NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
394803 |
1rhx   |
6010 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1rhx
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 1811
_Distance_constraint_stats_list.Viol_count 4619
_Distance_constraint_stats_list.Viol_total 7049.097
_Distance_constraint_stats_list.Viol_max 0.976
_Distance_constraint_stats_list.Viol_rms 0.0344
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0097
_Distance_constraint_stats_list.Viol_average_violations_only 0.0763
_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 2 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 LEU 9.134 0.606 5 1 "[ + 1 . 2]"
1 4 VAL 4.588 0.108 19 0 "[ . 1 . 2]"
1 5 LEU 13.674 0.698 5 1 "[ + 1 . 2]"
1 6 VAL 4.786 0.296 18 0 "[ . 1 . 2]"
1 7 LYS 10.870 0.698 5 1 "[ + 1 . 2]"
1 8 TYR 7.022 0.398 1 0 "[ . 1 . 2]"
1 9 GLY 5.802 0.350 1 0 "[ . 1 . 2]"
1 10 THR 11.473 0.398 1 0 "[ . 1 . 2]"
1 11 ASP 4.387 0.357 8 0 "[ . 1 . 2]"
1 12 HIS 7.989 0.295 8 0 "[ . 1 . 2]"
1 13 PRO 12.514 0.606 5 4 "[* + * 1 - . 2]"
1 14 VAL 6.393 0.109 1 0 "[ . 1 . 2]"
1 15 GLU 10.787 0.311 17 0 "[ . 1 . 2]"
1 16 LYS 8.425 0.122 17 0 "[ . 1 . 2]"
1 17 LEU 17.917 0.596 1 3 "[+ . * 1 - . 2]"
1 18 LYS 8.704 0.112 15 0 "[ . 1 . 2]"
1 19 ILE 9.564 0.122 17 0 "[ . 1 . 2]"
1 20 ARG 6.642 0.118 14 0 "[ . 1 . 2]"
1 21 SER 2.080 0.096 20 0 "[ . 1 . 2]"
1 22 ALA 7.662 0.122 20 0 "[ . 1 . 2]"
1 23 LYS 9.583 0.121 9 0 "[ . 1 . 2]"
1 24 ALA 9.450 0.191 6 0 "[ . 1 . 2]"
1 25 GLU 6.541 0.133 16 0 "[ . 1 . 2]"
1 26 ASP 7.491 0.102 16 0 "[ . 1 . 2]"
1 27 LYS 1.806 0.098 7 0 "[ . 1 . 2]"
1 28 ILE 12.357 0.130 10 0 "[ . 1 . 2]"
1 29 VAL 6.824 0.119 15 0 "[ . 1 . 2]"
1 30 LEU 17.701 0.569 7 2 "[ . + 1- . 2]"
1 31 ILE 20.850 0.569 7 2 "[ . + 1- . 2]"
1 32 GLN 5.296 0.104 7 0 "[ . 1 . 2]"
1 33 ASN 6.397 0.098 20 0 "[ . 1 . 2]"
1 34 GLY 5.164 0.100 12 0 "[ . 1 . 2]"
1 35 VAL 9.753 0.484 17 0 "[ . 1 . 2]"
1 36 PHE 8.845 0.299 17 0 "[ . 1 . 2]"
1 37 TRP 8.299 0.137 19 0 "[ . 1 . 2]"
1 38 ALA 10.224 0.128 3 0 "[ . 1 . 2]"
1 39 LEU 5.210 0.105 1 0 "[ . 1 . 2]"
1 40 GLU 11.510 0.976 3 8 "[ *+** *1* - * 2]"
1 41 GLU 14.423 0.976 3 8 "[ *+** *1* * * 2]"
1 42 LEU 10.866 0.780 12 2 "[ . 1 + . -]"
1 43 GLU 7.078 0.780 12 3 "[ . - 1 + . *]"
1 44 THR 10.322 0.215 7 0 "[ . 1 . 2]"
1 45 PRO 7.785 0.202 6 0 "[ . 1 . 2]"
1 46 ALA 5.570 0.108 15 0 "[ . 1 . 2]"
1 47 LYS 5.481 0.136 10 0 "[ . 1 . 2]"
1 48 VAL 5.836 0.113 4 0 "[ . 1 . 2]"
1 49 TYR 6.294 0.136 10 0 "[ . 1 . 2]"
1 50 ALA 4.048 0.105 12 0 "[ . 1 . 2]"
1 51 ILE 11.363 0.123 13 0 "[ . 1 . 2]"
1 52 LYS 8.136 0.111 13 0 "[ . 1 . 2]"
1 53 ASP 4.911 0.607 15 1 "[ . 1 + 2]"
1 54 ASP 3.755 0.122 19 0 "[ . 1 . 2]"
1 55 PHE 11.545 0.607 15 1 "[ . 1 + 2]"
1 56 LEU 11.521 0.098 17 0 "[ . 1 . 2]"
1 57 ALA 5.829 0.123 13 0 "[ . 1 . 2]"
1 58 ARG 8.840 0.484 17 0 "[ . 1 . 2]"
1 59 GLY 0.437 0.075 19 0 "[ . 1 . 2]"
1 60 TYR 10.342 0.403 17 0 "[ . 1 . 2]"
1 61 SER 4.362 0.106 2 0 "[ . 1 . 2]"
1 62 GLU 10.300 0.514 10 1 "[ . + . 2]"
1 63 GLU 6.109 0.514 10 1 "[ . + . 2]"
1 64 ASP 1.970 0.235 20 0 "[ . 1 . 2]"
1 65 SER 10.696 0.831 17 3 "[ - 1 . + *]"
1 66 LYS 9.388 0.142 1 0 "[ . 1 . 2]"
1 67 VAL 13.875 0.142 1 0 "[ . 1 . 2]"
1 68 PRO 11.230 0.117 14 0 "[ . 1 . 2]"
1 69 LEU 14.594 0.831 17 3 "[ - 1 . + *]"
1 70 ILE 12.705 0.117 14 0 "[ . 1 . 2]"
1 71 THR 6.125 0.111 13 0 "[ . 1 . 2]"
1 72 TYR 5.824 0.135 19 0 "[ . 1 . 2]"
1 73 SER 0.127 0.057 10 0 "[ . 1 . 2]"
1 74 GLU 4.812 0.089 3 0 "[ . 1 . 2]"
1 75 PHE 4.006 0.093 17 0 "[ . 1 . 2]"
1 76 ILE 5.880 0.120 5 0 "[ . 1 . 2]"
1 77 ASP 5.131 0.106 14 0 "[ . 1 . 2]"
1 78 LEU 4.703 0.097 2 0 "[ . 1 . 2]"
1 79 LEU 6.113 0.126 2 0 "[ . 1 . 2]"
1 80 GLU 1.839 0.118 17 0 "[ . 1 . 2]"
1 81 GLY 0.604 0.114 4 0 "[ . 1 . 2]"
1 82 GLU 3.013 0.114 4 0 "[ . 1 . 2]"
1 83 GLU 5.322 0.121 3 0 "[ . 1 . 2]"
1 84 LYS 6.805 0.140 3 0 "[ . 1 . 2]"
1 85 PHE 10.337 0.130 10 0 "[ . 1 . 2]"
1 86 ILE 12.641 0.192 2 0 "[ . 1 . 2]"
1 87 GLY 3.547 0.253 6 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 2 ALA HA 1 3 LEU HA . . 5.480 4.518 4.399 4.608 . 0 0 "[ . 1 . 2]" 1
2 1 2 ALA MB 1 3 LEU H . . 3.630 2.596 2.101 3.091 . 0 0 "[ . 1 . 2]" 1
3 1 2 ALA MB 1 3 LEU HA . . 4.850 4.157 3.899 4.342 . 0 0 "[ . 1 . 2]" 1
4 1 3 LEU H 1 3 LEU HB2 . . 3.690 2.617 2.508 2.719 . 0 0 "[ . 1 . 2]" 1
5 1 3 LEU H 1 3 LEU HB3 . . 3.700 3.752 3.693 3.780 0.080 1 0 "[ . 1 . 2]" 1
6 1 3 LEU H 1 3 LEU MD1 . . 4.930 3.784 2.161 4.383 . 0 0 "[ . 1 . 2]" 1
7 1 3 LEU H 1 3 LEU HG . . 4.450 3.240 2.579 4.522 0.072 20 0 "[ . 1 . 2]" 1
8 1 3 LEU H 1 4 VAL HB . . 5.500 5.260 4.703 5.581 0.081 4 0 "[ . 1 . 2]" 1
9 1 3 LEU H 1 84 LYS HA . . 5.500 4.839 4.155 5.490 . 0 0 "[ . 1 . 2]" 1
10 1 3 LEU H 1 85 PHE HA . . 4.280 3.869 3.113 4.373 0.093 14 0 "[ . 1 . 2]" 1
11 1 3 LEU H 1 85 PHE QB . . 5.500 4.929 4.123 5.546 0.046 11 0 "[ . 1 . 2]" 1
12 1 3 LEU HA 1 3 LEU MD2 . . 3.800 2.393 2.039 3.556 . 0 0 "[ . 1 . 2]" 1
13 1 3 LEU HA 1 3 LEU HG . . 3.300 2.888 2.338 3.382 0.082 20 0 "[ . 1 . 2]" 1
14 1 3 LEU HA 1 4 VAL HA . . 4.910 4.422 4.371 4.512 . 0 0 "[ . 1 . 2]" 1
15 1 3 LEU HA 1 4 VAL HB . . 5.500 4.970 4.361 5.591 0.091 10 0 "[ . 1 . 2]" 1
16 1 3 LEU HA 1 4 VAL QG . . 4.450 3.692 3.270 4.212 . 0 0 "[ . 1 . 2]" 1
17 1 3 LEU HA 1 12 HIS QB . . 4.680 4.569 4.241 4.767 0.087 5 0 "[ . 1 . 2]" 1
18 1 3 LEU HB2 1 3 LEU MD1 . . 3.650 2.353 2.231 3.276 . 0 0 "[ . 1 . 2]" 1
19 1 3 LEU HB2 1 4 VAL H . . 4.720 4.491 4.366 4.563 . 0 0 "[ . 1 . 2]" 1
20 1 3 LEU HB2 1 12 HIS HA . . 3.840 3.638 2.887 3.914 0.074 1 0 "[ . 1 . 2]" 1
21 1 3 LEU HB2 1 13 PRO QD . . 5.500 2.691 2.370 3.194 . 0 0 "[ . 1 . 2]" 1
22 1 3 LEU HB2 1 85 PHE HA . . 4.210 3.994 3.465 4.301 0.091 6 0 "[ . 1 . 2]" 1
23 1 3 LEU HB2 1 85 PHE QB . . 4.690 4.711 4.039 4.790 0.100 8 0 "[ . 1 . 2]" 1
24 1 3 LEU HB3 1 3 LEU MD2 . . 3.670 2.377 2.201 3.083 . 0 0 "[ . 1 . 2]" 1
25 1 3 LEU HB3 1 4 VAL H . . 4.400 3.972 3.535 4.346 . 0 0 "[ . 1 . 2]" 1
26 1 3 LEU HB3 1 12 HIS H . . 5.240 5.282 5.048 5.330 0.090 4 0 "[ . 1 . 2]" 1
27 1 3 LEU HB3 1 12 HIS HA . . 3.560 2.749 2.540 3.246 . 0 0 "[ . 1 . 2]" 1
28 1 3 LEU HB3 1 13 PRO QD . . 5.500 3.044 2.569 3.764 . 0 0 "[ . 1 . 2]" 1
29 1 3 LEU MD2 1 12 HIS H . . 4.890 4.505 3.882 5.185 0.295 8 0 "[ . 1 . 2]" 1
30 1 3 LEU MD2 1 12 HIS HA . . 3.410 2.722 1.943 3.675 0.265 8 0 "[ . 1 . 2]" 1
31 1 3 LEU MD2 1 12 HIS QB . . 4.120 3.555 3.086 3.964 . 0 0 "[ . 1 . 2]" 1
32 1 3 LEU MD2 1 13 PRO QD . . 3.980 3.626 2.016 4.586 0.606 5 1 "[ + 1 . 2]" 1
33 1 4 VAL H 1 4 VAL HB . . 3.700 3.010 2.338 3.769 0.069 5 0 "[ . 1 . 2]" 1
34 1 4 VAL H 1 4 VAL QG . . 3.530 2.597 2.069 3.007 . 0 0 "[ . 1 . 2]" 1
35 1 4 VAL H 1 5 LEU MD2 . . 3.670 2.775 2.177 3.388 . 0 0 "[ . 1 . 2]" 1
36 1 4 VAL HA 1 4 VAL QG . . 3.270 2.236 2.093 2.444 . 0 0 "[ . 1 . 2]" 1
37 1 4 VAL HA 1 5 LEU H . . 3.010 2.620 2.321 2.822 . 0 0 "[ . 1 . 2]" 1
38 1 4 VAL HA 1 5 LEU HA . . 4.450 4.275 4.112 4.461 0.011 8 0 "[ . 1 . 2]" 1
39 1 4 VAL HA 1 5 LEU HG . . 4.930 4.856 4.553 5.007 0.077 12 0 "[ . 1 . 2]" 1
40 1 4 VAL HA 1 85 PHE H . . 5.210 4.420 4.034 5.045 . 0 0 "[ . 1 . 2]" 1
41 1 4 VAL HA 1 85 PHE QB . . 5.420 5.278 4.590 5.524 0.104 20 0 "[ . 1 . 2]" 1
42 1 4 VAL HA 1 86 ILE H . . 4.230 2.213 1.893 2.848 . 0 0 "[ . 1 . 2]" 1
43 1 4 VAL HA 1 86 ILE HB . . 3.300 3.109 2.685 3.369 0.069 9 0 "[ . 1 . 2]" 1
44 1 4 VAL HA 1 86 ILE MD . . 4.590 4.535 4.234 4.698 0.108 19 0 "[ . 1 . 2]" 1
45 1 4 VAL HA 1 86 ILE HG12 . . 5.060 3.518 3.137 5.061 0.001 16 0 "[ . 1 . 2]" 1
46 1 4 VAL HA 1 86 ILE MG . . 4.800 4.484 3.673 4.754 . 0 0 "[ . 1 . 2]" 1
47 1 4 VAL HA 1 87 GLY H . . 5.500 4.629 4.368 4.995 . 0 0 "[ . 1 . 2]" 1
48 1 4 VAL QG 1 5 LEU H . . 4.290 3.644 3.508 3.792 . 0 0 "[ . 1 . 2]" 1
49 1 4 VAL QG 1 5 LEU HA . . 3.990 4.024 3.985 4.042 0.052 10 0 "[ . 1 . 2]" 1
50 1 4 VAL QG 1 85 PHE QB . . 4.740 4.564 4.081 4.729 . 0 0 "[ . 1 . 2]" 1
51 1 4 VAL QG 1 86 ILE H . . 4.290 2.248 1.870 2.541 . 0 0 "[ . 1 . 2]" 1
52 1 4 VAL QG 1 86 ILE HB . . 3.710 2.408 1.852 3.338 . 0 0 "[ . 1 . 2]" 1
53 1 4 VAL QG 1 86 ILE HG12 . . 3.360 2.249 1.967 2.960 . 0 0 "[ . 1 . 2]" 1
54 1 4 VAL QG 1 87 GLY HA2 . . 5.500 3.423 2.798 4.699 . 0 0 "[ . 1 . 2]" 1
55 1 5 LEU H 1 5 LEU HB2 . . 3.960 3.997 3.905 4.038 0.078 1 0 "[ . 1 . 2]" 1
56 1 5 LEU H 1 5 LEU HB3 . . 3.790 3.662 3.415 3.825 0.035 20 0 "[ . 1 . 2]" 1
57 1 5 LEU H 1 5 LEU MD2 . . 4.680 3.565 3.148 4.046 . 0 0 "[ . 1 . 2]" 1
58 1 5 LEU H 1 5 LEU HG . . 3.870 2.712 2.374 2.949 . 0 0 "[ . 1 . 2]" 1
59 1 5 LEU H 1 6 VAL HB . . 5.280 4.011 3.816 4.342 . 0 0 "[ . 1 . 2]" 1
60 1 5 LEU H 1 86 ILE HB . . 5.010 5.008 4.581 5.098 0.088 10 0 "[ . 1 . 2]" 1
61 1 5 LEU H 1 87 GLY HA2 . . 4.710 3.694 3.349 4.596 . 0 0 "[ . 1 . 2]" 1
62 1 5 LEU H 1 87 GLY HA3 . . 5.110 3.503 2.576 4.232 . 0 0 "[ . 1 . 2]" 1
63 1 5 LEU HA 1 5 LEU MD1 . . 4.060 3.994 3.814 4.138 0.078 17 0 "[ . 1 . 2]" 1
64 1 5 LEU HA 1 5 LEU MD2 . . 3.930 3.826 3.658 3.997 0.067 15 0 "[ . 1 . 2]" 1
65 1 5 LEU HA 1 6 VAL H . . 3.100 2.301 2.174 2.440 . 0 0 "[ . 1 . 2]" 1
66 1 5 LEU HA 1 6 VAL HA . . 4.370 4.449 4.431 4.462 0.092 18 0 "[ . 1 . 2]" 1
67 1 5 LEU HA 1 6 VAL MG1 . . 5.500 3.741 3.219 4.202 . 0 0 "[ . 1 . 2]" 1
68 1 5 LEU HA 1 7 LYS HG3 . . 5.500 5.354 4.263 6.198 0.698 5 1 "[ + 1 . 2]" 1
69 1 5 LEU HA 1 31 ILE MD . . 4.420 4.512 4.459 4.537 0.117 20 0 "[ . 1 . 2]" 1
70 1 5 LEU HA 1 86 ILE HB . . 5.210 5.067 4.521 5.296 0.086 16 0 "[ . 1 . 2]" 1
71 1 5 LEU HA 1 87 GLY H . . 5.500 4.538 4.383 4.678 . 0 0 "[ . 1 . 2]" 1
72 1 5 LEU HB2 1 5 LEU MD1 . . 3.500 2.198 2.111 2.266 . 0 0 "[ . 1 . 2]" 1
73 1 5 LEU HB2 1 6 VAL H . . 4.200 3.356 2.484 4.275 0.075 18 0 "[ . 1 . 2]" 1
74 1 5 LEU HB2 1 7 LYS QE . . 4.580 3.465 2.149 4.188 . 0 0 "[ . 1 . 2]" 1
75 1 5 LEU HB2 1 87 GLY HA2 . . 4.930 4.567 4.196 4.882 . 0 0 "[ . 1 . 2]" 1
76 1 5 LEU HB2 1 87 GLY HA3 . . 5.170 4.533 4.317 4.807 . 0 0 "[ . 1 . 2]" 1
77 1 5 LEU HB3 1 5 LEU MD2 . . 3.430 2.200 2.133 2.302 . 0 0 "[ . 1 . 2]" 1
78 1 5 LEU HB3 1 6 VAL H . . 4.940 4.175 3.671 4.622 . 0 0 "[ . 1 . 2]" 1
79 1 5 LEU HB3 1 87 GLY HA2 . . 4.560 3.971 3.548 4.365 . 0 0 "[ . 1 . 2]" 1
80 1 5 LEU HB3 1 87 GLY HA3 . . 4.390 4.537 4.256 4.643 0.253 6 0 "[ . 1 . 2]" 1
81 1 5 LEU MD1 1 6 VAL H . . 5.140 4.368 3.721 5.098 . 0 0 "[ . 1 . 2]" 1
82 1 5 LEU MD1 1 7 LYS QE . . 4.210 4.032 3.007 4.331 0.121 6 0 "[ . 1 . 2]" 1
83 1 5 LEU HG 1 6 VAL H . . 5.010 4.774 4.181 5.031 0.021 2 0 "[ . 1 . 2]" 1
84 1 6 VAL H 1 6 VAL HB . . 3.730 3.357 2.603 3.771 0.041 19 0 "[ . 1 . 2]" 1
85 1 6 VAL H 1 6 VAL MG1 . . 4.790 2.421 1.983 2.755 . 0 0 "[ . 1 . 2]" 1
86 1 6 VAL H 1 7 LYS HB3 . . 4.840 3.879 3.391 4.901 0.061 18 0 "[ . 1 . 2]" 1
87 1 6 VAL H 1 31 ILE MD . . 4.310 3.539 3.322 3.889 . 0 0 "[ . 1 . 2]" 1
88 1 6 VAL H 1 31 ILE HG13 . . 5.500 4.729 4.214 5.796 0.296 18 0 "[ . 1 . 2]" 1
89 1 6 VAL H 1 31 ILE MG . . 5.050 4.341 3.931 4.863 . 0 0 "[ . 1 . 2]" 1
90 1 6 VAL HA 1 6 VAL HB . . 2.820 2.369 2.271 2.523 . 0 0 "[ . 1 . 2]" 1
91 1 6 VAL HA 1 6 VAL MG1 . . 3.550 3.236 3.209 3.265 . 0 0 "[ . 1 . 2]" 1
92 1 6 VAL HA 1 6 VAL MG2 . . 3.490 2.440 2.321 2.647 . 0 0 "[ . 1 . 2]" 1
93 1 6 VAL HA 1 7 LYS H . . 3.050 2.569 2.348 2.858 . 0 0 "[ . 1 . 2]" 1
94 1 6 VAL HA 1 7 LYS HB3 . . 5.500 5.201 5.003 5.439 . 0 0 "[ . 1 . 2]" 1
95 1 6 VAL HA 1 31 ILE H . . 5.500 4.949 4.755 5.516 0.016 12 0 "[ . 1 . 2]" 1
96 1 6 VAL HA 1 34 GLY H . . 5.500 5.167 4.971 5.569 0.069 12 0 "[ . 1 . 2]" 1
