1373 1 83 GLU HA 1 83 GLU HG3 . . 3.950 3.328 2.372 3.782 . 0 0 "[ . 1 . 2]" 1
1374 1 83 GLU HA 1 84 PHE H . . 2.900 2.316 2.114 2.518 . 0 0 "[ . 1 . 2]" 1
1375 1 83 GLU HA 1 84 PHE HB3 . . 4.600 4.424 4.118 4.801 0.201 6 0 "[ . 1 . 2]" 1
1376 1 83 GLU HB2 1 84 PHE H . . 3.350 3.725 1.989 3.828 0.478 12 0 "[ . 1 . 2]" 1
1377 1 83 GLU HB3 1 84 PHE H . . 3.740 2.526 2.422 2.987 . 0 0 "[ . 1 . 2]" 1
1378 1 83 GLU HG2 1 84 PHE H . . 4.180 3.864 2.881 4.563 0.383 17 0 "[ . 1 . 2]" 1
1379 1 83 GLU HG3 1 84 PHE H . . 4.470 4.383 3.984 4.565 0.095 19 0 "[ . 1 . 2]" 1
1380 1 84 PHE H 1 84 PHE HB2 . . 3.380 3.068 2.612 3.210 . 0 0 "[ . 1 . 2]" 1
1381 1 84 PHE H 1 84 PHE HB3 . . 3.310 2.722 2.552 2.877 . 0 0 "[ . 1 . 2]" 1
1382 1 84 PHE HA 1 84 PHE HD1 . . 3.470 2.213 2.135 2.390 . 0 0 "[ . 1 . 2]" 1
1383 1 84 PHE HA 1 85 ALA H . . 2.820 2.237 2.162 2.351 . 0 0 "[ . 1 . 2]" 1
1384 1 84 PHE HA 1 85 ALA MB . . 4.650 4.151 3.937 4.323 . 0 0 "[ . 1 . 2]" 1
1385 1 84 PHE HB2 1 86 LYS H . . 5.500 5.464 5.136 5.830 0.330 9 0 "[ . 1 . 2]" 1
1386 1 84 PHE HD1 1 85 ALA H . . 4.250 3.351 2.577 3.942 . 0 0 "[ . 1 . 2]" 1
1387 1 84 PHE HD1 1 86 LYS H . . 4.940 4.624 4.142 4.997 0.057 13 0 "[ . 1 . 2]" 1
1388 1 84 PHE HD1 1 86 LYS HA . . 5.420 5.032 4.130 5.481 0.061 2 0 "[ . 1 . 2]" 1
1389 1 84 PHE HD1 1 86 LYS HB2 . . 4.090 3.990 3.717 4.174 0.084 18 0 "[ . 1 . 2]" 1
1390 1 85 ALA H 1 85 ALA MB . . 3.160 2.438 2.290 2.721 . 0 0 "[ . 1 . 2]" 1
1391 1 85 ALA H 1 86 LYS H . . 4.590 3.514 3.086 3.911 . 0 0 "[ . 1 . 2]" 1
1392 1 85 ALA HA 1 86 LYS H . . 2.780 2.350 2.173 2.680 . 0 0 "[ . 1 . 2]" 1
1393 1 85 ALA MB 1 86 LYS H . . 3.710 3.680 3.588 3.762 0.052 17 0 "[ . 1 . 2]" 1
1394 1 86 LYS H 1 86 LYS HB2 . . 3.170 2.469 2.098 3.147 . 0 0 "[ . 1 . 2]" 1
1395 1 86 LYS H 1 86 LYS HB3 . . 3.400 2.612 2.297 3.093 . 0 0 "[ . 1 . 2]" 1
1396 1 86 LYS H 1 86 LYS QD . . 4.940 4.438 4.211 4.774 . 0 0 "[ . 1 . 2]" 1
1397 1 86 LYS H 1 86 LYS QG . . 3.960 3.926 3.700 4.035 0.075 8 0 "[ . 1 . 2]" 1
1398 1 86 LYS H 1 87 GLY H . . 4.840 4.039 3.416 4.649 . 0 0 "[ . 1 . 2]" 1
1399 1 86 LYS HA 1 86 LYS QD . . 3.000 2.519 2.127 3.101 0.101 11 0 "[ . 1 . 2]" 1
1400 1 86 LYS HA 1 86 LYS QG . . 3.620 2.681 2.202 3.221 . 0 0 "[ . 1 . 2]" 1
1401 1 86 LYS HA 1 87 GLY H . . 3.050 2.367 2.141 2.848 . 0 0 "[ . 1 . 2]" 1
1402 1 86 LYS HB2 1 86 LYS HE3 . . 4.730 4.597 3.638 5.278 0.548 9 1 "[ . +1 . 2]" 1
1403 1 86 LYS HB2 1 86 LYS QG . . 2.420 2.196 2.090 2.372 . 0 0 "[ . 1 . 2]" 1
1404 1 86 LYS QD 1 86 LYS QG . . 2.480 2.086 1.994 2.140 . 0 0 "[ . 1 . 2]" 1
1405 1 86 LYS QD 1 87 GLY H . . 4.710 3.286 1.890 4.207 . 0 0 "[ . 1 . 2]" 1
1406 1 86 LYS QD 1 88 SER H . . 5.150 3.706 2.501 5.229 0.079 18 0 "[ . 1 . 2]" 1
1407 1 86 LYS QD 1 88 SER QB . . 5.500 3.878 2.426 5.376 . 0 0 "[ . 1 . 2]" 1
1408 1 86 LYS HE3 1 86 LYS QG . . 3.860 2.622 2.098 3.510 . 0 0 "[ . 1 . 2]" 1
1409 1 86 LYS QG 1 87 GLY H . . 4.850 4.207 3.020 4.916 0.066 12 0 "[ . 1 . 2]" 1
1410 1 86 LYS QG 1 88 SER H . . 5.500 4.819 2.994 5.567 0.067 8 0 "[ . 1 . 2]" 1
1411 1 86 LYS QG 1 88 SER QB . . 5.450 4.586 2.532 5.305 . 0 0 "[ . 1 . 2]" 1
1412 1 87 GLY H 1 88 SER H . . 4.490 3.707 2.558 4.548 0.058 3 0 "[ . 1 . 2]" 1
1413 1 87 GLY HA2 1 88 SER H . . 3.090 2.707 2.146 3.576 0.486 15 0 "[ . 1 . 2]" 1
1414 1 87 GLY HA3 1 88 SER H . . 3.540 3.236 2.282 3.593 0.053 13 0 "[ . 1 . 2]" 1
1415 1 88 SER H 1 88 SER QB . . 3.790 2.597 2.082 3.365 . 0 0 "[ . 1 . 2]" 1
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