97 1 6 VAL HB 1 7 LYS H . . 5.500 4.588 4.518 4.651 . 0 0 "[ . 1 . 2]" 1
98 1 6 VAL HB 1 30 LEU HA . . 4.160 4.144 3.924 4.241 0.081 5 0 "[ . 1 . 2]" 1
99 1 6 VAL HB 1 31 ILE H . . 4.620 4.571 4.452 4.671 0.051 15 0 "[ . 1 . 2]" 1
100 1 6 VAL HB 1 34 GLY HA2 . . 5.500 5.521 5.140 5.577 0.077 10 0 "[ . 1 . 2]" 1
101 1 6 VAL MG1 1 7 LYS H . . 4.130 4.099 3.669 4.227 0.097 19 0 "[ . 1 . 2]" 1
102 1 6 VAL MG1 1 7 LYS HA . . 4.870 4.351 3.716 4.624 . 0 0 "[ . 1 . 2]" 1
103 1 6 VAL MG1 1 30 LEU HA . . 4.600 2.390 1.939 3.298 . 0 0 "[ . 1 . 2]" 1
104 1 6 VAL MG1 1 31 ILE H . . 4.930 2.329 1.704 3.300 . 0 0 "[ . 1 . 2]" 1
105 1 6 VAL MG1 1 31 ILE MG . . 3.630 2.161 1.980 2.467 . 0 0 "[ . 1 . 2]" 1
106 1 6 VAL MG1 1 34 GLY H . . 5.500 4.766 3.800 5.314 . 0 0 "[ . 1 . 2]" 1
107 1 6 VAL MG2 1 7 LYS H . . 4.400 4.104 3.826 4.285 . 0 0 "[ . 1 . 2]" 1
108 1 6 VAL MG2 1 8 TYR H . . 4.690 3.918 3.361 4.299 . 0 0 "[ . 1 . 2]" 1
109 1 6 VAL MG2 1 30 LEU HA . . 4.740 2.152 1.807 3.099 . 0 0 "[ . 1 . 2]" 1
110 1 6 VAL MG2 1 37 TRP QB . . 4.650 4.281 3.937 4.787 0.137 19 0 "[ . 1 . 2]" 1
111 1 6 VAL MG2 1 37 TRP HD1 . . 5.370 2.797 2.445 3.458 . 0 0 "[ . 1 . 2]" 1
112 1 7 LYS H 1 7 LYS QD . . 5.120 3.921 2.037 4.649 . 0 0 "[ . 1 . 2]" 1
113 1 7 LYS H 1 7 LYS QE . . 5.500 4.223 3.433 4.885 . 0 0 "[ . 1 . 2]" 1
114 1 7 LYS H 1 7 LYS HG2 . . 4.240 2.714 2.136 3.615 . 0 0 "[ . 1 . 2]" 1
115 1 7 LYS H 1 31 ILE H . . 5.500 5.571 5.518 5.586 0.086 19 0 "[ . 1 . 2]" 1
116 1 7 LYS H 1 34 GLY HA2 . . 5.500 5.502 5.185 5.600 0.100 12 0 "[ . 1 . 2]" 1
117 1 7 LYS H 1 34 GLY HA3 . . 5.500 4.994 4.639 5.281 . 0 0 "[ . 1 . 2]" 1
118 1 7 LYS HA 1 31 ILE H . . 4.580 4.318 4.222 4.438 . 0 0 "[ . 1 . 2]" 1
119 1 7 LYS HA 1 31 ILE HA . . 5.500 5.582 5.561 5.592 0.092 19 0 "[ . 1 . 2]" 1
120 1 7 LYS HA 1 31 ILE MD . . 3.930 3.980 3.832 4.043 0.113 19 0 "[ . 1 . 2]" 1
121 1 7 LYS HA 1 31 ILE HG12 . . 3.890 3.350 3.043 3.683 . 0 0 "[ . 1 . 2]" 1
122 1 7 LYS HA 1 31 ILE HG13 . . 4.170 3.081 2.761 3.409 . 0 0 "[ . 1 . 2]" 1
123 1 7 LYS HA 1 32 GLN H . . 5.500 4.658 4.457 4.961 . 0 0 "[ . 1 . 2]" 1
124 1 7 LYS HA 1 32 GLN HB2 . . 4.350 2.099 1.978 2.222 . 0 0 "[ . 1 . 2]" 1
125 1 7 LYS HA 1 32 GLN HB3 . . 5.010 3.692 3.453 3.852 . 0 0 "[ . 1 . 2]" 1
126 1 7 LYS HA 1 32 GLN QG . . 5.500 3.511 3.328 3.652 . 0 0 "[ . 1 . 2]" 1
127 1 7 LYS HA 1 33 ASN H . . 5.440 2.518 2.194 3.097 . 0 0 "[ . 1 . 2]" 1
128 1 7 LYS HA 1 34 GLY H . . 3.720 2.465 2.253 2.621 . 0 0 "[ . 1 . 2]" 1
129 1 7 LYS HA 1 34 GLY HA2 . . 4.650 4.579 4.354 4.711 0.061 8 0 "[ . 1 . 2]" 1
130 1 7 LYS HA 1 34 GLY HA3 . . 4.150 3.758 3.459 3.926 . 0 0 "[ . 1 . 2]" 1
131 1 7 LYS HA 1 35 VAL H . . 5.500 4.976 4.777 5.218 . 0 0 "[ . 1 . 2]" 1
132 1 7 LYS HB2 1 8 TYR H . . 4.890 4.539 4.481 4.601 . 0 0 "[ . 1 . 2]" 1
133 1 7 LYS HB2 1 32 GLN HB2 . . 5.500 2.293 2.186 2.469 . 0 0 "[ . 1 . 2]" 1
134 1 7 LYS HB2 1 32 GLN HB3 . . 5.500 3.162 2.757 3.368 . 0 0 "[ . 1 . 2]" 1
135 1 7 LYS HB2 1 32 GLN QG . . 4.890 2.431 2.196 2.842 . 0 0 "[ . 1 . 2]" 1
136 1 7 LYS HB2 1 33 ASN H . . 5.500 3.561 3.282 3.886 . 0 0 "[ . 1 . 2]" 1
137 1 7 LYS HB2 1 34 GLY H . . 5.340 4.696 4.404 4.899 . 0 0 "[ . 1 . 2]" 1
138 1 7 LYS HB3 1 7 LYS QD . . 3.500 2.613 2.154 3.149 . 0 0 "[ . 1 . 2]" 1
139 1 7 LYS HB3 1 7 LYS QE . . 4.050 3.942 3.766 4.117 0.067 16 0 "[ . 1 . 2]" 1
140 1 7 LYS HB3 1 8 TYR H . . 5.060 4.700 4.636 4.757 . 0 0 "[ . 1 . 2]" 1
141 1 7 LYS HB3 1 31 ILE H . . 5.500 5.291 5.034 5.551 0.051 8 0 "[ . 1 . 2]" 1
142 1 7 LYS HB3 1 31 ILE MD . . 4.710 2.325 2.236 2.451 . 0 0 "[ . 1 . 2]" 1
143 1 7 LYS HB3 1 31 ILE HG13 . . 5.010 2.598 2.442 2.829 . 0 0 "[ . 1 . 2]" 1
144 1 7 LYS HB3 1 32 GLN HB2 . . 5.500 2.744 2.559 2.969 . 0 0 "[ . 1 . 2]" 1
145 1 7 LYS HB3 1 32 GLN QG . . 5.120 2.482 2.184 2.790 . 0 0 "[ . 1 . 2]" 1
146 1 7 LYS HB3 1 33 ASN H . . 5.500 4.284 4.084 4.796 . 0 0 "[ . 1 . 2]" 1
147 1 7 LYS HB3 1 34 GLY H . . 5.400 4.738 4.532 4.940 . 0 0 "[ . 1 . 2]" 1
148 1 7 LYS QD 1 8 TYR H . . 5.500 5.193 4.476 5.586 0.086 19 0 "[ . 1 . 2]" 1
149 1 7 LYS QD 1 8 TYR QD . . 4.930 4.123 3.153 4.775 . 0 0 "[ . 1 . 2]" 1
150 1 7 LYS QD 1 8 TYR QE . . 4.940 4.411 3.469 5.043 0.103 8 0 "[ . 1 . 2]" 1
151 1 7 LYS QD 1 32 GLN QG . . 4.640 3.226 2.633 4.060 . 0 0 "[ . 1 . 2]" 1
152 1 7 LYS QE 1 7 LYS HG2 . . 3.580 2.329 2.128 2.632 . 0 0 "[ . 1 . 2]" 1
153 1 7 LYS QE 1 31 ILE MD . . 4.440 4.412 3.980 4.571 0.131 13 0 "[ . 1 . 2]" 1
154 1 7 LYS HG2 1 31 ILE MD . . 4.940 3.708 3.034 4.757 . 0 0 "[ . 1 . 2]" 1
155 1 8 TYR H 1 8 TYR HB3 . . 4.080 3.497 3.038 3.916 . 0 0 "[ . 1 . 2]" 1
156 1 8 TYR HA 1 8 TYR QD . . 3.280 2.731 2.349 3.076 . 0 0 "[ . 1 . 2]" 1
157 1 8 TYR HA 1 8 TYR QE . . 4.520 4.500 4.276 4.617 0.097 16 0 "[ . 1 . 2]" 1
158 1 8 TYR HA 1 9 GLY H . . 3.230 2.912 2.846 2.985 . 0 0 "[ . 1 . 2]" 1
159 1 8 TYR HA 1 9 GLY HA2 . . 5.120 4.895 4.727 4.960 . 0 0 "[ . 1 . 2]" 1
160 1 8 TYR HA 1 9 GLY HA3 . . 4.940 4.521 4.301 4.697 . 0 0 "[ . 1 . 2]" 1
161 1 8 TYR HA 1 10 THR H . . 5.500 5.021 4.475 5.281 . 0 0 "[ . 1 . 2]" 1
162 1 8 TYR HA 1 33 ASN H . . 5.120 4.591 4.336 5.173 0.053 19 0 "[ . 1 . 2]" 1
163 1 8 TYR HA 1 33 ASN HB2 . . 4.200 2.605 2.413 2.852 . 0 0 "[ . 1 . 2]" 1
164 1 8 TYR HA 1 33 ASN HB3 . . 3.880 3.859 3.398 3.960 0.080 10 0 "[ . 1 . 2]" 1
165 1 8 TYR HA 1 34 GLY H . . 5.500 4.908 4.738 5.061 . 0 0 "[ . 1 . 2]" 1
166 1 8 TYR HB3 1 9 GLY H . . 4.200 4.357 4.161 4.550 0.350 1 0 "[ . 1 . 2]" 1
167 1 8 TYR HB3 1 10 THR H . . 4.510 4.423 3.681 4.908 0.398 1 0 "[ . 1 . 2]" 1
168 1 9 GLY H 1 33 ASN H . . 4.060 3.731 3.540 3.967 . 0 0 "[ . 1 . 2]" 1
169 1 9 GLY H 1 33 ASN HB2 . . 4.540 2.211 1.987 2.785 . 0 0 "[ . 1 . 2]" 1
170 1 9 GLY H 1 33 ASN HB3 . . 4.570 3.062 2.675 3.310 . 0 0 "[ . 1 . 2]" 1
171 1 9 GLY H 1 34 GLY H . . 2.730 2.767 2.690 2.796 0.066 8 0 "[ . 1 . 2]" 1
172 1 9 GLY H 1 34 GLY HA3 . . 5.500 3.638 3.434 3.937 . 0 0 "[ . 1 . 2]" 1
173 1 9 GLY H 1 35 VAL H . . 5.500 4.784 4.670 4.995 . 0 0 "[ . 1 . 2]" 1
174 1 9 GLY H 1 36 PHE H . . 5.400 4.815 4.660 5.033 . 0 0 "[ . 1 . 2]" 1
175 1 9 GLY H 1 37 TRP HE1 . . 5.500 5.290 5.031 5.554 0.054 9 0 "[ . 1 . 2]" 1
176 1 9 GLY HA2 1 10 THR H . . 3.620 3.386 3.295 3.523 . 0 0 "[ . 1 . 2]" 1
177 1 9 GLY HA2 1 10 THR MG . . 4.590 4.002 3.704 4.236 . 0 0 "[ . 1 . 2]" 1
178 1 9 GLY HA2 1 33 ASN HB2 . . 5.500 3.839 3.681 3.975 . 0 0 "[ . 1 . 2]" 1
179 1 9 GLY HA2 1 36 PHE H . . 3.690 3.264 3.022 3.472 . 0 0 "[ . 1 . 2]" 1
180 1 9 GLY HA2 1 36 PHE HB2 . . 3.510 2.447 2.208 2.858 . 0 0 "[ . 1 . 2]" 1
181 1 9 GLY HA2 1 36 PHE HB3 . . 4.320 4.036 3.783 4.378 0.058 7 0 "[ . 1 . 2]" 1
182 1 9 GLY HA2 1 37 TRP H . . 5.470 4.202 3.999 4.392 . 0 0 "[ . 1 . 2]" 1
183 1 9 GLY HA2 1 37 TRP HD1 . . 4.340 4.230 3.857 4.440 0.100 10 0 "[ . 1 . 2]" 1
184 1 9 GLY HA3 1 10 THR H . . 3.400 2.243 2.080 2.643 . 0 0 "[ . 1 . 2]" 1
185 1 9 GLY HA3 1 10 THR MG . . 5.050 3.380 2.999 3.897 . 0 0 "[ . 1 . 2]" 1
186 1 9 GLY HA3 1 33 ASN HB2 . . 5.430 4.068 3.861 4.337 . 0 0 "[ . 1 . 2]" 1
187 1 9 GLY HA3 1 33 ASN HB3 . . 5.500 3.673 3.173 4.097 . 0 0 "[ . 1 . 2]" 1
188 1 9 GLY HA3 1 36 PHE H . . 4.500 4.529 4.346 4.574 0.074 13 0 "[ . 1 . 2]" 1
189 1 9 GLY HA3 1 36 PHE HB2 . . 4.700 3.018 2.858 3.261 . 0 0 "[ . 1 . 2]" 1
190 1 9 GLY HA3 1 36 PHE HB3 . . 4.480 4.123 3.921 4.434 . 0 0 "[ . 1 . 2]" 1
191 1 9 GLY HA3 1 36 PHE QD . . 4.300 3.448 2.244 4.386 0.086 7 0 "[ . 1 . 2]" 1
192 1 10 THR H 1 10 THR MG . . 3.490 2.891 2.532 3.240 . 0 0 "[ . 1 . 2]" 1
193 1 10 THR H 1 11 ASP HA . . 5.500 5.262 4.619 5.573 0.073 6 0 "[ . 1 . 2]" 1
194 1 10 THR H 1 11 ASP HB3 . . 5.500 5.072 3.594 5.857 0.357 8 0 "[ . 1 . 2]" 1
195 1 10 THR H 1 33 ASN HB2 . . 5.500 5.588 5.570 5.598 0.098 20 0 "[ . 1 . 2]" 1
196 1 10 THR H 1 34 GLY HA2 . . 5.500 4.741 4.257 5.043 . 0 0 "[ . 1 . 2]" 1
197 1 10 THR H 1 36 PHE HB2 . . 4.780 4.687 4.374 4.866 0.086 4 0 "[ . 1 . 2]" 1
198 1 10 THR H 1 37 TRP HE1 . . 5.500 4.478 4.218 4.996 . 0 0 "[ . 1 . 2]" 1
199 1 10 THR HA 1 10 THR MG . . 3.300 2.197 2.101 2.300 . 0 0 "[ . 1 . 2]" 1
200 1 10 THR HA 1 11 ASP HA . . 5.190 4.413 4.209 4.532 . 0 0 "[ . 1 . 2]" 1
201 1 10 THR HB 1 11 ASP H . . 5.180 4.375 4.229 4.459 . 0 0 "[ . 1 . 2]" 1
202 1 10 THR HB 1 11 ASP HA . . 4.460 4.533 4.411 4.557 0.097 16 0 "[ . 1 . 2]" 1
203 1 10 THR HB 1 12 HIS H . . 5.050 5.085 4.897 5.134 0.084 9 0 "[ . 1 . 2]" 1
204 1 10 THR HB 1 37 TRP HH2 . . 4.630 4.100 3.660 4.569 . 0 0 "[ . 1 . 2]" 1
205 1 10 THR HB 1 37 TRP HZ2 . . 4.500 3.539 3.064 3.839 . 0 0 "[ . 1 . 2]" 1
206 1 10 THR MG 1 11 ASP H . . 4.900 4.378 4.159 4.585 . 0 0 "[ . 1 . 2]" 1
207 1 10 THR MG 1 11 ASP HA . . 5.500 5.454 5.248 5.547 0.047 5 0 "[ . 1 . 2]" 1
208 1 10 THR MG 1 12 HIS H . . 5.500 5.180 4.750 5.481 . 0 0 "[ . 1 . 2]" 1
209 1 10 THR MG 1 34 GLY HA2 . . 5.500 5.110 4.774 5.334 . 0 0 "[ . 1 . 2]" 1
210 1 10 THR MG 1 36 PHE H . . 5.500 5.530 5.343 5.603 0.103 7 0 "[ . 1 . 2]" 1
211 1 10 THR MG 1 36 PHE HB2 . . 3.970 3.676 3.319 3.976 0.006 7 0 "[ . 1 . 2]" 1
212 1 10 THR MG 1 36 PHE HB3 . . 4.070 3.503 3.214 3.796 . 0 0 "[ . 1 . 2]" 1
213 1 10 THR MG 1 36 PHE QD . . 5.270 3.844 3.280 4.796 . 0 0 "[ . 1 . 2]" 1
214 1 10 THR MG 1 37 TRP H . . 4.970 4.782 4.563 5.043 0.073 15 0 "[ . 1 . 2]" 1
215 1 10 THR MG 1 37 TRP HA . . 4.060 4.106 3.911 4.168 0.108 11 0 "[ . 1 . 2]" 1
216 1 10 THR MG 1 37 TRP QB . . 5.000 4.865 4.579 5.081 0.081 15 0 "[ . 1 . 2]" 1
217 1 10 THR MG 1 37 TRP HD1 . . 5.470 4.823 4.392 5.084 . 0 0 "[ . 1 . 2]" 1
218 1 10 THR MG 1 37 TRP HE3 . . 4.490 4.057 3.263 4.562 0.072 15 0 "[ . 1 . 2]" 1
219 1 10 THR MG 1 37 TRP HH2 . . 4.450 3.914 3.335 4.497 0.047 15 0 "[ . 1 . 2]" 1
220 1 10 THR MG 1 37 TRP HZ2 . . 4.840 3.661 3.105 4.149 . 0 0 "[ . 1 . 2]" 1
221 1 10 THR MG 1 40 GLU QB . . 5.060 4.909 4.506 5.186 0.126 12 0 "[ . 1 . 2]" 1
222 1 10 THR MG 1 40 GLU QG . . 3.960 3.717 3.423 4.104 0.144 5 0 "[ . 1 . 2]" 1
223 1 11 ASP H 1 11 ASP HB3 . . 4.070 2.861 2.493 3.287 . 0 0 "[ . 1 . 2]" 1
224 1 11 ASP H 1 12 HIS HA . . 5.410 5.146 4.732 5.469 0.059 19 0 "[ . 1 . 2]" 1
225 1 11 ASP HA 1 11 ASP HB2 . . 3.030 2.557 2.442 2.681 . 0 0 "[ . 1 . 2]" 1
226 1 11 ASP HA 1 12 HIS HA . . 5.500 4.401 4.280 4.518 . 0 0 "[ . 1 . 2]" 1
227 1 11 ASP HA 1 12 HIS QB . . 4.580 4.649 4.623 4.670 0.090 18 0 "[ . 1 . 2]" 1
228 1 11 ASP HA 1 37 TRP HZ2 . . 3.930 3.567 3.086 4.009 0.079 19 0 "[ . 1 . 2]" 1
229 1 11 ASP HB2 1 12 HIS H . . 5.400 4.663 4.571 4.752 . 0 0 "[ . 1 . 2]" 1
230 1 11 ASP HB3 1 12 HIS H . . 4.850 4.394 4.231 4.753 . 0 0 "[ . 1 . 2]" 1
231 1 12 HIS HA 1 17 LEU HB2 . . 4.630 3.886 3.759 4.086 . 0 0 "[ . 1 . 2]" 1
232 1 12 HIS HA 1 17 LEU HB3 . . 3.430 3.515 3.507 3.523 0.093 14 0 "[ . 1 . 2]" 1
233 1 12 HIS HA 1 17 LEU QD . . 5.500 3.433 2.175 4.043 . 0 0 "[ . 1 . 2]" 1
234 1 12 HIS HA 1 28 ILE MG . . 5.250 5.226 4.966 5.350 0.100 7 0 "[ . 1 . 2]" 1
235 1 12 HIS HE1 1 14 VAL HB . . 3.570 2.585 2.284 3.077 . 0 0 "[ . 1 . 2]" 1
236 1 12 HIS HE1 1 14 VAL MG1 . . 5.160 3.472 3.152 3.962 . 0 0 "[ . 1 . 2]" 1
237 1 12 HIS HE1 1 14 VAL MG2 . . 4.930 2.371 2.113 2.800 . 0 0 "[ . 1 . 2]" 1
238 1 12 HIS HE1 1 30 LEU MD1 . . 4.740 4.030 3.778 4.292 . 0 0 "[ . 1 . 2]" 1
239 1 12 HIS HE1 1 30 LEU MD2 . . 5.070 2.034 1.966 2.079 . 0 0 "[ . 1 . 2]" 1
240 1 12 HIS HE1 1 37 TRP QB . . 3.720 2.934 2.479 3.779 0.059 19 0 "[ . 1 . 2]" 1
241 1 12 HIS HE1 1 37 TRP HD1 . . 3.660 2.830 2.549 3.192 . 0 0 "[ . 1 . 2]" 1
242 1 13 PRO HA 1 15 GLU H . . 4.290 3.754 3.609 4.046 . 0 0 "[ . 1 . 2]" 1
243 1 13 PRO HA 1 16 LYS QB . . 4.690 4.749 4.506 4.801 0.111 19 0 "[ . 1 . 2]" 1
244 1 13 PRO HA 1 17 LEU H . . 3.510 3.041 2.901 3.225 . 0 0 "[ . 1 . 2]" 1
245 1 13 PRO HA 1 17 LEU HB2 . . 3.620 2.441 2.194 2.787 . 0 0 "[ . 1 . 2]" 1
246 1 13 PRO HA 1 18 LYS HB3 . . 3.640 3.290 3.012 3.582 . 0 0 "[ . 1 . 2]" 1
247 1 13 PRO HB2 1 14 VAL H . . 3.710 2.822 2.590 3.009 . 0 0 "[ . 1 . 2]" 1
248 1 13 PRO HB2 1 14 VAL MG2 . . 5.500 4.219 3.940 4.509 . 0 0 "[ . 1 . 2]" 1
249 1 13 PRO HB2 1 15 GLU H . . 5.500 5.070 4.800 5.367 . 0 0 "[ . 1 . 2]" 1
250 1 13 PRO HB2 1 17 LEU H . . 5.320 5.478 5.287 5.580 0.260 15 0 "[ . 1 . 2]" 1
251 1 13 PRO HB2 1 17 LEU HB2 . . 4.720 4.996 4.721 5.316 0.596 1 3 "[+ . * 1 - . 2]" 1
252 1 13 PRO HB2 1 18 LYS HB3 . . 4.350 2.414 2.045 2.798 . 0 0 "[ . 1 . 2]" 1
253 1 13 PRO HB3 1 14 VAL H . . 3.760 3.703 3.441 3.836 0.076 4 0 "[ . 1 . 2]" 1
254 1 13 PRO HB3 1 17 LEU H . . 5.500 4.769 4.683 4.867 . 0 0 "[ . 1 . 2]" 1
255 1 13 PRO QD 1 14 VAL HB . . 5.500 5.349 5.021 5.550 0.050 5 0 "[ . 1 . 2]" 1
256 1 13 PRO QD 1 14 VAL MG2 . . 5.500 4.436 4.182 4.706 . 0 0 "[ . 1 . 2]" 1
257 1 13 PRO QD 1 18 LYS H . . 5.500 5.107 4.655 5.319 . 0 0 "[ . 1 . 2]" 1
258 1 13 PRO QD 1 28 ILE MG . . 4.680 2.726 2.258 3.216 . 0 0 "[ . 1 . 2]" 1
259 1 13 PRO QG 1 14 VAL MG2 . . 4.240 3.949 3.738 4.279 0.039 13 0 "[ . 1 . 2]" 1
260 1 14 VAL H 1 14 VAL HB . . 3.280 3.360 3.347 3.372 0.092 11 0 "[ . 1 . 2]" 1
261 1 14 VAL H 1 14 VAL MG1 . . 4.030 3.936 3.838 3.996 . 0 0 "[ . 1 . 2]" 1
262 1 14 VAL H 1 15 GLU H . . 2.400 2.310 2.090 2.487 0.087 20 0 "[ . 1 . 2]" 1
263 1 14 VAL H 1 15 GLU HG2 . . 5.500 5.337 5.040 5.567 0.067 13 0 "[ . 1 . 2]" 1
264 1 14 VAL H 1 15 GLU HG3 . . 5.500 4.884 4.318 5.274 . 0 0 "[ . 1 . 2]" 1
265 1 14 VAL H 1 17 LEU HB2 . . 5.500 4.586 4.253 4.987 . 0 0 "[ . 1 . 2]" 1
266 1 14 VAL H 1 18 LYS HB3 . . 4.010 1.884 1.592 2.246 . 0 0 "[ . 1 . 2]" 1
267 1 14 VAL H 1 18 LYS QE . . 5.500 4.785 4.136 5.107 . 0 0 "[ . 1 . 2]" 1
268 1 14 VAL H 1 44 THR HA . . 5.500 5.590 5.566 5.601 0.101 16 0 "[ . 1 . 2]" 1
269 1 14 VAL HA 1 14 VAL MG1 . . 3.130 2.808 2.725 2.937 . 0 0 "[ . 1 . 2]" 1
270 1 14 VAL HA 1 14 VAL MG2 . . 3.160 2.167 2.077 2.252 . 0 0 "[ . 1 . 2]" 1
271 1 14 VAL HA 1 16 LYS H . . 5.500 4.862 4.587 5.169 . 0 0 "[ . 1 . 2]" 1
272 1 14 VAL HA 1 18 LYS HB3 . . 3.790 3.262 2.986 3.604 . 0 0 "[ . 1 . 2]" 1
273 1 14 VAL HA 1 18 LYS QD . . 3.980 4.003 3.750 4.089 0.109 1 0 "[ . 1 . 2]" 1
274 1 14 VAL HA 1 44 THR MG . . 4.520 3.142 2.252 4.296 . 0 0 "[ . 1 . 2]" 1
275 1 14 VAL HB 1 15 GLU H . . 3.900 2.931 2.622 3.207 . 0 0 "[ . 1 . 2]" 1
276 1 14 VAL HB 1 16 LYS H . . 5.060 4.913 4.522 5.122 0.062 20 0 "[ . 1 . 2]" 1
277 1 14 VAL MG1 1 15 GLU H . . 4.320 2.928 2.661 3.218 . 0 0 "[ . 1 . 2]" 1
278 1 14 VAL MG1 1 15 GLU HA . . 4.000 3.955 3.867 4.090 0.090 5 0 "[ . 1 . 2]" 1
279 1 14 VAL MG1 1 15 GLU HG2 . . 4.260 3.121 2.347 3.464 . 0 0 "[ . 1 . 2]" 1
280 1 14 VAL MG1 1 15 GLU HG3 . . 4.810 2.466 1.933 3.742 . 0 0 "[ . 1 . 2]" 1
281 1 14 VAL MG1 1 37 TRP HA . . 4.820 3.897 3.529 4.092 . 0 0 "[ . 1 . 2]" 1
282 1 14 VAL MG1 1 37 TRP QB . . 4.100 2.020 1.917 2.152 . 0 0 "[ . 1 . 2]" 1
283 1 14 VAL MG1 1 37 TRP HD1 . . 5.500 4.684 4.123 5.097 . 0 0 "[ . 1 . 2]" 1
284 1 14 VAL MG1 1 37 TRP HE3 . . 3.770 3.047 2.398 3.854 0.084 6 0 "[ . 1 . 2]" 1
285 1 14 VAL MG1 1 38 ALA HA . . 5.500 4.068 3.784 4.322 . 0 0 "[ . 1 . 2]" 1
286 1 14 VAL MG1 1 40 GLU QG . . 5.080 4.115 3.482 4.860 . 0 0 "[ . 1 . 2]" 1
287 1 14 VAL MG1 1 44 THR HB . . 5.500 3.659 2.790 4.270 . 0 0 "[ . 1 . 2]" 1
288 1 14 VAL MG1 1 44 THR MG . . 4.220 3.099 2.609 3.502 . 0 0 "[ . 1 . 2]" 1
289 1 14 VAL MG2 1 15 GLU H . . 4.730 4.217 4.063 4.336 . 0 0 "[ . 1 . 2]" 1
290 1 15 GLU H 1 15 GLU HB2 . . 3.820 3.112 2.602 3.951 0.131 5 0 "[ . 1 . 2]" 1
291 1 15 GLU H 1 15 GLU HG2 . . 4.090 3.860 3.107 4.182 0.092 18 0 "[ . 1 . 2]" 1
292 1 15 GLU H 1 15 GLU HG3 . . 4.100 3.231 2.282 3.798 . 0 0 "[ . 1 . 2]" 1
293 1 15 GLU H 1 16 LYS H . . 5.430 2.188 1.765 2.652 . 0 0 "[ . 1 . 2]" 1
294 1 15 GLU H 1 16 LYS QB . . 5.370 3.915 3.606 4.156 . 0 0 "[ . 1 . 2]" 1
295 1 15 GLU H 1 17 LEU H . . 5.500 3.921 3.586 4.166 . 0 0 "[ . 1 . 2]" 1
296 1 15 GLU H 1 18 LYS QE . . 5.500 4.908 4.040 5.324 . 0 0 "[ . 1 . 2]" 1
297 1 15 GLU H 1 37 TRP QB . . 4.680 4.303 3.871 4.763 0.083 13 0 "[ . 1 . 2]" 1
298 1 15 GLU HA 1 16 LYS QB . . 4.430 4.530 4.519 4.543 0.113 13 0 "[ . 1 . 2]" 1
299 1 15 GLU HA 1 18 LYS H . . 5.500 4.959 4.618 5.411 . 0 0 "[ . 1 . 2]" 1
300 1 15 GLU HA 1 18 LYS QD . . 3.400 2.463 2.126 3.507 0.107 11 0 "[ . 1 . 2]" 1
301 1 15 GLU HA 1 18 LYS QE . . 2.910 2.895 2.066 3.022 0.112 15 0 "[ . 1 . 2]" 1
302 1 15 GLU HA 1 19 ILE HB . . 5.500 5.408 5.129 5.585 0.085 1 0 "[ . 1 . 2]" 1
303 1 15 GLU HA 1 19 ILE MD . . 5.370 4.578 4.267 4.819 . 0 0 "[ . 1 . 2]" 1
304 1 15 GLU HA 1 42 LEU HB2 . . 5.090 3.759 3.383 4.043 . 0 0 "[ . 1 . 2]" 1
305 1 15 GLU HA 1 42 LEU HB3 . . 4.720 2.447 2.244 2.795 . 0 0 "[ . 1 . 2]" 1
306 1 15 GLU HA 1 42 LEU QD . . 5.270 3.302 2.622 4.015 . 0 0 "[ . 1 . 2]" 1
307 1 15 GLU HA 1 42 LEU HG . . 5.310 4.555 3.114 5.404 0.094 19 0 "[ . 1 . 2]" 1
308 1 15 GLU HA 1 43 GLU H . . 2.880 2.953 2.924 2.973 0.093 7 0 "[ . 1 . 2]" 1
309 1 15 GLU HB2 1 16 LYS H . . 4.510 4.182 3.162 4.568 0.058 6 0 "[ . 1 . 2]" 1
310 1 15 GLU HB2 1 37 TRP HE3 . . 5.500 2.963 2.060 4.869 . 0 0 "[ . 1 . 2]" 1
311 1 15 GLU HB2 1 37 TRP HZ3 . . 5.320 3.622 2.270 5.198 . 0 0 "[ . 1 . 2]" 1
312 1 15 GLU HB2 1 42 LEU HB3 . . 3.770 3.320 2.035 4.060 0.290 1 0 "[ . 1 . 2]" 1
313 1 15 GLU HB3 1 16 LYS H . . 4.500 4.317 3.917 4.480 . 0 0 "[ . 1 . 2]" 1
314 1 15 GLU HB3 1 42 LEU HB3 . . 4.540 2.682 2.187 3.656 . 0 0 "[ . 1 . 2]" 1
315 1 15 GLU HG2 1 16 LYS H . . 5.470 4.631 3.782 5.079 . 0 0 "[ . 1 . 2]" 1
316 1 15 GLU HG3 1 16 LYS H . . 5.470 4.315 2.094 5.343 . 0 0 "[ . 1 . 2]" 1
317 1 15 GLU HG3 1 37 TRP QB . . 4.920 4.161 3.358 4.719 . 0 0 "[ . 1 . 2]" 1
318 1 15 GLU HG3 1 42 LEU HB3 . . 4.260 4.213 3.915 4.571 0.311 17 0 "[ . 1 . 2]" 1
319 1 16 LYS H 1 16 LYS QB . . 3.420 2.873 2.281 3.190 . 0 0 "[ . 1 . 2]" 1
320 1 16 LYS H 1 18 LYS QE . . 5.450 3.859 2.914 4.989 . 0 0 "[ . 1 . 2]" 1
321 1 16 LYS H 1 19 ILE H . . 5.360 3.817 3.406 4.352 . 0 0 "[ . 1 . 2]" 1
322 1 16 LYS H 1 19 ILE HB . . 5.310 4.480 4.096 4.897 . 0 0 "[ . 1 . 2]" 1
323 1 16 LYS H 1 19 ILE MD . . 4.710 4.817 4.792 4.832 0.122 17 0 "[ . 1 . 2]" 1
324 1 16 LYS HA 1 16 LYS QD . . 3.360 2.258 2.071 2.499 . 0 0 "[ . 1 . 2]" 1
325 1 16 LYS HA 1 16 LYS QE . . 5.370 3.922 3.552 4.190 . 0 0 "[ . 1 . 2]" 1
326 1 16 LYS HA 1 16 LYS HG2 . . 3.930 3.643 3.564 3.776 . 0 0 "[ . 1 . 2]" 1
327 1 16 LYS HA 1 16 LYS HG3 . . 3.680 2.600 2.327 2.971 . 0 0 "[ . 1 . 2]" 1
328 1 16 LYS HA 1 18 LYS H . . 5.420 4.172 3.984 4.404 . 0 0 "[ . 1 . 2]" 1
329 1 16 LYS HA 1 18 LYS QD . . 5.500 3.467 3.013 4.884 . 0 0 "[ . 1 . 2]" 1
330 1 16 LYS HA 1 19 ILE H . . 4.250 3.464 3.214 3.687 . 0 0 "[ . 1 . 2]" 1
331 1 16 LYS HA 1 19 ILE HB . . 3.730 2.952 2.577 3.367 . 0 0 "[ . 1 . 2]" 1
332 1 16 LYS HA 1 19 ILE MD . . 3.640 3.229 2.648 3.695 0.055 9 0 "[ . 1 . 2]" 1
333 1 16 LYS HA 1 19 ILE HG13 . . 5.500 5.202 4.527 5.572 0.072 9 0 "[ . 1 . 2]" 1
334 1 16 LYS HA 1 19 ILE MG . . 4.740 3.421 3.018 4.268 . 0 0 "[ . 1 . 2]" 1
335 1 16 LYS HA 1 20 ARG H . . 4.950 5.006 4.910 5.041 0.091 20 0 "[ . 1 . 2]" 1
336 1 16 LYS HA 1 42 LEU QD . . 4.510 3.117 2.254 3.584 . 0 0 "[ . 1 . 2]" 1
337 1 16 LYS QB 1 17 LEU H . . 3.130 2.048 1.908 2.219 . 0 0 "[ . 1 . 2]" 1
338 1 16 LYS QB 1 19 ILE MD . . 5.340 4.902 4.227 5.385 0.045 9 0 "[ . 1 . 2]" 1
339 1 16 LYS QB 1 20 ARG QD . . 5.500 4.139 3.807 4.357 . 0 0 "[ . 1 . 2]" 1
340 1 16 LYS QB 1 37 TRP HE3 . . 4.750 4.376 3.997 4.715 . 0 0 "[ . 1 . 2]" 1
341 1 16 LYS QB 1 37 TRP HH2 . . 3.800 2.239 2.030 2.677 . 0 0 "[ . 1 . 2]" 1
342 1 16 LYS QD 1 19 ILE MD . . 4.660 3.536 2.741 4.296 . 0 0 "[ . 1 . 2]" 1
343 1 16 LYS QD 1 42 LEU QD . . 3.120 2.284 2.059 2.942 . 0 0 "[ . 1 . 2]" 1
344 1 16 LYS QE 1 16 LYS HG2 . . 3.450 2.593 2.004 2.940 . 0 0 "[ . 1 . 2]" 1
345 1 16 LYS QE 1 19 ILE MD . . 5.250 4.404 3.873 5.274 0.024 1 0 "[ . 1 . 2]" 1
346 1 16 LYS QE 1 20 ARG QD . . 4.720 4.518 4.070 4.645 . 0 0 "[ . 1 . 2]" 1
347 1 16 LYS QE 1 42 LEU QD . . 4.390 3.074 2.575 3.522 . 0 0 "[ . 1 . 2]" 1
348 1 16 LYS HG2 1 17 LEU H . . 4.110 4.125 3.793 4.195 0.085 9 0 "[ . 1 . 2]" 1
349 1 16 LYS HG2 1 20 ARG QD . . 4.800 4.338 3.848 4.550 . 0 0 "[ . 1 . 2]" 1
350 1 16 LYS HG3 1 17 LEU H . . 4.010 3.801 3.407 4.037 0.027 2 0 "[ . 1 . 2]" 1
351 1 16 LYS HG3 1 19 ILE MD . . 5.500 4.763 4.134 5.476 . 0 0 "[ . 1 . 2]" 1
352 1 16 LYS HG3 1 20 ARG H . . 5.500 5.325 4.969 5.568 0.068 11 0 "[ . 1 . 2]" 1
353 1 16 LYS HG3 1 20 ARG QD . . 5.500 3.058 2.379 3.355 . 0 0 "[ . 1 . 2]" 1
354 1 17 LEU H 1 17 LEU HB2 . . 3.360 2.082 2.030 2.130 . 0 0 "[ . 1 . 2]" 1
355 1 17 LEU H 1 17 LEU HB3 . . 3.400 3.373 3.203 3.454 0.054 4 0 "[ . 1 . 2]" 1
356 1 17 LEU H 1 17 LEU QD . . 4.060 3.017 2.586 3.535 . 0 0 "[ . 1 . 2]" 1
357 1 17 LEU H 1 18 LYS HA . . 5.420 5.456 5.382 5.503 0.083 11 0 "[ . 1 . 2]" 1
358 1 17 LEU H 1 19 ILE HB . . 5.500 5.387 5.179 5.584 0.084 1 0 "[ . 1 . 2]" 1
359 1 17 LEU H 1 20 ARG QB . . 5.500 5.435 4.942 5.586 0.086 19 0 "[ . 1 . 2]" 1
360 1 17 LEU H 1 20 ARG QD . . 4.660 3.948 3.825 4.493 . 0 0 "[ . 1 . 2]" 1
361 1 17 LEU HA 1 17 LEU HB3 . . 2.980 2.913 2.839 3.005 0.025 1 0 "[ . 1 . 2]" 1
362 1 17 LEU HA 1 17 LEU QD . . 3.370 2.008 1.847 2.237 . 0 0 "[ . 1 . 2]" 1
363 1 17 LEU HA 1 17 LEU HG . . 4.090 3.302 2.240 3.686 . 0 0 "[ . 1 . 2]" 1
364 1 17 LEU HA 1 19 ILE H . . 5.500 3.888 3.645 4.286 . 0 0 "[ . 1 . 2]" 1
365 1 17 LEU HA 1 20 ARG H . . 4.110 3.264 3.104 3.491 . 0 0 "[ . 1 . 2]" 1
366 1 17 LEU HA 1 20 ARG QB . . 3.270 2.906 2.358 3.228 . 0 0 "[ . 1 . 2]" 1
367 1 17 LEU HA 1 20 ARG QD . . 4.840 2.078 1.821 3.390 . 0 0 "[ . 1 . 2]" 1
368 1 17 LEU HA 1 20 ARG QG . . 3.820 3.707 1.848 3.938 0.118 14 0 "[ . 1 . 2]" 1
369 1 17 LEU HA 1 37 TRP HH2 . . 4.810 4.890 4.871 4.904 0.094 6 0 "[ . 1 . 2]" 1
370 1 17 LEU HB2 1 18 LYS H . . 3.380 3.437 3.346 3.458 0.078 17 0 "[ . 1 . 2]" 1
371 1 17 LEU HB2 1 37 TRP HZ2 . . 4.900 3.635 3.266 4.034 . 0 0 "[ . 1 . 2]" 1
372 1 17 LEU QD 1 18 LYS H . . 4.770 4.124 3.954 4.280 . 0 0 "[ . 1 . 2]" 1
373 1 17 LEU QD 1 18 LYS HA . . 4.810 4.647 4.377 4.725 . 0 0 "[ . 1 . 2]" 1
374 1 17 LEU QD 1 20 ARG QB . . 4.260 2.321 2.144 2.483 . 0 0 "[ . 1 . 2]" 1
375 1 17 LEU QD 1 20 ARG QD . . 5.300 2.314 1.888 4.220 . 0 0 "[ . 1 . 2]" 1
376 1 17 LEU QD 1 21 SER QB . . 4.640 3.898 3.019 4.670 0.030 5 0 "[ . 1 . 2]" 1
377 1 17 LEU HG 1 20 ARG QD . . 5.500 4.297 2.823 5.319 . 0 0 "[ . 1 . 2]" 1
378 1 18 LYS H 1 18 LYS HB3 . . 3.470 2.300 2.072 2.684 . 0 0 "[ . 1 . 2]" 1
379 1 18 LYS H 1 18 LYS QE . . 4.740 4.416 3.968 4.834 0.094 7 0 "[ . 1 . 2]" 1
380 1 18 LYS H 1 19 ILE HA . . 5.500 5.328 5.204 5.562 0.062 1 0 "[ . 1 . 2]" 1
381 1 18 LYS H 1 20 ARG QD . . 5.500 4.565 4.255 5.303 . 0 0 "[ . 1 . 2]" 1
382 1 18 LYS HA 1 18 LYS QE . . 5.080 5.109 4.826 5.175 0.095 10 0 "[ . 1 . 2]" 1
383 1 18 LYS HA 1 21 SER H . . 4.190 3.305 2.948 3.536 . 0 0 "[ . 1 . 2]" 1
384 1 18 LYS HA 1 21 SER QB . . 4.820 4.647 3.870 4.909 0.089 5 0 "[ . 1 . 2]" 1
385 1 18 LYS HA 1 22 ALA H . . 5.500 4.410 4.025 4.644 . 0 0 "[ . 1 . 2]" 1
386 1 18 LYS HA 1 28 ILE MD . . 5.310 4.225 3.973 5.264 . 0 0 "[ . 1 . 2]" 1
387 1 18 LYS HA 1 28 ILE QG . . 5.500 5.590 5.488 5.607 0.107 12 0 "[ . 1 . 2]" 1
388 1 18 LYS QD 1 19 ILE H . . 4.350 2.279 1.989 2.958 . 0 0 "[ . 1 . 2]" 1
389 1 18 LYS QD 1 19 ILE MG . . 4.650 4.186 3.929 4.651 0.001 1 0 "[ . 1 . 2]" 1
390 1 18 LYS QD 1 20 ARG QD . . 5.500 5.210 4.722 5.425 . 0 0 "[ . 1 . 2]" 1
391 1 18 LYS QE 1 19 ILE HB . . 4.150 2.438 1.966 4.232 0.082 7 0 "[ . 1 . 2]" 1
392 1 18 LYS QE 1 19 ILE HG12 . . 3.950 3.552 3.324 4.044 0.094 7 0 "[ . 1 . 2]" 1
393 1 18 LYS QE 1 42 LEU HB3 . . 4.260 3.563 2.768 4.292 0.032 17 0 "[ . 1 . 2]" 1
394 1 18 LYS QE 1 42 LEU QD . . 5.450 2.373 1.844 3.616 . 0 0 "[ . 1 . 2]" 1
395 1 19 ILE H 1 19 ILE HB . . 3.190 1.989 1.894 2.167 . 0 0 "[ . 1 . 2]" 1
396 1 19 ILE H 1 19 ILE MD . . 4.010 3.709 3.459 4.007 . 0 0 "[ . 1 . 2]" 1
397 1 19 ILE H 1 19 ILE HG12 . . 4.910 4.521 4.319 4.657 . 0 0 "[ . 1 . 2]" 1
398 1 19 ILE H 1 19 ILE HG13 . . 4.410 3.755 3.272 4.056 . 0 0 "[ . 1 . 2]" 1
399 1 19 ILE H 1 19 ILE MG . . 4.320 3.007 2.788 3.445 . 0 0 "[ . 1 . 2]" 1
400 1 19 ILE H 1 20 ARG QD . . 4.530 3.616 2.891 4.141 . 0 0 "[ . 1 . 2]" 1
401 1 19 ILE H 1 21 SER H . . 5.500 3.951 3.680 4.143 . 0 0 "[ . 1 . 2]" 1
402 1 19 ILE HA 1 19 ILE MD . . 3.670 3.664 3.543 3.737 0.067 8 0 "[ . 1 . 2]" 1
403 1 19 ILE HA 1 19 ILE HG12 . . 3.970 2.917 2.474 3.136 . 0 0 "[ . 1 . 2]" 1
404 1 19 ILE HA 1 19 ILE HG13 . . 3.980 2.234 2.110 2.330 . 0 0 "[ . 1 . 2]" 1
405 1 19 ILE HA 1 19 ILE MG . . 3.430 3.177 2.987 3.258 . 0 0 "[ . 1 . 2]" 1
406 1 19 ILE HA 1 20 ARG QG . . 5.270 5.291 4.996 5.367 0.097 8 0 "[ . 1 . 2]" 1
407 1 19 ILE HA 1 21 SER H . . 5.210 4.114 3.659 4.527 . 0 0 "[ . 1 . 2]" 1
408 1 19 ILE HA 1 22 ALA H . . 4.650 4.658 4.410 4.723 0.073 10 0 "[ . 1 . 2]" 1
409 1 19 ILE HA 1 22 ALA MB . . 4.140 4.240 4.206 4.261 0.121 14 0 "[ . 1 . 2]" 1
410 1 19 ILE HA 1 42 LEU QD . . 5.500 5.298 4.912 5.434 . 0 0 "[ . 1 . 2]" 1
411 1 19 ILE HB 1 20 ARG H . . 3.850 3.470 3.136 3.670 . 0 0 "[ . 1 . 2]" 1
412 1 19 ILE HB 1 20 ARG HA . . 5.500 5.462 5.242 5.567 0.067 18 0 "[ . 1 . 2]" 1
413 1 19 ILE HB 1 21 SER H . . 5.500 5.406 5.218 5.552 0.052 11 0 "[ . 1 . 2]" 1
414 1 19 ILE HB 1 42 LEU QD . . 5.500 3.658 3.052 3.957 . 0 0 "[ . 1 . 2]" 1
415 1 19 ILE MD 1 19 ILE MG . . 3.100 2.127 2.020 2.204 . 0 0 "[ . 1 . 2]" 1
416 1 19 ILE MD 1 20 ARG QG . . 5.500 5.406 5.009 5.586 0.086 11 0 "[ . 1 . 2]" 1
417 1 19 ILE MD 1 42 LEU HA . . 5.500 5.233 4.711 5.585 0.085 3 0 "[ . 1 . 2]" 1
418 1 19 ILE MD 1 42 LEU HB2 . . 5.500 5.099 4.591 5.578 0.078 14 0 "[ . 1 . 2]" 1
419 1 19 ILE MD 1 42 LEU HB3 . . 5.500 4.323 3.672 4.826 . 0 0 "[ . 1 . 2]" 1
420 1 19 ILE MD 1 42 LEU QD . . 3.640 1.933 1.826 2.053 . 0 0 "[ . 1 . 2]" 1
421 1 19 ILE HG12 1 19 ILE MG . . 3.170 2.319 2.230 2.510 . 0 0 "[ . 1 . 2]" 1
422 1 19 ILE HG13 1 19 ILE MG . . 3.190 3.212 3.166 3.250 0.060 15 0 "[ . 1 . 2]" 1
423 1 19 ILE HG13 1 20 ARG H . . 5.500 5.064 4.860 5.137 . 0 0 "[ . 1 . 2]" 1
424 1 19 ILE MG 1 20 ARG HA . . 4.080 3.395 3.254 3.913 . 0 0 "[ . 1 . 2]" 1
425 1 19 ILE MG 1 20 ARG QD . . 5.100 2.427 2.103 2.982 . 0 0 "[ . 1 . 2]" 1
426 1 19 ILE MG 1 20 ARG QG . . 4.670 2.564 2.126 3.795 . 0 0 "[ . 1 . 2]" 1
427 1 19 ILE MG 1 42 LEU QD . . 3.850 3.701 3.320 3.794 . 0 0 "[ . 1 . 2]" 1
428 1 20 ARG H 1 20 ARG QB . . 3.100 2.424 2.209 2.879 . 0 0 "[ . 1 . 2]" 1
429 1 20 ARG H 1 20 ARG QD . . 5.030 2.614 1.913 3.166 . 0 0 "[ . 1 . 2]" 1
430 1 20 ARG H 1 20 ARG QG . . 3.350 2.826 1.829 3.030 . 0 0 "[ . 1 . 2]" 1
431 1 20 ARG H 1 21 SER H . . 3.660 2.530 2.210 2.746 . 0 0 "[ . 1 . 2]" 1
432 1 20 ARG H 1 21 SER QB . . 4.780 4.820 4.343 4.876 0.096 20 0 "[ . 1 . 2]" 1
433 1 20 ARG HA 1 20 ARG QD . . 4.470 3.812 3.563 3.960 . 0 0 "[ . 1 . 2]" 1
434 1 20 ARG HA 1 20 ARG QG . . 3.320 2.434 2.233 3.396 0.076 11 0 "[ . 1 . 2]" 1
435 1 20 ARG QB 1 21 SER H . . 3.700 3.021 2.598 3.510 . 0 0 "[ . 1 . 2]" 1
436 1 20 ARG QB 1 21 SER QB . . 5.110 3.589 3.074 3.911 . 0 0 "[ . 1 . 2]" 1
437 1 20 ARG QG 1 21 SER H . . 4.960 4.476 3.656 4.718 . 0 0 "[ . 1 . 2]" 1
438 1 21 SER H 1 21 SER QB . . 3.240 2.929 2.687 3.199 . 0 0 "[ . 1 . 2]" 1
439 1 21 SER H 1 22 ALA HA . . 5.210 5.092 4.865 5.267 0.057 10 0 "[ . 1 . 2]" 1
440 1 21 SER H 1 22 ALA MB . . 4.860 3.833 3.610 4.099 . 0 0 "[ . 1 . 2]" 1
441 1 21 SER HA 1 21 SER QB . . 2.740 2.441 2.272 2.581 . 0 0 "[ . 1 . 2]" 1
442 1 21 SER QB 1 22 ALA H . . 4.210 3.879 3.562 4.117 . 0 0 "[ . 1 . 2]" 1
443 1 22 ALA H 1 22 ALA MB . . 3.040 2.952 2.867 3.051 0.011 9 0 "[ . 1 . 2]" 1
444 1 22 ALA HA 1 23 LYS H . . 2.980 2.466 2.289 2.574 . 0 0 "[ . 1 . 2]" 1
445 1 22 ALA HA 1 23 LYS HA . . 4.850 4.556 4.456 4.636 . 0 0 "[ . 1 . 2]" 1
446 1 22 ALA HA 1 23 LYS HB2 . . 5.400 4.121 3.798 4.327 . 0 0 "[ . 1 . 2]" 1
447 1 22 ALA HA 1 23 LYS HB3 . . 5.220 5.198 4.945 5.291 0.071 4 0 "[ . 1 . 2]" 1
448 1 22 ALA HA 1 23 LYS QD . . 4.960 5.034 4.877 5.064 0.104 2 0 "[ . 1 . 2]" 1
449 1 22 ALA HA 1 26 ASP HB2 . . 4.430 3.730 3.182 4.488 0.058 5 0 "[ . 1 . 2]" 1
450 1 22 ALA HA 1 26 ASP HB3 . . 5.020 4.379 3.662 4.805 . 0 0 "[ . 1 . 2]" 1
451 1 22 ALA MB 1 23 LYS H . . 3.430 2.250 2.016 2.606 . 0 0 "[ . 1 . 2]" 1
452 1 22 ALA MB 1 23 LYS HA . . 5.060 3.740 3.507 3.965 . 0 0 "[ . 1 . 2]" 1
453 1 22 ALA MB 1 26 ASP HA . . 5.180 5.106 4.533 5.282 0.102 16 0 "[ . 1 . 2]" 1
454 1 22 ALA MB 1 26 ASP HB2 . . 3.740 3.026 2.633 3.411 . 0 0 "[ . 1 . 2]" 1
455 1 22 ALA MB 1 26 ASP HB3 . . 3.940 2.993 2.612 3.396 . 0 0 "[ . 1 . 2]" 1
456 1 22 ALA MB 1 44 THR HA . . 5.500 5.017 4.692 5.502 0.002 8 0 "[ . 1 . 2]" 1
457 1 22 ALA MB 1 44 THR HB . . 5.430 5.163 4.544 5.552 0.122 20 0 "[ . 1 . 2]" 1
458 1 22 ALA MB 1 45 PRO HD2 . . 5.490 3.895 3.331 4.301 . 0 0 "[ . 1 . 2]" 1
459 1 22 ALA MB 1 45 PRO HD3 . . 5.500 4.967 4.067 5.578 0.078 8 0 "[ . 1 . 2]" 1
460 1 22 ALA MB 1 46 ALA H . . 4.830 4.645 4.297 4.904 0.074 13 0 "[ . 1 . 2]" 1
461 1 22 ALA MB 1 46 ALA MB . . 3.340 3.108 2.673 3.382 0.042 13 0 "[ . 1 . 2]" 1
462 1 23 LYS H 1 23 LYS HB2 . . 4.070 2.951 2.711 3.217 . 0 0 "[ . 1 . 2]" 1
463 1 23 LYS H 1 23 LYS HB3 . . 3.570 3.279 3.111 3.494 . 0 0 "[ . 1 . 2]" 1
464 1 23 LYS H 1 26 ASP HA . . 5.500 4.590 4.218 4.993 . 0 0 "[ . 1 . 2]" 1
465 1 23 LYS H 1 26 ASP HB2 . . 4.130 2.129 1.662 3.054 . 0 0 "[ . 1 . 2]" 1
466 1 23 LYS H 1 26 ASP HB3 . . 4.620 3.309 2.862 4.141 . 0 0 "[ . 1 . 2]" 1
467 1 23 LYS H 1 46 ALA HA . . 5.500 5.524 5.131 5.582 0.082 10 0 "[ . 1 . 2]" 1
468 1 23 LYS H 1 46 ALA MB . . 4.560 3.797 3.407 4.082 . 0 0 "[ . 1 . 2]" 1
469 1 23 LYS HA 1 23 LYS QD . . 3.600 2.661 2.022 3.609 0.009 5 0 "[ . 1 . 2]" 1
470 1 23 LYS HA 1 23 LYS QE . . 4.040 3.028 1.713 4.064 0.024 4 0 "[ . 1 . 2]" 1
471 1 23 LYS HA 1 23 LYS QG . . 3.520 2.473 2.243 2.697 . 0 0 "[ . 1 . 2]" 1
472 1 23 LYS HA 1 24 ALA H . . 3.160 2.696 2.528 2.876 . 0 0 "[ . 1 . 2]" 1
473 1 23 LYS HA 1 24 ALA HA . . 4.330 4.294 4.128 4.395 0.065 11 0 "[ . 1 . 2]" 1
474 1 23 LYS HA 1 25 GLU H . . 4.570 4.405 4.023 4.633 0.063 9 0 "[ . 1 . 2]" 1
475 1 23 LYS HA 1 26 ASP H . . 5.500 5.559 5.374 5.592 0.092 18 0 "[ . 1 . 2]" 1
476 1 23 LYS HA 1 45 PRO HG2 . . 3.830 3.383 2.891 3.860 0.030 4 0 "[ . 1 . 2]" 1
477 1 23 LYS HA 1 45 PRO HG3 . . 4.790 4.136 3.332 4.670 . 0 0 "[ . 1 . 2]" 1
478 1 23 LYS HB2 1 23 LYS QD . . 3.790 2.534 2.188 2.923 . 0 0 "[ . 1 . 2]" 1
479 1 23 LYS HB2 1 23 LYS QE . . 5.000 2.506 2.006 3.348 . 0 0 "[ . 1 . 2]" 1
480 1 23 LYS HB2 1 24 ALA H . . 3.660 3.730 3.666 3.751 0.091 7 0 "[ . 1 . 2]" 1
481 1 23 LYS HB2 1 25 GLU H . . 4.150 3.983 3.604 4.214 0.064 4 0 "[ . 1 . 2]" 1
482 1 23 LYS HB3 1 23 LYS QE . . 3.390 3.464 3.341 3.511 0.121 9 0 "[ . 1 . 2]" 1
483 1 23 LYS HB3 1 24 ALA H . . 3.950 2.457 2.242 2.660 . 0 0 "[ . 1 . 2]" 1
484 1 23 LYS HB3 1 24 ALA HA . . 4.660 4.607 4.504 4.696 0.036 16 0 "[ . 1 . 2]" 1
485 1 23 LYS HB3 1 25 GLU H . . 3.950 2.347 2.019 2.600 . 0 0 "[ . 1 . 2]" 1
486 1 23 LYS HB3 1 26 ASP H . . 4.630 4.468 3.892 4.713 0.083 14 0 "[ . 1 . 2]" 1
487 1 23 LYS QD 1 24 ALA H . . 4.510 3.959 3.482 4.452 . 0 0 "[ . 1 . 2]" 1
488 1 23 LYS QG 1 24 ALA H . . 4.830 2.088 1.746 2.462 . 0 0 "[ . 1 . 2]" 1
489 1 23 LYS QG 1 24 ALA HA . . 4.750 4.699 4.455 4.834 0.084 10 0 "[ . 1 . 2]" 1
490 1 24 ALA H 1 24 ALA MB . . 2.930 2.288 2.205 2.363 . 0 0 "[ . 1 . 2]" 1
491 1 24 ALA H 1 25 GLU HA . . 5.500 5.188 4.962 5.368 . 0 0 "[ . 1 . 2]" 1
492 1 24 ALA H 1 45 PRO HB2 . . 4.970 3.953 3.626 4.348 . 0 0 "[ . 1 . 2]" 1
493 1 24 ALA H 1 45 PRO HG2 . . 3.670 3.371 3.049 3.642 . 0 0 "[ . 1 . 2]" 1
494 1 24 ALA H 1 45 PRO HG3 . . 4.490 4.339 3.873 4.558 0.068 17 0 "[ . 1 . 2]" 1
495 1 24 ALA HA 1 25 GLU HA . . 4.920 4.670 4.534 4.768 . 0 0 "[ . 1 . 2]" 1
496 1 24 ALA HA 1 26 ASP H . . 4.370 3.671 3.473 3.953 . 0 0 "[ . 1 . 2]" 1
497 1 24 ALA HA 1 45 PRO HA . . 4.540 4.105 3.976 4.252 . 0 0 "[ . 1 . 2]" 1
498 1 24 ALA HA 1 45 PRO HB2 . . 3.910 2.209 2.116 2.325 . 0 0 "[ . 1 . 2]" 1
499 1 24 ALA HA 1 45 PRO HB3 . . 3.790 3.852 3.726 3.981 0.191 6 0 "[ . 1 . 2]" 1
500 1 24 ALA HA 1 45 PRO HD2 . . 3.820 3.898 3.874 3.908 0.088 15 0 "[ . 1 . 2]" 1
501 1 24 ALA HA 1 45 PRO HG2 . . 4.270 2.326 2.036 2.802 . 0 0 "[ . 1 . 2]" 1
502 1 24 ALA HA 1 46 ALA H . . 4.540 3.583 3.455 3.753 . 0 0 "[ . 1 . 2]" 1
503 1 24 ALA HA 1 46 ALA HA . . 3.180 3.056 2.839 3.266 0.086 10 0 "[ . 1 . 2]" 1
504 1 24 ALA HA 1 46 ALA MB . . 3.910 3.670 3.523 3.810 . 0 0 "[ . 1 . 2]" 1
505 1 24 ALA MB 1 25 GLU H . . 3.420 2.804 2.547 3.236 . 0 0 "[ . 1 . 2]" 1
506 1 24 ALA MB 1 25 GLU HA . . 3.860 3.920 3.813 3.976 0.116 14 0 "[ . 1 . 2]" 1
507 1 24 ALA MB 1 25 GLU QG . . 4.360 3.819 2.911 4.478 0.118 17 0 "[ . 1 . 2]" 1
508 1 24 ALA MB 1 26 ASP H . . 4.720 4.322 4.169 4.605 . 0 0 "[ . 1 . 2]" 1
509 1 24 ALA MB 1 45 PRO HA . . 4.310 4.193 3.942 4.371 0.061 8 0 "[ . 1 . 2]" 1
510 1 24 ALA MB 1 45 PRO HB2 . . 3.640 2.170 2.057 2.253 . 0 0 "[ . 1 . 2]" 1
511 1 24 ALA MB 1 45 PRO HB3 . . 3.530 3.440 3.292 3.532 0.002 7 0 "[ . 1 . 2]" 1
512 1 24 ALA MB 1 45 PRO HG2 . . 4.110 3.218 2.970 3.538 . 0 0 "[ . 1 . 2]" 1
513 1 24 ALA MB 1 45 PRO HG3 . . 5.220 3.744 3.341 4.146 . 0 0 "[ . 1 . 2]" 1
514 1 24 ALA MB 1 46 ALA H . . 4.810 4.883 4.835 4.910 0.100 14 0 "[ . 1 . 2]" 1
515 1 25 GLU H 1 25 GLU QB . . 3.280 2.575 1.975 3.060 . 0 0 "[ . 1 . 2]" 1
516 1 25 GLU H 1 25 GLU QG . . 3.870 2.879 1.608 3.958 0.088 12 0 "[ . 1 . 2]" 1
517 1 25 GLU H 1 26 ASP HA . . 5.500 4.963 4.617 5.240 . 0 0 "[ . 1 . 2]" 1
518 1 25 GLU H 1 26 ASP HB2 . . 5.260 4.079 3.716 4.470 . 0 0 "[ . 1 . 2]" 1
519 1 25 GLU H 1 26 ASP HB3 . . 5.500 5.428 5.097 5.585 0.085 18 0 "[ . 1 . 2]" 1
520 1 25 GLU HA 1 25 GLU QG . . 3.090 2.688 2.108 3.223 0.133 16 0 "[ . 1 . 2]" 1
521 1 25 GLU HA 1 26 ASP HA . . 4.330 4.331 4.076 4.417 0.087 16 0 "[ . 1 . 2]" 1
522 1 25 GLU HA 1 26 ASP HB2 . . 4.770 4.852 4.819 4.863 0.093 7 0 "[ . 1 . 2]" 1
523 1 25 GLU QB 1 26 ASP HA . . 4.370 4.299 4.236 4.327 . 0 0 "[ . 1 . 2]" 1
524 1 25 GLU QG 1 26 ASP H . . 4.930 4.333 3.756 4.760 . 0 0 "[ . 1 . 2]" 1
525 1 26 ASP H 1 26 ASP HB2 . . 3.490 2.521 2.089 2.901 . 0 0 "[ . 1 . 2]" 1
526 1 26 ASP H 1 26 ASP HB3 . . 3.880 3.009 2.620 3.429 . 0 0 "[ . 1 . 2]" 1
527 1 26 ASP H 1 27 LYS HA . . 5.500 5.029 4.770 5.252 . 0 0 "[ . 1 . 2]" 1
528 1 26 ASP H 1 46 ALA HA . . 4.340 2.772 2.519 2.966 . 0 0 "[ . 1 . 2]" 1
529 1 26 ASP H 1 46 ALA MB . . 4.180 2.917 2.540 3.151 . 0 0 "[ . 1 . 2]" 1
530 1 26 ASP HA 1 27 LYS H . . 3.200 2.602 2.483 2.777 . 0 0 "[ . 1 . 2]" 1
531 1 26 ASP HA 1 27 LYS QE . . 5.210 3.844 2.238 5.286 0.076 7 0 "[ . 1 . 2]" 1
532 1 26 ASP HA 1 46 ALA MB . . 4.770 4.059 3.973 4.201 . 0 0 "[ . 1 . 2]" 1
533 1 26 ASP HA 1 47 LYS H . . 5.500 5.412 5.172 5.577 0.077 2 0 "[ . 1 . 2]" 1
534 1 26 ASP HB2 1 27 LYS H . . 4.130 4.044 3.859 4.198 0.068 10 0 "[ . 1 . 2]" 1
535 1 26 ASP HB2 1 46 ALA H . . 5.500 5.453 4.654 5.576 0.076 16 0 "[ . 1 . 2]" 1
536 1 26 ASP HB2 1 46 ALA HA . . 4.590 4.368 3.260 4.663 0.073 2 0 "[ . 1 . 2]" 1
537 1 26 ASP HB2 1 46 ALA MB . . 3.800 2.966 2.097 3.374 . 0 0 "[ . 1 . 2]" 1
538 1 26 ASP HB3 1 27 LYS H . . 4.030 3.078 2.639 3.613 . 0 0 "[ . 1 . 2]" 1
539 1 26 ASP HB3 1 46 ALA HA . . 5.500 4.010 3.531 4.927 . 0 0 "[ . 1 . 2]" 1
540 1 26 ASP HB3 1 46 ALA MB . . 4.090 2.152 1.975 2.873 . 0 0 "[ . 1 . 2]" 1
541 1 27 LYS H 1 27 LYS HB3 . . 3.740 3.754 3.507 3.818 0.078 2 0 "[ . 1 . 2]" 1
542 1 27 LYS H 1 28 ILE HA . . 5.500 4.861 4.619 5.088 . 0 0 "[ . 1 . 2]" 1
543 1 27 LYS H 1 46 ALA MB . . 5.160 3.758 3.449 4.114 . 0 0 "[ . 1 . 2]" 1
544 1 27 LYS HA 1 27 LYS QE . . 5.090 4.562 3.322 5.188 0.098 7 0 "[ . 1 . 2]" 1
545 1 27 LYS HA 1 28 ILE H . . 3.140 2.280 2.204 2.362 . 0 0 "[ . 1 . 2]" 1
546 1 27 LYS HA 1 47 LYS H . . 3.990 2.988 2.286 3.618 . 0 0 "[ . 1 . 2]" 1
547 1 27 LYS HA 1 47 LYS QG . . 4.800 2.265 1.905 3.871 . 0 0 "[ . 1 . 2]" 1
548 1 27 LYS HB2 1 27 LYS QE . . 4.530 3.713 2.217 4.234 . 0 0 "[ . 1 . 2]" 1
549 1 27 LYS HB3 1 47 LYS H . . 5.500 5.217 4.362 5.571 0.071 16 0 "[ . 1 . 2]" 1
550 1 27 LYS QE 1 27 LYS HG3 . . 3.510 2.430 2.167 3.023 . 0 0 "[ . 1 . 2]" 1
551 1 28 ILE H 1 28 ILE HB . . 3.590 3.044 2.857 3.196 . 0 0 "[ . 1 . 2]" 1
552 1 28 ILE H 1 28 ILE MD . . 4.080 3.977 2.434 4.165 0.085 17 0 "[ . 1 . 2]" 1
553 1 28 ILE H 1 28 ILE QG . . 4.130 2.900 2.700 3.500 . 0 0 "[ . 1 . 2]" 1
554 1 28 ILE H 1 28 ILE MG . . 4.130 3.987 3.959 4.021 . 0 0 "[ . 1 . 2]" 1
555 1 28 ILE H 1 29 VAL HA . . 5.500 4.874 4.705 5.046 . 0 0 "[ . 1 . 2]" 1
556 1 28 ILE H 1 46 ALA MB . . 4.370 3.938 3.487 4.332 . 0 0 "[ . 1 . 2]" 1
557 1 28 ILE H 1 47 LYS HA . . 5.500 5.199 4.674 5.511 0.011 16 0 "[ . 1 . 2]" 1
558 1 28 ILE H 1 47 LYS HB2 . . 5.490 4.364 2.665 5.198 . 0 0 "[ . 1 . 2]" 1
559 1 28 ILE H 1 48 VAL HA . . 3.880 3.668 3.311 3.929 0.049 9 0 "[ . 1 . 2]" 1
560 1 28 ILE H 1 48 VAL QG . . 4.170 3.954 3.399 4.142 . 0 0 "[ . 1 . 2]" 1
561 1 28 ILE HA 1 28 ILE MD . . 4.010 4.058 3.537 4.105 0.095 3 0 "[ . 1 . 2]" 1
562 1 28 ILE HA 1 28 ILE QG . . 3.930 2.899 2.651 2.992 . 0 0 "[ . 1 . 2]" 1
563 1 28 ILE HA 1 28 ILE MG . . 3.460 2.158 2.089 2.221 . 0 0 "[ . 1 . 2]" 1
564 1 28 ILE HA 1 29 VAL H . . 3.140 2.356 2.173 2.449 . 0 0 "[ . 1 . 2]" 1
565 1 28 ILE HA 1 29 VAL HB . . 4.270 4.339 4.307 4.355 0.085 3 0 "[ . 1 . 2]" 1
566 1 28 ILE HA 1 29 VAL MG2 . . 4.850 3.803 3.606 4.066 . 0 0 "[ . 1 . 2]" 1
567 1 28 ILE HA 1 46 ALA MB . . 5.500 5.387 5.182 5.596 0.096 15 0 "[ . 1 . 2]" 1
568 1 28 ILE HA 1 85 PHE QD . . 5.500 2.881 1.923 4.686 . 0 0 "[ . 1 . 2]" 1
569 1 28 ILE HB 1 28 ILE MD . . 3.600 2.252 2.105 2.343 . 0 0 "[ . 1 . 2]" 1
570 1 28 ILE HB 1 29 VAL H . . 5.500 3.334 3.202 3.470 . 0 0 "[ . 1 . 2]" 1
571 1 28 ILE HB 1 47 LYS H . . 5.500 5.567 5.485 5.583 0.083 19 0 "[ . 1 . 2]" 1
572 1 28 ILE HB 1 48 VAL HA . . 3.540 3.076 2.603 3.234 . 0 0 "[ . 1 . 2]" 1
573 1 28 ILE HB 1 49 TYR H . . 4.340 4.392 4.226 4.424 0.084 20 0 "[ . 1 . 2]" 1
574 1 28 ILE MD 1 29 VAL H . . 4.620 4.723 4.710 4.739 0.119 15 0 "[ . 1 . 2]" 1
575 1 28 ILE MD 1 46 ALA H . . 4.630 4.210 4.000 4.466 . 0 0 "[ . 1 . 2]" 1
576 1 28 ILE MD 1 46 ALA MB . . 3.390 2.308 1.961 2.513 . 0 0 "[ . 1 . 2]" 1
577 1 28 ILE MD 1 47 LYS H . . 5.020 4.676 3.351 5.046 0.026 11 0 "[ . 1 . 2]" 1
578 1 28 ILE MD 1 48 VAL HA . . 4.850 4.095 3.659 4.444 . 0 0 "[ . 1 . 2]" 1
579 1 28 ILE QG 1 29 VAL H . . 5.440 4.355 4.043 4.497 . 0 0 "[ . 1 . 2]" 1
580 1 28 ILE QG 1 48 VAL HA . . 5.500 4.662 4.305 5.067 . 0 0 "[ . 1 . 2]" 1
581 1 28 ILE QG 1 85 PHE QB . . 5.500 3.359 2.800 3.886 . 0 0 "[ . 1 . 2]" 1
582 1 28 ILE QG 1 85 PHE QD . . 4.220 4.246 3.668 4.350 0.130 10 0 "[ . 1 . 2]" 1
583 1 28 ILE MG 1 29 VAL H . . 3.610 1.867 1.770 1.969 . 0 0 "[ . 1 . 2]" 1
584 1 28 ILE MG 1 29 VAL HB . . 4.490 4.402 4.244 4.523 0.033 7 0 "[ . 1 . 2]" 1
585 1 29 VAL H 1 29 VAL HB . . 3.760 2.894 2.742 2.975 . 0 0 "[ . 1 . 2]" 1
586 1 29 VAL H 1 29 VAL MG1 . . 4.040 3.942 3.821 4.012 . 0 0 "[ . 1 . 2]" 1
587 1 29 VAL H 1 49 TYR H . . 5.270 4.763 4.551 4.983 . 0 0 "[ . 1 . 2]" 1
588 1 29 VAL HA 1 29 VAL MG1 . . 3.660 2.583 2.496 2.748 . 0 0 "[ . 1 . 2]" 1
589 1 29 VAL HA 1 29 VAL MG2 . . 3.450 2.232 2.110 2.296 . 0 0 "[ . 1 . 2]" 1
590 1 29 VAL HA 1 30 LEU H . . 3.250 2.412 2.291 2.567 . 0 0 "[ . 1 . 2]" 1
591 1 29 VAL HA 1 30 LEU MD2 . . 4.140 3.407 3.112 3.698 . 0 0 "[ . 1 . 2]" 1
592 1 29 VAL HA 1 30 LEU HG . . 4.850 3.765 3.527 3.994 . 0 0 "[ . 1 . 2]" 1
593 1 29 VAL HA 1 49 TYR H . . 3.960 2.442 2.162 2.720 . 0 0 "[ . 1 . 2]" 1
594 1 29 VAL HA 1 49 TYR HB2 . . 4.880 3.252 2.949 3.395 . 0 0 "[ . 1 . 2]" 1
595 1 29 VAL HA 1 49 TYR HB3 . . 4.640 4.643 4.459 4.721 0.081 3 0 "[ . 1 . 2]" 1
596 1 29 VAL HA 1 49 TYR QD . . 4.660 4.334 3.742 4.712 0.052 10 0 "[ . 1 . 2]" 1
597 1 29 VAL HA 1 50 ALA H . . 5.500 5.139 5.017 5.301 . 0 0 "[ . 1 . 2]" 1
598 1 29 VAL HA 1 50 ALA HA . . 4.360 4.040 3.857 4.265 . 0 0 "[ . 1 . 2]" 1
599 1 29 VAL HA 1 51 ILE MD . . 5.500 5.461 5.137 5.582 0.082 19 0 "[ . 1 . 2]" 1
600 1 29 VAL HB 1 75 PHE QD . . 4.870 3.064 2.699 3.417 . 0 0 "[ . 1 . 2]" 1
601 1 29 VAL HB 1 75 PHE HZ . . 4.530 4.170 3.465 4.599 0.069 14 0 "[ . 1 . 2]" 1
602 1 29 VAL MG1 1 31 ILE MG . . 3.340 2.475 2.276 2.654 . 0 0 "[ . 1 . 2]" 1
603 1 29 VAL MG1 1 49 TYR H . . 4.750 4.066 3.721 4.454 . 0 0 "[ . 1 . 2]" 1
604 1 29 VAL MG1 1 49 TYR HB2 . . 4.520 3.189 2.763 3.856 . 0 0 "[ . 1 . 2]" 1
605 1 29 VAL MG1 1 49 TYR HB3 . . 4.670 3.880 3.492 4.265 . 0 0 "[ . 1 . 2]" 1
606 1 29 VAL MG1 1 75 PHE QD . . 3.660 2.826 2.602 3.023 . 0 0 "[ . 1 . 2]" 1
607 1 29 VAL MG2 1 30 LEU H . . 3.730 3.780 3.643 3.829 0.099 12 0 "[ . 1 . 2]" 1
608 1 29 VAL MG2 1 48 VAL HA . . 5.500 4.138 3.765 4.442 . 0 0 "[ . 1 . 2]" 1
609 1 29 VAL MG2 1 49 TYR H . . 5.310 3.153 2.657 3.522 . 0 0 "[ . 1 . 2]" 1
610 1 29 VAL MG2 1 49 TYR HB2 . . 4.870 2.091 2.051 2.180 . 0 0 "[ . 1 . 2]" 1
611 1 29 VAL MG2 1 49 TYR HB3 . . 4.560 3.525 3.255 3.625 . 0 0 "[ . 1 . 2]" 1
612 1 29 VAL MG2 1 50 ALA HA . . 5.020 4.751 4.565 5.059 0.039 4 0 "[ . 1 . 2]" 1
613 1 29 VAL MG2 1 51 ILE MD . . 3.960 3.871 3.463 4.069 0.109 11 0 "[ . 1 . 2]" 1
614 1 29 VAL MG2 1 75 PHE HA . . 5.490 2.710 2.335 2.972 . 0 0 "[ . 1 . 2]" 1
615 1 29 VAL MG2 1 75 PHE HB3 . . 5.500 4.272 3.983 4.570 . 0 0 "[ . 1 . 2]" 1
616 1 29 VAL MG2 1 75 PHE QD . . 3.950 2.090 1.980 2.162 . 0 0 "[ . 1 . 2]" 1
617 1 29 VAL MG2 1 75 PHE QE . . 4.940 3.215 2.654 3.567 . 0 0 "[ . 1 . 2]" 1
618 1 30 LEU H 1 30 LEU HB2 . . 3.580 3.153 2.921 3.307 . 0 0 "[ . 1 . 2]" 1
619 1 30 LEU H 1 30 LEU MD1 . . 4.430 3.957 3.845 4.139 . 0 0 "[ . 1 . 2]" 1
620 1 30 LEU H 1 30 LEU MD2 . . 3.790 3.020 2.754 3.309 . 0 0 "[ . 1 . 2]" 1
621 1 30 LEU H 1 30 LEU HG . . 4.380 2.398 2.251 2.672 . 0 0 "[ . 1 . 2]" 1
622 1 30 LEU H 1 35 VAL HA . . 5.500 5.492 5.336 5.577 0.077 16 0 "[ . 1 . 2]" 1
623 1 30 LEU H 1 48 VAL HA . . 5.500 5.528 5.350 5.578 0.078 12 0 "[ . 1 . 2]" 1
624 1 30 LEU H 1 49 TYR HA . . 5.500 5.208 5.117 5.350 . 0 0 "[ . 1 . 2]" 1
625 1 30 LEU H 1 49 TYR HB3 . . 5.410 5.210 5.018 5.453 0.043 15 0 "[ . 1 . 2]" 1
626 1 30 LEU H 1 50 ALA HA . . 3.900 2.131 1.971 2.386 . 0 0 "[ . 1 . 2]" 1
627 1 30 LEU H 1 50 ALA MB . . 4.590 3.578 3.283 4.002 . 0 0 "[ . 1 . 2]" 1
628 1 30 LEU H 1 51 ILE HB . . 5.500 5.532 5.238 5.581 0.081 3 0 "[ . 1 . 2]" 1
629 1 30 LEU HA 1 30 LEU MD1 . . 4.330 4.094 4.021 4.143 . 0 0 "[ . 1 . 2]" 1
630 1 30 LEU HA 1 30 LEU MD2 . . 3.710 2.860 2.700 3.014 . 0 0 "[ . 1 . 2]" 1
631 1 30 LEU HA 1 31 ILE H . . 3.290 2.272 2.197 2.329 . 0 0 "[ . 1 . 2]" 1
632 1 30 LEU HA 1 31 ILE HA . . 5.000 4.446 4.388 4.492 . 0 0 "[ . 1 . 2]" 1
633 1 30 LEU HA 1 31 ILE HB . . 5.500 5.578 5.562 5.587 0.087 20 0 "[ . 1 . 2]" 1
634 1 30 LEU HA 1 31 ILE HG13 . . 5.500 5.754 5.569 6.069 0.569 7 2 "[ . + 1- . 2]" 1
635 1 30 LEU HA 1 34 GLY HA3 . . 4.840 3.708 3.406 3.965 . 0 0 "[ . 1 . 2]" 1
636 1 30 LEU HA 1 35 VAL H . . 5.500 5.122 4.761 5.540 0.040 16 0 "[ . 1 . 2]" 1
637 1 30 LEU HA 1 50 ALA HA . . 5.500 4.399 4.239 4.561 . 0 0 "[ . 1 . 2]" 1
638 1 30 LEU HA 1 51 ILE H . . 5.480 5.029 4.841 5.263 . 0 0 "[ . 1 . 2]" 1
639 1 30 LEU HB2 1 31 ILE H . . 5.140 3.477 3.320 3.681 . 0 0 "[ . 1 . 2]" 1
640 1 30 LEU HB2 1 35 VAL HA . . 3.180 2.409 2.184 2.527 . 0 0 "[ . 1 . 2]" 1
641 1 30 LEU HB2 1 35 VAL HB . . 5.500 4.403 4.100 4.632 . 0 0 "[ . 1 . 2]" 1
642 1 30 LEU HB2 1 35 VAL MG1 . . 5.210 2.759 2.387 3.524 . 0 0 "[ . 1 . 2]" 1
643 1 30 LEU HB2 1 50 ALA HA . . 3.570 2.885 2.673 3.070 . 0 0 "[ . 1 . 2]" 1
644 1 30 LEU HB2 1 50 ALA MB . . 3.710 2.652 2.214 3.232 . 0 0 "[ . 1 . 2]" 1
645 1 30 LEU HB2 1 51 ILE H . . 5.360 3.567 3.368 3.795 . 0 0 "[ . 1 . 2]" 1
646 1 30 LEU HB3 1 30 LEU MD2 . . 3.320 2.342 2.216 2.519 . 0 0 "[ . 1 . 2]" 1
647 1 30 LEU HB3 1 31 ILE H . . 4.980 3.178 3.008 3.364 . 0 0 "[ . 1 . 2]" 1
648 1 30 LEU HB3 1 34 GLY HA2 . . 4.020 4.043 3.864 4.099 0.079 16 0 "[ . 1 . 2]" 1
649 1 30 LEU HB3 1 34 GLY HA3 . . 4.090 3.187 2.993 3.378 . 0 0 "[ . 1 . 2]" 1
650 1 30 LEU HB3 1 35 VAL H . . 5.500 3.797 3.416 4.213 . 0 0 "[ . 1 . 2]" 1
651 1 30 LEU HB3 1 35 VAL HA . . 4.210 2.955 2.682 3.186 . 0 0 "[ . 1 . 2]" 1
652 1 30 LEU HB3 1 35 VAL HB . . 5.500 5.300 4.915 5.574 0.074 8 0 "[ . 1 . 2]" 1
653 1 30 LEU HB3 1 37 TRP H . . 5.500 4.038 3.863 4.244 . 0 0 "[ . 1 . 2]" 1
654 1 30 LEU HB3 1 37 TRP QB . . 4.540 3.473 3.108 3.942 . 0 0 "[ . 1 . 2]" 1
655 1 30 LEU HB3 1 37 TRP HD1 . . 3.190 3.251 3.055 3.283 0.093 19 0 "[ . 1 . 2]" 1
656 1 30 LEU HB3 1 38 ALA H . . 5.050 5.108 5.037 5.133 0.083 10 0 "[ . 1 . 2]" 1
657 1 30 LEU HB3 1 50 ALA HA . . 4.240 4.314 4.169 4.336 0.096 16 0 "[ . 1 . 2]" 1
658 1 30 LEU HB3 1 51 ILE H . . 5.500 5.147 4.922 5.401 . 0 0 "[ . 1 . 2]" 1
659 1 30 LEU HB3 1 67 VAL MG2 . . 5.500 5.359 5.103 5.596 0.096 4 0 "[ . 1 . 2]" 1
660 1 30 LEU MD1 1 35 VAL HA . . 3.620 2.147 2.027 2.373 . 0 0 "[ . 1 . 2]" 1
661 1 30 LEU MD1 1 35 VAL HB . . 5.500 3.756 3.575 4.102 . 0 0 "[ . 1 . 2]" 1
662 1 30 LEU MD1 1 37 TRP H . . 4.600 2.753 2.469 3.123 . 0 0 "[ . 1 . 2]" 1
663 1 30 LEU MD1 1 37 TRP QB . . 3.820 2.111 2.005 2.301 . 0 0 "[ . 1 . 2]" 1
664 1 30 LEU MD1 1 37 TRP HD1 . . 4.860 3.543 3.185 3.872 . 0 0 "[ . 1 . 2]" 1
665 1 30 LEU MD1 1 38 ALA H . . 4.190 2.543 2.443 2.693 . 0 0 "[ . 1 . 2]" 1
666 1 30 LEU MD1 1 38 ALA MB . . 4.270 2.043 1.943 2.139 . 0 0 "[ . 1 . 2]" 1
667 1 30 LEU MD1 1 50 ALA H . . 5.170 4.694 4.087 4.938 . 0 0 "[ . 1 . 2]" 1
668 1 30 LEU MD1 1 50 ALA HA . . 4.280 3.437 3.011 3.693 . 0 0 "[ . 1 . 2]" 1
669 1 30 LEU MD1 1 67 VAL MG2 . . 4.330 2.504 2.252 2.733 . 0 0 "[ . 1 . 2]" 1
670 1 30 LEU MD2 1 34 GLY HA2 . . 5.310 4.893 4.471 5.335 0.025 8 0 "[ . 1 . 2]" 1
671 1 30 LEU MD2 1 34 GLY HA3 . . 5.310 4.578 4.123 4.924 . 0 0 "[ . 1 . 2]" 1
672 1 30 LEU MD2 1 37 TRP H . . 4.100 3.969 3.658 4.163 0.063 8 0 "[ . 1 . 2]" 1
673 1 30 LEU MD2 1 37 TRP QB . . 3.340 2.142 2.033 2.295 . 0 0 "[ . 1 . 2]" 1
674 1 30 LEU MD2 1 37 TRP HD1 . . 4.070 2.879 2.144 3.492 . 0 0 "[ . 1 . 2]" 1
675 1 30 LEU HG 1 31 ILE H . . 5.500 5.337 5.261 5.411 . 0 0 "[ . 1 . 2]" 1
676 1 30 LEU HG 1 37 TRP QB . . 5.500 4.281 4.012 4.569 . 0 0 "[ . 1 . 2]" 1
677 1 30 LEU HG 1 49 TYR HB2 . . 5.500 5.506 5.218 5.593 0.093 10 0 "[ . 1 . 2]" 1
678 1 30 LEU HG 1 50 ALA H . . 5.460 4.342 3.978 4.735 . 0 0 "[ . 1 . 2]" 1
679 1 30 LEU HG 1 51 ILE H . . 4.920 4.562 4.298 4.912 . 0 0 "[ . 1 . 2]" 1
680 1 30 LEU HG 1 67 VAL MG2 . . 5.500 3.179 2.731 3.653 . 0 0 "[ . 1 . 2]" 1
681 1 31 ILE H 1 31 ILE HG12 . . 4.580 2.813 2.665 2.969 . 0 0 "[ . 1 . 2]" 1
682 1 31 ILE H 1 31 ILE HG13 . . 4.220 3.617 3.407 3.899 . 0 0 "[ . 1 . 2]" 1
683 1 31 ILE H 1 31 ILE MG . . 4.240 2.792 2.719 2.889 . 0 0 "[ . 1 . 2]" 1
684 1 31 ILE H 1 34 GLY HA2 . . 4.800 4.428 4.211 4.567 . 0 0 "[ . 1 . 2]" 1
685 1 31 ILE H 1 34 GLY HA3 . . 4.500 2.709 2.496 2.861 . 0 0 "[ . 1 . 2]" 1
686 1 31 ILE H 1 50 ALA HA . . 5.500 5.309 5.177 5.453 . 0 0 "[ . 1 . 2]" 1
687 1 31 ILE HA 1 31 ILE MD . . 4.170 4.093 3.963 4.188 0.018 1 0 "[ . 1 . 2]" 1
688 1 31 ILE HA 1 32 GLN H . . 3.370 2.505 2.370 2.642 . 0 0 "[ . 1 . 2]" 1
689 1 31 ILE HA 1 32 GLN HA . . 4.420 4.425 4.342 4.478 0.058 15 0 "[ . 1 . 2]" 1
690 1 31 ILE HA 1 32 GLN QG . . 5.240 4.364 4.140 4.640 . 0 0 "[ . 1 . 2]" 1
691 1 31 ILE HA 1 51 ILE H . . 4.360 3.158 3.056 3.338 . 0 0 "[ . 1 . 2]" 1
692 1 31 ILE HA 1 51 ILE HB . . 4.220 2.439 2.291 2.738 . 0 0 "[ . 1 . 2]" 1
693 1 31 ILE HA 1 51 ILE MD . . 5.240 4.706 4.507 5.106 . 0 0 "[ . 1 . 2]" 1
694 1 31 ILE HA 1 51 ILE HG12 . . 3.990 3.298 3.056 3.830 . 0 0 "[ . 1 . 2]" 1
695 1 31 ILE HA 1 51 ILE MG . . 5.380 3.867 3.703 4.155 . 0 0 "[ . 1 . 2]" 1
696 1 31 ILE HA 1 54 ASP QB . . 5.010 3.208 2.481 4.381 . 0 0 "[ . 1 . 2]" 1
697 1 31 ILE HB 1 31 ILE MD . . 3.310 2.364 2.224 2.527 . 0 0 "[ . 1 . 2]" 1
698 1 31 ILE HB 1 32 GLN H . . 3.960 2.350 2.153 2.582 . 0 0 "[ . 1 . 2]" 1
699 1 31 ILE HB 1 32 GLN HA . . 5.150 4.517 4.260 4.766 . 0 0 "[ . 1 . 2]" 1
700 1 31 ILE HB 1 32 GLN QG . . 4.600 3.230 3.040 3.437 . 0 0 "[ . 1 . 2]" 1
701 1 31 ILE HB 1 51 ILE MD . . 5.470 4.698 4.412 5.212 . 0 0 "[ . 1 . 2]" 1
702 1 31 ILE HB 1 51 ILE HG13 . . 4.710 3.228 2.829 3.813 . 0 0 "[ . 1 . 2]" 1
703 1 31 ILE HB 1 72 TYR QE . . 4.970 3.728 3.123 4.695 . 0 0 "[ . 1 . 2]" 1
704 1 31 ILE MD 1 32 GLN H . . 5.120 3.485 3.047 3.971 . 0 0 "[ . 1 . 2]" 1
705 1 31 ILE MD 1 32 GLN HA . . 5.500 4.802 4.339 5.289 . 0 0 "[ . 1 . 2]" 1
706 1 31 ILE MD 1 32 GLN HB2 . . 5.420 3.826 3.519 4.169 . 0 0 "[ . 1 . 2]" 1
707 1 31 ILE MD 1 32 GLN HB3 . . 5.500 4.826 4.483 5.335 . 0 0 "[ . 1 . 2]" 1
708 1 31 ILE MD 1 32 GLN HE21 . . 5.500 4.264 3.557 4.819 . 0 0 "[ . 1 . 2]" 1
709 1 31 ILE MD 1 32 GLN HE22 . . 5.500 5.309 4.776 5.604 0.104 7 0 "[ . 1 . 2]" 1
710 1 31 ILE MD 1 32 GLN QG . . 4.450 2.447 2.029 3.020 . 0 0 "[ . 1 . 2]" 1
711 1 31 ILE MD 1 51 ILE HB . . 5.010 5.118 5.102 5.133 0.123 13 0 "[ . 1 . 2]" 1
712 1 31 ILE MD 1 51 ILE HG13 . . 4.600 4.412 4.245 4.598 . 0 0 "[ . 1 . 2]" 1
713 1 31 ILE MD 1 72 TYR QE . . 3.760 3.730 3.492 3.895 0.135 19 0 "[ . 1 . 2]" 1
714 1 31 ILE HG12 1 32 GLN H . . 4.510 3.887 3.614 4.307 . 0 0 "[ . 1 . 2]" 1
715 1 31 ILE HG12 1 32 GLN HA . . 5.500 5.455 5.273 5.599 0.099 8 0 "[ . 1 . 2]" 1
716 1 31 ILE HG12 1 32 GLN QG . . 5.120 3.606 3.327 3.932 . 0 0 "[ . 1 . 2]" 1
717 1 31 ILE HG13 1 32 GLN H . . 4.970 2.587 2.300 3.006 . 0 0 "[ . 1 . 2]" 1
718 1 31 ILE HG13 1 32 GLN HA . . 5.200 3.960 3.834 4.062 . 0 0 "[ . 1 . 2]" 1
719 1 31 ILE HG13 1 32 GLN HB2 . . 5.500 2.687 2.369 2.930 . 0 0 "[ . 1 . 2]" 1
720 1 31 ILE HG13 1 32 GLN QG . . 4.730 2.205 1.980 2.474 . 0 0 "[ . 1 . 2]" 1
721 1 31 ILE HG13 1 35 VAL H . . 5.500 5.521 5.272 5.739 0.239 7 0 "[ . 1 . 2]" 1
722 1 31 ILE MG 1 51 ILE H . . 5.500 3.724 3.410 3.928 . 0 0 "[ . 1 . 2]" 1
723 1 31 ILE MG 1 51 ILE HB . . 4.010 3.286 2.728 3.518 . 0 0 "[ . 1 . 2]" 1
724 1 32 GLN H 1 32 GLN QG . . 4.190 2.256 1.960 2.689 . 0 0 "[ . 1 . 2]" 1
725 1 32 GLN H 1 35 VAL H . . 5.500 4.818 4.521 5.047 . 0 0 "[ . 1 . 2]" 1
726 1 32 GLN H 1 35 VAL MG2 . . 5.130 4.944 3.878 5.213 0.083 16 0 "[ . 1 . 2]" 1
727 1 32 GLN H 1 51 ILE HB . . 5.160 3.858 3.535 4.462 . 0 0 "[ . 1 . 2]" 1
728 1 32 GLN H 1 54 ASP QB . . 4.500 2.494 2.191 2.890 . 0 0 "[ . 1 . 2]" 1
729 1 32 GLN HA 1 32 GLN QG . . 3.670 2.628 2.428 2.914 . 0 0 "[ . 1 . 2]" 1
730 1 32 GLN HA 1 34 GLY H . . 5.500 4.712 4.447 4.954 . 0 0 "[ . 1 . 2]" 1
731 1 32 GLN HA 1 35 VAL H . . 5.500 4.947 4.654 5.269 . 0 0 "[ . 1 . 2]" 1
732 1 32 GLN HA 1 35 VAL MG2 . . 4.600 4.345 3.866 4.584 . 0 0 "[ . 1 . 2]" 1
733 1 32 GLN HA 1 54 ASP HA . . 5.020 4.147 3.707 5.010 . 0 0 "[ . 1 . 2]" 1
734 1 32 GLN HA 1 54 ASP QB . . 4.830 2.443 2.093 3.555 . 0 0 "[ . 1 . 2]" 1
735 1 32 GLN HB2 1 33 ASN H . . 3.470 1.937 1.816 2.127 . 0 0 "[ . 1 . 2]" 1
736 1 32 GLN HB2 1 33 ASN HA . . 5.500 4.732 4.671 4.847 . 0 0 "[ . 1 . 2]" 1
737 1 32 GLN HB2 1 33 ASN HB2 . . 5.500 4.278 4.115 4.497 . 0 0 "[ . 1 . 2]" 1
738 1 32 GLN HB2 1 33 ASN HB3 . . 5.470 5.533 5.466 5.550 0.080 15 0 "[ . 1 . 2]" 1
739 1 32 GLN HB2 1 34 GLY H . . 4.770 3.285 3.046 3.465 . 0 0 "[ . 1 . 2]" 1
740 1 32 GLN HB2 1 35 VAL H . . 5.500 5.112 4.856 5.322 . 0 0 "[ . 1 . 2]" 1
741 1 32 GLN HB3 1 33 ASN H . . 3.380 2.371 1.873 2.931 . 0 0 "[ . 1 . 2]" 1
742 1 32 GLN HB3 1 33 ASN HA . . 5.500 4.517 4.355 4.639 . 0 0 "[ . 1 . 2]" 1
743 1 32 GLN HB3 1 33 ASN HB2 . . 5.500 4.501 4.101 4.948 . 0 0 "[ . 1 . 2]" 1
744 1 32 GLN HB3 1 33 ASN HB3 . . 5.500 5.470 5.274 5.576 0.076 8 0 "[ . 1 . 2]" 1
745 1 32 GLN HB3 1 34 GLY H . . 5.000 4.416 4.073 4.681 . 0 0 "[ . 1 . 2]" 1
746 1 32 GLN HE21 1 54 ASP H . . 5.500 5.524 5.196 5.597 0.097 15 0 "[ . 1 . 2]" 1
747 1 32 GLN QG 1 33 ASN H . . 4.210 3.762 3.668 3.875 . 0 0 "[ . 1 . 2]" 1
748 1 32 GLN QG 1 33 ASN HD21 . . 5.500 4.771 4.343 5.232 . 0 0 "[ . 1 . 2]" 1
749 1 32 GLN QG 1 34 GLY H . . 5.500 4.833 4.722 4.917 . 0 0 "[ . 1 . 2]" 1
750 1 33 ASN H 1 33 ASN HB3 . . 4.000 3.722 3.634 3.902 . 0 0 "[ . 1 . 2]" 1
751 1 33 ASN H 1 33 ASN HD21 . . 2.990 2.706 2.239 3.075 0.085 19 0 "[ . 1 . 2]" 1
752 1 33 ASN H 1 34 GLY HA3 . . 5.500 4.406 3.673 4.810 . 0 0 "[ . 1 . 2]" 1
753 1 33 ASN H 1 58 ARG HD2 . . 5.500 4.987 4.118 5.445 . 0 0 "[ . 1 . 2]" 1
754 1 33 ASN HA 1 35 VAL H . . 4.440 3.533 3.335 3.697 . 0 0 "[ . 1 . 2]" 1
755 1 33 ASN HA 1 35 VAL MG2 . . 4.100 2.479 2.179 2.739 . 0 0 "[ . 1 . 2]" 1
756 1 33 ASN HA 1 36 PHE H . . 3.930 3.887 3.663 4.013 0.083 16 0 "[ . 1 . 2]" 1
757 1 33 ASN HA 1 36 PHE QD . . 3.790 3.635 2.761 3.880 0.090 19 0 "[ . 1 . 2]" 1
758 1 33 ASN HA 1 58 ARG HD2 . . 5.500 2.566 2.260 2.788 . 0 0 "[ . 1 . 2]" 1
759 1 33 ASN HA 1 58 ARG HD3 . . 5.500 3.228 2.333 3.834 . 0 0 "[ . 1 . 2]" 1
760 1 33 ASN HB2 1 34 GLY H . . 5.180 3.248 2.926 3.443 . 0 0 "[ . 1 . 2]" 1
761 1 33 ASN HB2 1 35 VAL MG2 . . 5.340 4.905 4.576 5.157 . 0 0 "[ . 1 . 2]" 1
762 1 33 ASN HB2 1 36 PHE H . . 5.500 5.405 5.205 5.550 0.050 3 0 "[ . 1 . 2]" 1
763 1 33 ASN HB3 1 34 GLY H . . 4.940 4.087 3.836 4.234 . 0 0 "[ . 1 . 2]" 1
764 1 33 ASN HB3 1 35 VAL MG2 . . 5.500 4.327 4.039 4.655 . 0 0 "[ . 1 . 2]" 1
765 1 33 ASN HB3 1 36 PHE H . . 4.690 4.612 4.406 4.756 0.066 6 0 "[ . 1 . 2]" 1
766 1 33 ASN HB3 1 36 PHE QD . . 4.710 3.865 2.619 4.386 . 0 0 "[ . 1 . 2]" 1
767 1 34 GLY H 1 35 VAL MG1 . . 5.500 4.043 3.809 4.402 . 0 0 "[ . 1 . 2]" 1
768 1 34 GLY H 1 35 VAL MG2 . . 4.990 3.881 3.457 4.187 . 0 0 "[ . 1 . 2]" 1
769 1 34 GLY HA2 1 36 PHE H . . 4.880 3.717 3.540 3.912 . 0 0 "[ . 1 . 2]" 1
770 1 34 GLY HA2 1 36 PHE HB3 . . 5.500 5.493 5.241 5.576 0.076 18 0 "[ . 1 . 2]" 1
771 1 34 GLY HA2 1 36 PHE QD . . 5.500 5.258 4.446 5.570 0.070 13 0 "[ . 1 . 2]" 1
772 1 34 GLY HA2 1 37 TRP H . . 4.980 3.902 3.636 4.241 . 0 0 "[ . 1 . 2]" 1
773 1 34 GLY HA2 1 37 TRP QB . . 5.500 4.794 4.356 5.237 . 0 0 "[ . 1 . 2]" 1
774 1 34 GLY HA2 1 37 TRP HD1 . . 3.150 2.836 2.555 3.142 . 0 0 "[ . 1 . 2]" 1
775 1 34 GLY HA3 1 36 PHE H . . 5.240 4.428 4.282 4.601 . 0 0 "[ . 1 . 2]" 1
776 1 34 GLY HA3 1 37 TRP HD1 . . 3.540 3.455 3.179 3.618 0.078 12 0 "[ . 1 . 2]" 1
777 1 35 VAL H 1 35 VAL MG1 . . 3.440 2.106 1.951 2.343 . 0 0 "[ . 1 . 2]" 1
778 1 35 VAL H 1 35 VAL MG2 . . 3.470 2.147 1.874 2.376 . 0 0 "[ . 1 . 2]" 1
779 1 35 VAL H 1 58 ARG HD3 . . 5.500 5.472 4.878 5.984 0.484 17 0 "[ . 1 . 2]" 1
780 1 35 VAL HA 1 35 VAL MG2 . . 3.490 3.260 3.236 3.296 . 0 0 "[ . 1 . 2]" 1
781 1 35 VAL HA 1 38 ALA H . . 4.750 3.726 3.522 3.905 . 0 0 "[ . 1 . 2]" 1
782 1 35 VAL HA 1 38 ALA MB . . 5.190 3.653 3.456 3.849 . 0 0 "[ . 1 . 2]" 1
783 1 35 VAL HA 1 50 ALA HA . . 4.730 4.721 4.476 4.810 0.080 5 0 "[ . 1 . 2]" 1
784 1 35 VAL HA 1 50 ALA MB . . 4.100 3.126 2.854 3.669 . 0 0 "[ . 1 . 2]" 1
785 1 35 VAL HA 1 51 ILE H . . 5.500 5.012 4.698 5.236 . 0 0 "[ . 1 . 2]" 1
786 1 35 VAL HA 1 55 PHE QD . . 4.410 4.239 3.308 4.488 0.078 11 0 "[ . 1 . 2]" 1
787 1 35 VAL HA 1 55 PHE QE . . 5.210 4.717 2.888 5.114 . 0 0 "[ . 1 . 2]" 1
788 1 35 VAL HB 1 36 PHE H . . 5.500 4.044 3.825 4.194 . 0 0 "[ . 1 . 2]" 1
789 1 35 VAL HB 1 38 ALA H . . 5.360 4.725 4.484 4.910 . 0 0 "[ . 1 . 2]" 1
790 1 35 VAL HB 1 38 ALA MB . . 4.740 3.954 3.694 4.223 . 0 0 "[ . 1 . 2]" 1
791 1 35 VAL HB 1 50 ALA MB . . 4.300 3.674 3.108 4.190 . 0 0 "[ . 1 . 2]" 1
792 1 35 VAL HB 1 55 PHE H . . 5.130 5.073 4.703 5.205 0.075 6 0 "[ . 1 . 2]" 1
793 1 35 VAL HB 1 55 PHE HA . . 4.420 3.519 3.152 3.796 . 0 0 "[ . 1 . 2]" 1
794 1 35 VAL HB 1 55 PHE HB2 . . 4.990 3.569 3.191 4.220 . 0 0 "[ . 1 . 2]" 1
795 1 35 VAL HB 1 55 PHE QD . . 3.300 2.110 1.986 2.673 . 0 0 "[ . 1 . 2]" 1
796 1 35 VAL HB 1 55 PHE QE . . 4.720 3.063 2.514 3.298 . 0 0 "[ . 1 . 2]" 1
797 1 35 VAL MG1 1 36 PHE H . . 4.340 4.223 4.140 4.372 0.032 13 0 "[ . 1 . 2]" 1
798 1 35 VAL MG1 1 37 TRP H . . 5.500 5.228 5.004 5.393 . 0 0 "[ . 1 . 2]" 1
799 1 35 VAL MG1 1 54 ASP H . . 5.500 4.578 4.373 4.831 . 0 0 "[ . 1 . 2]" 1
800 1 35 VAL MG1 1 54 ASP QB . . 5.180 2.914 2.340 4.028 . 0 0 "[ . 1 . 2]" 1
801 1 35 VAL MG1 1 55 PHE H . . 5.080 2.953 2.683 3.137 . 0 0 "[ . 1 . 2]" 1
802 1 35 VAL MG1 1 55 PHE HA . . 3.420 2.470 2.153 2.883 . 0 0 "[ . 1 . 2]" 1
803 1 35 VAL MG1 1 55 PHE HB2 . . 5.250 2.465 2.280 2.824 . 0 0 "[ . 1 . 2]" 1
804 1 35 VAL MG1 1 55 PHE HB3 . . 3.840 3.873 3.705 3.951 0.111 10 0 "[ . 1 . 2]" 1
805 1 35 VAL MG1 1 55 PHE QD . . 3.770 2.671 2.105 2.966 . 0 0 "[ . 1 . 2]" 1
806 1 35 VAL MG1 1 55 PHE QE . . 4.430 4.299 3.363 4.534 0.104 17 0 "[ . 1 . 2]" 1
807 1 35 VAL MG1 1 56 LEU H . . 5.500 4.849 4.642 5.017 . 0 0 "[ . 1 . 2]" 1
808 1 35 VAL MG1 1 57 ALA MB . . 5.500 5.430 4.949 5.623 0.123 13 0 "[ . 1 . 2]" 1
809 1 35 VAL MG1 1 58 ARG H . . 5.500 5.167 4.766 5.574 0.074 18 0 "[ . 1 . 2]" 1
810 1 35 VAL MG1 1 58 ARG HB2 . . 5.500 3.956 3.219 4.819 . 0 0 "[ . 1 . 2]" 1
811 1 35 VAL MG1 1 58 ARG HB3 . . 5.500 4.427 3.590 5.189 . 0 0 "[ . 1 . 2]" 1
812 1 35 VAL MG1 1 58 ARG HD2 . . 5.500 5.200 4.282 5.601 0.101 9 0 "[ . 1 . 2]" 1
813 1 35 VAL MG1 1 58 ARG HD3 . . 5.500 4.959 4.560 5.570 0.070 17 0 "[ . 1 . 2]" 1
814 1 35 VAL MG2 1 36 PHE H . . 5.410 2.577 2.469 2.816 . 0 0 "[ . 1 . 2]" 1
815 1 35 VAL MG2 1 54 ASP QB . . 4.080 4.023 3.749 4.202 0.122 19 0 "[ . 1 . 2]" 1
816 1 35 VAL MG2 1 55 PHE H . . 4.490 4.447 4.105 4.596 0.106 6 0 "[ . 1 . 2]" 1
817 1 35 VAL MG2 1 55 PHE HA . . 4.490 2.479 2.267 2.790 . 0 0 "[ . 1 . 2]" 1
818 1 35 VAL MG2 1 55 PHE HB2 . . 5.500 3.957 3.606 4.614 . 0 0 "[ . 1 . 2]" 1
819 1 35 VAL MG2 1 55 PHE QD . . 4.250 2.444 2.019 3.855 . 0 0 "[ . 1 . 2]" 1
820 1 35 VAL MG2 1 55 PHE QE . . 4.480 3.306 2.590 4.379 . 0 0 "[ . 1 . 2]" 1
821 1 35 VAL MG2 1 58 ARG HD2 . . 5.500 3.213 2.558 3.553 . 0 0 "[ . 1 . 2]" 1
822 1 36 PHE H 1 36 PHE HB2 . . 3.530 2.265 2.106 2.452 . 0 0 "[ . 1 . 2]" 1
823 1 36 PHE H 1 36 PHE HB3 . . 3.440 3.471 3.379 3.506 0.066 14 0 "[ . 1 . 2]" 1
824 1 36 PHE H 1 37 TRP QB . . 5.500 5.044 4.635 5.376 . 0 0 "[ . 1 . 2]" 1
825 1 36 PHE H 1 39 LEU HG . . 5.500 5.361 5.035 5.588 0.088 3 0 "[ . 1 . 2]" 1
826 1 36 PHE H 1 58 ARG HD2 . . 5.500 5.317 4.861 5.581 0.081 18 0 "[ . 1 . 2]" 1
827 1 36 PHE H 1 58 ARG HD3 . . 5.120 4.940 4.041 5.419 0.299 17 0 "[ . 1 . 2]" 1
828 1 36 PHE H 1 58 ARG QG . . 5.480 5.390 4.524 5.586 0.106 13 0 "[ . 1 . 2]" 1
829 1 36 PHE HA 1 36 PHE QD . . 3.310 2.643 2.298 3.119 . 0 0 "[ . 1 . 2]" 1
830 1 36 PHE HA 1 38 ALA H . . 4.290 3.704 3.528 3.856 . 0 0 "[ . 1 . 2]" 1
831 1 36 PHE HA 1 39 LEU QD . . 3.550 2.055 1.958 2.150 . 0 0 "[ . 1 . 2]" 1
832 1 36 PHE HA 1 39 LEU HG . . 4.280 2.870 2.514 3.106 . 0 0 "[ . 1 . 2]" 1
833 1 36 PHE HB2 1 37 TRP H . . 4.640 3.138 2.874 3.542 . 0 0 "[ . 1 . 2]" 1
834 1 36 PHE HB2 1 38 ALA H . . 5.500 5.199 5.020 5.514 0.014 18 0 "[ . 1 . 2]" 1
835 1 36 PHE HB2 1 39 LEU QD . . 4.450 4.239 4.010 4.432 . 0 0 "[ . 1 . 2]" 1
836 1 36 PHE HB3 1 37 TRP H . . 4.580 3.734 3.422 4.006 . 0 0 "[ . 1 . 2]" 1
837 1 36 PHE HB3 1 39 LEU QD . . 5.410 3.416 2.970 4.066 . 0 0 "[ . 1 . 2]" 1
838 1 36 PHE QD 1 39 LEU QD . . 3.960 3.193 2.094 3.705 . 0 0 "[ . 1 . 2]" 1
839 1 36 PHE QE 1 58 ARG HB3 . . 5.200 4.730 4.289 5.292 0.092 14 0 "[ . 1 . 2]" 1
840 1 36 PHE QE 1 58 ARG HD2 . . 5.500 2.935 2.207 4.122 . 0 0 "[ . 1 . 2]" 1
841 1 36 PHE QE 1 58 ARG HD3 . . 4.950 2.603 2.174 3.533 . 0 0 "[ . 1 . 2]" 1
842 1 36 PHE QE 1 60 TYR QE . . 3.770 3.078 2.261 3.874 0.104 4 0 "[ . 1 . 2]" 1
843 1 37 TRP H 1 37 TRP QB . . 3.490 2.454 2.276 2.658 . 0 0 "[ . 1 . 2]" 1
844 1 37 TRP H 1 37 TRP HE1 . . 5.500 4.936 4.706 5.221 . 0 0 "[ . 1 . 2]" 1
845 1 37 TRP H 1 38 ALA MB . . 5.130 4.373 4.186 4.490 . 0 0 "[ . 1 . 2]" 1
846 1 37 TRP H 1 39 LEU H . . 5.420 4.824 4.638 4.986 . 0 0 "[ . 1 . 2]" 1
847 1 37 TRP H 1 39 LEU QD . . 4.630 4.219 3.729 4.537 . 0 0 "[ . 1 . 2]" 1
848 1 37 TRP HA 1 37 TRP HE3 . . 3.420 2.843 2.501 3.135 . 0 0 "[ . 1 . 2]" 1
849 1 37 TRP HA 1 37 TRP HZ3 . . 5.160 5.062 4.719 5.238 0.078 20 0 "[ . 1 . 2]" 1
850 1 37 TRP HA 1 38 ALA MB . . 5.500 5.015 4.974 5.096 . 0 0 "[ . 1 . 2]" 1
851 1 37 TRP HA 1 39 LEU H . . 4.690 3.416 3.217 3.551 . 0 0 "[ . 1 . 2]" 1
852 1 37 TRP HA 1 39 LEU QD . . 5.060 4.361 4.092 4.593 . 0 0 "[ . 1 . 2]" 1
853 1 37 TRP HA 1 40 GLU QB . . 3.970 3.558 2.969 4.012 0.042 5 0 "[ . 1 . 2]" 1
854 1 37 TRP HA 1 40 GLU QG . . 3.740 2.043 1.867 2.216 . 0 0 "[ . 1 . 2]" 1
855 1 37 TRP QB 1 37 TRP HE3 . . 3.780 2.724 2.509 2.936 . 0 0 "[ . 1 . 2]" 1
856 1 37 TRP QB 1 37 TRP HZ3 . . 4.900 4.921 4.754 4.990 0.090 19 0 "[ . 1 . 2]" 1
857 1 37 TRP QB 1 38 ALA H . . 4.460 3.200 3.086 3.298 . 0 0 "[ . 1 . 2]" 1
858 1 37 TRP QB 1 38 ALA HA . . 5.430 4.120 3.996 4.270 . 0 0 "[ . 1 . 2]" 1
859 1 37 TRP QB 1 39 LEU H . . 5.500 4.310 4.208 4.441 . 0 0 "[ . 1 . 2]" 1
860 1 37 TRP QB 1 40 GLU H . . 5.500 5.326 4.859 5.579 0.079 16 0 "[ . 1 . 2]" 1
861 1 37 TRP QB 1 40 GLU QB . . 5.500 4.324 3.850 5.080 . 0 0 "[ . 1 . 2]" 1
862 1 37 TRP HE3 1 40 GLU QB . . 3.630 3.339 2.883 3.702 0.072 5 0 "[ . 1 . 2]" 1
863 1 37 TRP HE3 1 40 GLU QG . . 3.910 2.326 2.068 3.309 . 0 0 "[ . 1 . 2]" 1
864 1 38 ALA H 1 38 ALA MB . . 3.190 2.279 2.202 2.341 . 0 0 "[ . 1 . 2]" 1
865 1 38 ALA H 1 39 LEU QB . . 4.690 4.759 4.631 4.793 0.103 10 0 "[ . 1 . 2]" 1
866 1 38 ALA H 1 39 LEU HG . . 5.080 3.463 2.919 4.554 . 0 0 "[ . 1 . 2]" 1
867 1 38 ALA H 1 50 ALA MB . . 5.380 4.699 4.538 4.889 . 0 0 "[ . 1 . 2]" 1
868 1 38 ALA H 1 66 LYS QG . . 5.500 4.906 4.647 5.459 . 0 0 "[ . 1 . 2]" 1
869 1 38 ALA H 1 67 VAL MG2 . . 5.500 4.539 4.297 4.781 . 0 0 "[ . 1 . 2]" 1
870 1 38 ALA HA 1 39 LEU QB . . 4.590 4.688 4.678 4.695 0.105 1 0 "[ . 1 . 2]" 1
871 1 38 ALA HA 1 40 GLU H . . 4.330 4.173 3.934 4.403 0.073 3 0 "[ . 1 . 2]" 1
872 1 38 ALA HA 1 50 ALA MB . . 5.120 5.089 4.786 5.214 0.094 7 0 "[ . 1 . 2]" 1
873 1 38 ALA HA 1 66 LYS H . . 4.800 3.634 3.441 3.816 . 0 0 "[ . 1 . 2]" 1
874 1 38 ALA HA 1 66 LYS HB3 . . 5.120 5.191 5.074 5.209 0.089 7 0 "[ . 1 . 2]" 1
875 1 38 ALA HA 1 66 LYS QG . . 5.410 2.524 2.239 2.839 . 0 0 "[ . 1 . 2]" 1
876 1 38 ALA HA 1 67 VAL HB . . 5.500 5.037 4.677 5.401 . 0 0 "[ . 1 . 2]" 1
877 1 38 ALA HA 1 67 VAL MG1 . . 3.510 2.211 1.975 2.456 . 0 0 "[ . 1 . 2]" 1
878 1 38 ALA HA 1 67 VAL MG2 . . 3.900 3.620 3.202 3.901 0.001 13 0 "[ . 1 . 2]" 1
879 1 38 ALA MB 1 39 LEU H . . 4.540 3.689 3.648 3.716 . 0 0 "[ . 1 . 2]" 1
880 1 38 ALA MB 1 39 LEU HA . . 5.470 4.653 4.537 4.747 . 0 0 "[ . 1 . 2]" 1
881 1 38 ALA MB 1 40 GLU H . . 5.500 5.205 5.011 5.395 . 0 0 "[ . 1 . 2]" 1
882 1 38 ALA MB 1 50 ALA H . . 5.320 5.249 4.810 5.425 0.105 12 0 "[ . 1 . 2]" 1
883 1 38 ALA MB 1 50 ALA HA . . 5.500 5.070 4.808 5.324 . 0 0 "[ . 1 . 2]" 1
884 1 38 ALA MB 1 50 ALA MB . . 4.110 2.850 2.661 2.964 . 0 0 "[ . 1 . 2]" 1
885 1 38 ALA MB 1 55 PHE QD . . 4.530 4.482 3.627 4.658 0.128 3 0 "[ . 1 . 2]" 1
886 1 38 ALA MB 1 55 PHE QE . . 4.020 3.420 2.088 3.872 . 0 0 "[ . 1 . 2]" 1
887 1 38 ALA MB 1 55 PHE HZ . . 5.390 3.872 2.339 4.687 . 0 0 "[ . 1 . 2]" 1
888 1 38 ALA MB 1 65 SER H . . 5.500 4.969 4.751 5.215 . 0 0 "[ . 1 . 2]" 1
889 1 38 ALA MB 1 65 SER HA . . 4.080 2.845 2.497 3.232 . 0 0 "[ . 1 . 2]" 1
890 1 38 ALA MB 1 65 SER HB2 . . 5.310 3.317 2.264 4.070 . 0 0 "[ . 1 . 2]" 1
891 1 38 ALA MB 1 65 SER HB3 . . 5.070 3.698 2.581 4.253 . 0 0 "[ . 1 . 2]" 1
892 1 38 ALA MB 1 66 LYS H . . 4.270 2.422 2.228 2.635 . 0 0 "[ . 1 . 2]" 1
893 1 38 ALA MB 1 66 LYS HA . . 5.500 4.546 4.333 4.823 . 0 0 "[ . 1 . 2]" 1
894 1 38 ALA MB 1 66 LYS QG . . 3.550 3.046 2.821 3.375 . 0 0 "[ . 1 . 2]" 1
895 1 38 ALA MB 1 67 VAL H . . 5.010 3.075 2.733 3.390 . 0 0 "[ . 1 . 2]" 1
896 1 38 ALA MB 1 67 VAL HA . . 5.500 4.585 4.328 4.792 . 0 0 "[ . 1 . 2]" 1
897 1 38 ALA MB 1 67 VAL HB . . 5.500 4.074 3.896 4.207 . 0 0 "[ . 1 . 2]" 1
898 1 38 ALA MB 1 67 VAL MG2 . . 3.630 2.060 1.905 2.315 . 0 0 "[ . 1 . 2]" 1
899 1 38 ALA MB 1 68 PRO HD2 . . 5.500 5.504 5.316 5.605 0.105 13 0 "[ . 1 . 2]" 1
900 1 38 ALA MB 1 69 LEU MD2 . . 4.720 3.642 3.357 3.922 . 0 0 "[ . 1 . 2]" 1
901 1 39 LEU H 1 39 LEU QB . . 3.600 3.405 3.367 3.457 . 0 0 "[ . 1 . 2]" 1
902 1 39 LEU H 1 39 LEU QD . . 3.880 3.191 2.767 3.465 . 0 0 "[ . 1 . 2]" 1
903 1 39 LEU H 1 39 LEU HG . . 3.690 3.022 2.660 3.735 0.045 17 0 "[ . 1 . 2]" 1
904 1 39 LEU H 1 40 GLU QB . . 5.440 3.536 3.258 4.176 . 0 0 "[ . 1 . 2]" 1
905 1 39 LEU H 1 40 GLU QG . . 5.140 2.809 2.399 3.199 . 0 0 "[ . 1 . 2]" 1
906 1 39 LEU H 1 66 LYS QE . . 4.750 2.777 2.406 3.266 . 0 0 "[ . 1 . 2]" 1
907 1 39 LEU H 1 66 LYS QG . . 5.500 3.497 3.277 4.138 . 0 0 "[ . 1 . 2]" 1
908 1 39 LEU HA 1 39 LEU QD . . 3.930 3.453 3.365 3.503 . 0 0 "[ . 1 . 2]" 1
909 1 39 LEU HA 1 66 LYS QG . . 4.020 2.559 2.119 4.066 0.046 1 0 "[ . 1 . 2]" 1
910 1 39 LEU QB 1 40 GLU H . . 4.070 3.998 3.805 4.071 0.001 15 0 "[ . 1 . 2]" 1
911 1 39 LEU QB 1 40 GLU QG . . 5.500 4.709 4.343 4.975 . 0 0 "[ . 1 . 2]" 1
912 1 39 LEU QB 1 66 LYS QE . . 5.490 4.032 3.636 4.311 . 0 0 "[ . 1 . 2]" 1
913 1 39 LEU QD 1 60 TYR QE . . 3.630 2.091 1.996 2.215 . 0 0 "[ . 1 . 2]" 1
914 1 39 LEU QD 1 64 ASP HA . . 5.500 4.925 4.347 5.293 . 0 0 "[ . 1 . 2]" 1
915 1 39 LEU QD 1 64 ASP HB2 . . 4.950 4.448 3.949 4.895 . 0 0 "[ . 1 . 2]" 1
916 1 39 LEU QD 1 64 ASP HB3 . . 4.400 3.600 3.083 4.093 . 0 0 "[ . 1 . 2]" 1
917 1 39 LEU QD 1 65 SER HA . . 4.790 2.982 2.568 3.186 . 0 0 "[ . 1 . 2]" 1
918 1 39 LEU QD 1 65 SER HB2 . . 5.500 4.301 3.131 5.339 . 0 0 "[ . 1 . 2]" 1
919 1 39 LEU QD 1 65 SER HB3 . . 5.500 5.159 4.257 5.510 0.010 19 0 "[ . 1 . 2]" 1
920 1 39 LEU QD 1 66 LYS HB3 . . 5.500 5.188 4.794 5.379 . 0 0 "[ . 1 . 2]" 1
921 1 39 LEU QD 1 66 LYS QE . . 5.500 4.591 4.257 4.781 . 0 0 "[ . 1 . 2]" 1
922 1 39 LEU HG 1 40 GLU H . . 4.760 4.604 4.226 4.845 0.085 16 0 "[ . 1 . 2]" 1
923 1 39 LEU HG 1 60 TYR QE . . 4.750 4.698 4.461 4.835 0.085 19 0 "[ . 1 . 2]" 1
924 1 40 GLU H 1 40 GLU QB . . 3.330 2.427 2.083 2.962 . 0 0 "[ . 1 . 2]" 1
925 1 40 GLU HA 1 41 GLU H . . 2.840 2.774 2.482 2.932 0.092 6 0 "[ . 1 . 2]" 1
926 1 40 GLU HA 1 41 GLU HB3 . . 4.900 4.729 3.797 5.876 0.976 3 8 "[ *+** *1* - * 2]" 1
927 1 40 GLU HA 1 66 LYS QE . . 4.240 4.147 3.964 4.311 0.071 18 0 "[ . 1 . 2]" 1
928 1 40 GLU QB 1 41 GLU H . . 3.420 2.000 1.732 2.391 . 0 0 "[ . 1 . 2]" 1
929 1 40 GLU QB 1 42 LEU QD . . 4.540 4.262 3.510 4.568 0.028 5 0 "[ . 1 . 2]" 1
930 1 40 GLU QG 1 66 LYS QE . . 3.930 4.055 4.034 4.069 0.139 5 0 "[ . 1 . 2]" 1
931 1 41 GLU H 1 41 GLU HB2 . . 3.790 3.242 2.175 3.819 0.029 18 0 "[ . 1 . 2]" 1
932 1 41 GLU H 1 41 GLU HB3 . . 3.180 3.299 2.836 3.833 0.653 4 4 "[ *-+* 1 . 2]" 1
933 1 41 GLU H 1 41 GLU QG . . 3.490 2.660 1.842 3.580 0.090 11 0 "[ . 1 . 2]" 1
934 1 41 GLU H 1 42 LEU H . . 5.500 3.169 2.791 4.260 . 0 0 "[ . 1 . 2]" 1
935 1 41 GLU H 1 42 LEU HA . . 5.500 5.123 4.661 5.514 0.014 13 0 "[ . 1 . 2]" 1
936 1 41 GLU H 1 42 LEU QD . . 5.500 3.851 3.136 4.408 . 0 0 "[ . 1 . 2]" 1
937 1 41 GLU H 1 66 LYS QE . . 4.980 4.696 4.345 5.068 0.088 13 0 "[ . 1 . 2]" 1
938 1 41 GLU HA 1 42 LEU H . . 2.740 2.564 2.153 2.811 0.071 11 0 "[ . 1 . 2]" 1
939 1 41 GLU HA 1 42 LEU HB2 . . 4.400 4.489 4.468 4.502 0.102 19 0 "[ . 1 . 2]" 1
940 1 41 GLU HB2 1 42 LEU H . . 4.360 4.455 4.309 4.694 0.334 9 0 "[ . 1 . 2]" 1
941 1 41 GLU QG 1 42 LEU H . . 5.500 4.258 3.739 4.675 . 0 0 "[ . 1 . 2]" 1
942 1 42 LEU H 1 42 LEU HB2 . . 3.640 2.765 2.553 3.367 . 0 0 "[ . 1 . 2]" 1
943 1 42 LEU H 1 42 LEU HB3 . . 3.870 3.468 3.175 3.811 . 0 0 "[ . 1 . 2]" 1
944 1 42 LEU H 1 42 LEU QD . . 4.650 3.812 3.625 4.026 . 0 0 "[ . 1 . 2]" 1
945 1 42 LEU HA 1 42 LEU QD . . 3.180 2.554 1.948 2.998 . 0 0 "[ . 1 . 2]" 1
946 1 42 LEU HA 1 43 GLU H . . 3.340 3.006 2.695 3.255 . 0 0 "[ . 1 . 2]" 1
947 1 42 LEU HA 1 43 GLU HG3 . . 5.220 5.064 4.147 6.000 0.780 12 2 "[ . 1 + . -]" 1
948 1 42 LEU HB2 1 42 LEU QD . . 3.240 2.169 2.064 2.312 . 0 0 "[ . 1 . 2]" 1
949 1 42 LEU HB3 1 43 GLU H . . 4.210 1.876 1.626 2.133 . 0 0 "[ . 1 . 2]" 1
950 1 42 LEU HB3 1 43 GLU HA . . 4.890 4.089 3.779 4.312 . 0 0 "[ . 1 . 2]" 1
951 1 42 LEU HB3 1 44 THR H . . 5.500 5.556 5.073 5.605 0.105 13 0 "[ . 1 . 2]" 1
952 1 42 LEU QD 1 43 GLU H . . 5.360 2.369 1.899 2.804 . 0 0 "[ . 1 . 2]" 1
953 1 42 LEU QD 1 43 GLU HG2 . . 4.290 3.384 2.284 4.307 0.017 19 0 "[ . 1 . 2]" 1
954 1 43 GLU H 1 43 GLU HB3 . . 3.930 3.538 3.224 3.836 . 0 0 "[ . 1 . 2]" 1
955 1 43 GLU H 1 43 GLU HG2 . . 4.740 2.926 2.111 3.613 . 0 0 "[ . 1 . 2]" 1
956 1 43 GLU H 1 43 GLU HG3 . . 4.560 3.185 2.320 4.466 . 0 0 "[ . 1 . 2]" 1
957 1 43 GLU HA 1 43 GLU HG3 . . 3.670 3.763 3.643 4.217 0.547 7 1 "[ . + 1 . 2]" 1
958 1 43 GLU HA 1 44 THR H . . 2.760 2.369 2.081 2.668 . 0 0 "[ . 1 . 2]" 1
959 1 43 GLU HA 1 44 THR HA . . 4.740 4.629 4.547 4.776 0.036 17 0 "[ . 1 . 2]" 1
960 1 43 GLU HA 1 44 THR MG . . 4.120 3.887 3.205 4.196 0.076 8 0 "[ . 1 . 2]" 1
961 1 43 GLU HB2 1 43 GLU HG3 . . 2.770 2.533 2.242 2.852 0.082 16 0 "[ . 1 . 2]" 1
962 1 43 GLU HB2 1 44 THR H . . 4.500 2.569 1.987 3.784 . 0 0 "[ . 1 . 2]" 1
963 1 43 GLU HB3 1 43 GLU HG3 . . 2.960 2.992 2.734 3.041 0.081 13 0 "[ . 1 . 2]" 1
964 1 43 GLU HB3 1 44 THR H . . 4.340 3.803 3.486 4.555 0.215 7 0 "[ . 1 . 2]" 1
965 1 43 GLU HG3 1 45 PRO HD3 . . 5.500 4.256 3.349 5.201 . 0 0 "[ . 1 . 2]" 1
966 1 44 THR H 1 44 THR MG . . 3.220 2.199 1.977 2.409 . 0 0 "[ . 1 . 2]" 1
967 1 44 THR H 1 45 PRO HD2 . . 5.500 5.064 4.826 5.286 . 0 0 "[ . 1 . 2]" 1
968 1 44 THR H 1 45 PRO HD3 . . 5.330 4.573 4.118 4.922 . 0 0 "[ . 1 . 2]" 1
969 1 44 THR H 1 48 VAL QG . . 5.500 4.055 3.106 5.069 . 0 0 "[ . 1 . 2]" 1
970 1 44 THR HA 1 44 THR HB . . 2.890 2.417 2.231 2.549 . 0 0 "[ . 1 . 2]" 1
971 1 44 THR HA 1 45 PRO HA . . 4.410 4.483 4.457 4.503 0.093 14 0 "[ . 1 . 2]" 1
972 1 44 THR HA 1 45 PRO HB2 . . 5.480 5.576 5.564 5.682 0.202 6 0 "[ . 1 . 2]" 1
973 1 44 THR HA 1 45 PRO HD2 . . 3.140 2.473 2.285 2.703 . 0 0 "[ . 1 . 2]" 1
974 1 44 THR HA 1 45 PRO HD3 . . 3.090 2.257 2.135 2.437 . 0 0 "[ . 1 . 2]" 1
975 1 44 THR HA 1 45 PRO HG2 . . 4.510 4.515 4.426 4.592 0.082 6 0 "[ . 1 . 2]" 1
976 1 44 THR HA 1 45 PRO HG3 . . 4.510 4.472 4.392 4.568 0.058 16 0 "[ . 1 . 2]" 1
977 1 44 THR HA 1 46 ALA H . . 4.240 3.419 3.131 3.707 . 0 0 "[ . 1 . 2]" 1
978 1 44 THR HA 1 46 ALA MB . . 5.500 4.405 4.120 4.644 . 0 0 "[ . 1 . 2]" 1
979 1 44 THR HA 1 48 VAL QG . . 4.750 4.564 4.212 4.779 0.029 4 0 "[ . 1 . 2]" 1
980 1 44 THR HB 1 45 PRO HD3 . . 4.980 4.557 4.327 4.791 . 0 0 "[ . 1 . 2]" 1
981 1 44 THR HB 1 46 ALA H . . 4.610 3.881 3.715 3.988 . 0 0 "[ . 1 . 2]" 1
982 1 44 THR HB 1 46 ALA MB . . 5.500 3.903 3.638 4.239 . 0 0 "[ . 1 . 2]" 1
983 1 44 THR HB 1 48 VAL QG . . 3.430 3.113 2.446 3.483 0.053 2 0 "[ . 1 . 2]" 1
984 1 44 THR MG 1 45 PRO HA . . 4.790 4.074 3.717 4.508 . 0 0 "[ . 1 . 2]" 1
985 1 44 THR MG 1 45 PRO HD2 . . 5.430 4.121 3.706 4.583 . 0 0 "[ . 1 . 2]" 1
986 1 44 THR MG 1 45 PRO HD3 . . 5.500 4.604 4.407 4.858 . 0 0 "[ . 1 . 2]" 1
987 1 44 THR MG 1 46 ALA H . . 3.680 2.811 1.928 3.627 . 0 0 "[ . 1 . 2]" 1
988 1 44 THR MG 1 46 ALA HA . . 5.020 4.578 3.843 5.128 0.108 15 0 "[ . 1 . 2]" 1
989 1 44 THR MG 1 46 ALA MB . . 4.060 2.984 1.997 3.983 . 0 0 "[ . 1 . 2]" 1
990 1 44 THR MG 1 47 LYS H . . 5.500 4.942 4.207 5.548 0.048 12 0 "[ . 1 . 2]" 1
991 1 44 THR MG 1 47 LYS HA . . 5.450 4.445 4.134 5.051 . 0 0 "[ . 1 . 2]" 1
992 1 44 THR MG 1 48 VAL H . . 4.650 4.294 3.498 4.624 . 0 0 "[ . 1 . 2]" 1
993 1 44 THR MG 1 48 VAL HB . . 4.370 3.305 2.273 3.879 . 0 0 "[ . 1 . 2]" 1
994 1 44 THR MG 1 48 VAL QG . . 2.860 1.776 1.654 2.006 . 0 0 "[ . 1 . 2]" 1
995 1 45 PRO HA 1 46 ALA MB . . 5.060 4.943 4.837 5.043 . 0 0 "[ . 1 . 2]" 1
996 1 45 PRO HD2 1 46 ALA H . . 3.890 2.364 1.959 2.844 . 0 0 "[ . 1 . 2]" 1
997 1 45 PRO HD2 1 46 ALA MB . . 5.460 3.408 2.939 3.811 . 0 0 "[ . 1 . 2]" 1
998 1 45 PRO HD3 1 46 ALA H . . 4.420 3.714 3.432 3.992 . 0 0 "[ . 1 . 2]" 1
999 1 45 PRO HD3 1 46 ALA MB . . 5.500 4.872 4.450 5.207 . 0 0 "[ . 1 . 2]" 1
1000 1 45 PRO HG2 1 46 ALA H . . 4.590 3.369 2.711 3.679 . 0 0 "[ . 1 . 2]" 1
1001 1 46 ALA H 1 46 ALA MB . . 3.030 2.209 2.103 2.274 . 0 0 "[ . 1 . 2]" 1
1002 1 46 ALA H 1 48 VAL QG . . 4.920 3.816 3.318 4.099 . 0 0 "[ . 1 . 2]" 1
1003 1 46 ALA HA 1 47 LYS H . . 2.960 2.664 2.453 2.805 . 0 0 "[ . 1 . 2]" 1
1004 1 46 ALA HA 1 47 LYS HA . . 4.910 4.467 4.361 4.584 . 0 0 "[ . 1 . 2]" 1
1005 1 46 ALA HA 1 47 LYS QG . . 4.610 4.210 3.876 4.513 . 0 0 "[ . 1 . 2]" 1
1006 1 46 ALA HA 1 48 VAL QG . . 4.740 4.644 4.188 4.796 0.056 5 0 "[ . 1 . 2]" 1
1007 1 46 ALA MB 1 47 LYS H . . 3.190 2.379 2.166 2.594 . 0 0 "[ . 1 . 2]" 1
1008 1 46 ALA MB 1 48 VAL H . . 5.500 4.997 4.521 5.283 . 0 0 "[ . 1 . 2]" 1
1009 1 47 LYS H 1 47 LYS HB2 . . 3.470 3.342 2.140 3.559 0.089 15 0 "[ . 1 . 2]" 1
1010 1 47 LYS H 1 47 LYS HB3 . . 3.440 2.970 2.489 3.548 0.108 10 0 "[ . 1 . 2]" 1
1011 1 47 LYS H 1 47 LYS QD . . 4.280 3.768 3.432 4.045 . 0 0 "[ . 1 . 2]" 1
1012 1 47 LYS H 1 47 LYS QE . . 5.440 4.573 3.937 5.190 . 0 0 "[ . 1 . 2]" 1
1013 1 47 LYS H 1 47 LYS QG . . 3.720 2.050 1.820 2.842 . 0 0 "[ . 1 . 2]" 1
1014 1 47 LYS HA 1 47 LYS QE . . 5.040 4.500 4.121 5.144 0.104 15 0 "[ . 1 . 2]" 1
1015 1 47 LYS HA 1 47 LYS QG . . 3.570 3.138 2.287 3.311 . 0 0 "[ . 1 . 2]" 1
1016 1 47 LYS HA 1 48 VAL H . . 2.790 2.308 2.131 2.394 . 0 0 "[ . 1 . 2]" 1
1017 1 47 LYS HA 1 48 VAL HA . . 5.110 4.486 4.419 4.551 . 0 0 "[ . 1 . 2]" 1
1018 1 47 LYS HA 1 48 VAL QG . . 4.160 3.335 2.815 3.696 . 0 0 "[ . 1 . 2]" 1
1019 1 47 LYS HB2 1 49 TYR QE . . 3.690 2.459 2.096 3.826 0.136 10 0 "[ . 1 . 2]" 1
1020 1 47 LYS QD 1 49 TYR QD . . 4.560 3.568 2.678 4.504 . 0 0 "[ . 1 . 2]" 1
1021 1 47 LYS QD 1 49 TYR QE . . 3.350 2.486 1.926 3.300 . 0 0 "[ . 1 . 2]" 1
1022 1 47 LYS QD 1 78 LEU HB3 . . 4.130 3.654 2.994 4.033 . 0 0 "[ . 1 . 2]" 1
1023 1 47 LYS QD 1 78 LEU QD . . 4.630 2.445 1.809 3.459 . 0 0 "[ . 1 . 2]" 1
1024 1 47 LYS QE 1 47 LYS QG . . 3.080 2.445 1.988 2.914 . 0 0 "[ . 1 . 2]" 1
1025 1 47 LYS QE 1 48 VAL H . . 5.500 5.353 4.927 5.594 0.094 5 0 "[ . 1 . 2]" 1
1026 1 47 LYS QE 1 49 TYR QE . . 4.390 2.295 1.802 4.112 . 0 0 "[ . 1 . 2]" 1
1027 1 47 LYS QE 1 78 LEU HA . . 4.820 4.643 3.446 4.917 0.097 2 0 "[ . 1 . 2]" 1
1028 1 47 LYS QE 1 78 LEU QD . . 4.060 2.184 1.869 2.927 . 0 0 "[ . 1 . 2]" 1
1029 1 47 LYS QG 1 48 VAL H . . 4.760 4.113 3.628 4.514 . 0 0 "[ . 1 . 2]" 1
1030 1 47 LYS QG 1 49 TYR QD . . 5.110 3.690 2.432 4.262 . 0 0 "[ . 1 . 2]" 1
1031 1 48 VAL H 1 48 VAL HB . . 3.350 3.001 2.547 3.449 0.099 8 0 "[ . 1 . 2]" 1
1032 1 48 VAL H 1 48 VAL QG . . 3.420 2.546 1.918 3.051 . 0 0 "[ . 1 . 2]" 1
1033 1 48 VAL H 1 49 TYR HA . . 5.500 4.672 4.062 5.026 . 0 0 "[ . 1 . 2]" 1
1034 1 48 VAL H 1 67 VAL HB . . 5.500 5.046 4.737 5.449 . 0 0 "[ . 1 . 2]" 1
1035 1 48 VAL H 1 67 VAL MG2 . . 5.500 5.593 5.531 5.613 0.113 4 0 "[ . 1 . 2]" 1
1036 1 48 VAL H 1 68 PRO HD2 . . 5.500 4.411 4.175 4.704 . 0 0 "[ . 1 . 2]" 1
1037 1 48 VAL HA 1 48 VAL QG . . 3.340 2.129 2.045 2.243 . 0 0 "[ . 1 . 2]" 1
1038 1 48 VAL HA 1 49 TYR H . . 3.240 2.152 2.076 2.567 . 0 0 "[ . 1 . 2]" 1
1039 1 48 VAL HA 1 49 TYR HB2 . . 5.500 4.368 4.055 4.994 . 0 0 "[ . 1 . 2]" 1
1040 1 48 VAL HA 1 49 TYR QD . . 4.200 3.687 3.220 4.287 0.087 20 0 "[ . 1 . 2]" 1
1041 1 48 VAL HB 1 49 TYR H . . 4.770 3.736 2.717 4.509 . 0 0 "[ . 1 . 2]" 1
1042 1 48 VAL HB 1 49 TYR HA . . 5.500 4.696 4.202 5.271 . 0 0 "[ . 1 . 2]" 1
1043 1 48 VAL HB 1 67 VAL HA . . 5.500 5.384 4.826 5.583 0.083 13 0 "[ . 1 . 2]" 1
1044 1 48 VAL HB 1 67 VAL HB . . 4.790 3.563 3.158 4.041 . 0 0 "[ . 1 . 2]" 1
1045 1 48 VAL HB 1 67 VAL MG2 . . 5.040 4.179 3.481 4.839 . 0 0 "[ . 1 . 2]" 1
1046 1 48 VAL HB 1 68 PRO HD2 . . 5.500 4.176 3.585 4.625 . 0 0 "[ . 1 . 2]" 1
1047 1 48 VAL QG 1 49 TYR H . . 3.770 2.967 2.243 3.591 . 0 0 "[ . 1 . 2]" 1
1048 1 48 VAL QG 1 49 TYR HA . . 4.090 3.731 3.472 4.016 . 0 0 "[ . 1 . 2]" 1
1049 1 48 VAL QG 1 49 TYR HB2 . . 5.460 4.871 4.500 5.219 . 0 0 "[ . 1 . 2]" 1
1050 1 48 VAL QG 1 49 TYR QD . . 5.200 4.401 4.241 4.683 . 0 0 "[ . 1 . 2]" 1
1051 1 49 TYR H 1 49 TYR HB3 . . 4.090 3.810 3.655 3.928 . 0 0 "[ . 1 . 2]" 1
1052 1 49 TYR H 1 67 VAL MG2 . . 5.390 4.029 3.586 5.093 . 0 0 "[ . 1 . 2]" 1
1053 1 49 TYR HA 1 49 TYR QD . . 3.760 2.928 2.637 3.237 . 0 0 "[ . 1 . 2]" 1
1054 1 49 TYR HA 1 49 TYR QE . . 4.950 4.812 4.578 4.968 0.018 17 0 "[ . 1 . 2]" 1
1055 1 49 TYR HA 1 50 ALA H . . 3.310 2.449 2.248 2.567 . 0 0 "[ . 1 . 2]" 1
1056 1 49 TYR HA 1 50 ALA MB . . 4.920 3.924 3.621 4.239 . 0 0 "[ . 1 . 2]" 1
1057 1 49 TYR HA 1 67 VAL HB . . 4.460 3.583 3.007 4.174 . 0 0 "[ . 1 . 2]" 1
1058 1 49 TYR HA 1 67 VAL MG2 . . 3.910 2.773 2.418 3.187 . 0 0 "[ . 1 . 2]" 1
1059 1 49 TYR HA 1 68 PRO HB2 . . 4.900 4.070 3.894 4.228 . 0 0 "[ . 1 . 2]" 1
1060 1 49 TYR HA 1 68 PRO HB3 . . 5.270 5.093 4.924 5.291 0.021 8 0 "[ . 1 . 2]" 1
1061 1 49 TYR HA 1 68 PRO HD2 . . 4.660 2.790 2.161 3.488 . 0 0 "[ . 1 . 2]" 1
1062 1 49 TYR HA 1 68 PRO HD3 . . 5.290 4.392 3.914 4.899 . 0 0 "[ . 1 . 2]" 1
1063 1 49 TYR HA 1 68 PRO HG2 . . 4.350 2.581 2.153 3.634 . 0 0 "[ . 1 . 2]" 1
1064 1 49 TYR HA 1 68 PRO HG3 . . 5.260 4.232 3.835 4.876 . 0 0 "[ . 1 . 2]" 1
1065 1 49 TYR HA 1 70 ILE MG . . 3.740 3.452 2.994 3.710 . 0 0 "[ . 1 . 2]" 1
1066 1 49 TYR HB2 1 50 ALA HA . . 5.500 4.733 4.381 5.070 . 0 0 "[ . 1 . 2]" 1
1067 1 49 TYR HB2 1 70 ILE H . . 5.500 5.278 4.571 5.558 0.058 14 0 "[ . 1 . 2]" 1
1068 1 49 TYR HB2 1 70 ILE HB . . 5.500 5.488 5.173 5.576 0.076 8 0 "[ . 1 . 2]" 1
1069 1 49 TYR HB2 1 70 ILE MD . . 3.690 2.500 2.322 2.750 . 0 0 "[ . 1 . 2]" 1
1070 1 49 TYR HB2 1 70 ILE HG12 . . 4.670 3.513 3.027 3.880 . 0 0 "[ . 1 . 2]" 1
1071 1 49 TYR HB2 1 70 ILE MG . . 3.920 3.597 3.425 3.819 . 0 0 "[ . 1 . 2]" 1
1072 1 49 TYR HB2 1 78 LEU QD . . 4.890 3.043 2.414 3.965 . 0 0 "[ . 1 . 2]" 1
1073 1 49 TYR HB3 1 50 ALA H . . 4.410 2.855 2.555 3.609 . 0 0 "[ . 1 . 2]" 1
1074 1 49 TYR HB3 1 50 ALA HA . . 5.500 4.716 4.501 4.979 . 0 0 "[ . 1 . 2]" 1
1075 1 49 TYR HB3 1 70 ILE MD . . 4.140 2.173 2.039 2.330 . 0 0 "[ . 1 . 2]" 1
1076 1 49 TYR HB3 1 70 ILE HG12 . . 5.500 2.439 2.214 2.678 . 0 0 "[ . 1 . 2]" 1
1077 1 49 TYR HB3 1 70 ILE MG . . 3.960 2.212 2.093 2.461 . 0 0 "[ . 1 . 2]" 1
1078 1 49 TYR HB3 1 78 LEU QD . . 5.390 3.741 3.024 4.519 . 0 0 "[ . 1 . 2]" 1
1079 1 49 TYR QD 1 68 PRO HA . . 4.980 4.774 4.466 4.963 . 0 0 "[ . 1 . 2]" 1
1080 1 49 TYR QD 1 68 PRO HB2 . . 4.070 2.378 2.211 2.537 . 0 0 "[ . 1 . 2]" 1
1081 1 49 TYR QD 1 68 PRO HB3 . . 3.870 3.919 3.784 3.962 0.092 6 0 "[ . 1 . 2]" 1
1082 1 49 TYR QD 1 68 PRO HD2 . . 5.240 4.085 3.109 4.483 . 0 0 "[ . 1 . 2]" 1
1083 1 49 TYR QD 1 68 PRO HG2 . . 4.620 2.226 2.062 2.458 . 0 0 "[ . 1 . 2]" 1
1084 1 49 TYR QD 1 70 ILE HA . . 5.200 5.231 5.066 5.278 0.078 13 0 "[ . 1 . 2]" 1
1085 1 49 TYR QD 1 70 ILE MG . . 3.360 1.982 1.930 2.072 . 0 0 "[ . 1 . 2]" 1
1086 1 49 TYR QD 1 78 LEU QD . . 4.390 2.371 2.136 2.999 . 0 0 "[ . 1 . 2]" 1
1087 1 49 TYR QE 1 68 PRO HB2 . . 4.790 3.241 2.762 3.681 . 0 0 "[ . 1 . 2]" 1
1088 1 49 TYR QE 1 68 PRO HB3 . . 5.060 4.126 3.674 4.671 . 0 0 "[ . 1 . 2]" 1
1089 1 49 TYR QE 1 68 PRO HG2 . . 4.710 3.267 2.556 3.614 . 0 0 "[ . 1 . 2]" 1
1090 1 49 TYR QE 1 70 ILE MG . . 4.360 3.227 2.957 3.450 . 0 0 "[ . 1 . 2]" 1
1091 1 49 TYR QE 1 78 LEU HB3 . . 5.500 5.015 3.944 5.588 0.088 2 0 "[ . 1 . 2]" 1
1092 1 49 TYR QE 1 78 LEU QD . . 4.130 2.546 2.207 2.862 . 0 0 "[ . 1 . 2]" 1
1093 1 50 ALA H 1 50 ALA MB . . 3.590 2.462 2.271 2.646 . 0 0 "[ . 1 . 2]" 1
1094 1 50 ALA H 1 67 VAL HB . . 5.330 4.817 4.298 5.212 . 0 0 "[ . 1 . 2]" 1
1095 1 50 ALA H 1 67 VAL MG2 . . 3.900 2.726 2.252 3.124 . 0 0 "[ . 1 . 2]" 1
1096 1 50 ALA H 1 68 PRO HA . . 5.500 5.205 5.003 5.488 . 0 0 "[ . 1 . 2]" 1
1097 1 50 ALA H 1 68 PRO HD2 . . 5.500 4.537 3.976 5.139 . 0 0 "[ . 1 . 2]" 1
1098 1 50 ALA H 1 69 LEU HA . . 3.720 2.831 2.632 3.105 . 0 0 "[ . 1 . 2]" 1
1099 1 50 ALA H 1 69 LEU MD2 . . 4.350 3.516 2.777 3.910 . 0 0 "[ . 1 . 2]" 1
1100 1 50 ALA H 1 70 ILE MG . . 4.640 3.301 2.920 4.124 . 0 0 "[ . 1 . 2]" 1
1101 1 50 ALA HA 1 51 ILE H . . 3.350 2.349 2.239 2.549 . 0 0 "[ . 1 . 2]" 1
1102 1 50 ALA HA 1 51 ILE HA . . 4.840 4.460 4.329 4.551 . 0 0 "[ . 1 . 2]" 1
1103 1 50 ALA HA 1 51 ILE HB . . 4.820 4.667 4.515 4.839 0.019 15 0 "[ . 1 . 2]" 1
1104 1 50 ALA HA 1 51 ILE MD . . 5.140 4.316 4.035 4.555 . 0 0 "[ . 1 . 2]" 1
1105 1 50 ALA HA 1 51 ILE HG12 . . 4.810 4.043 3.765 4.301 . 0 0 "[ . 1 . 2]" 1
1106 1 50 ALA HA 1 69 LEU MD2 . . 5.500 4.483 4.132 4.706 . 0 0 "[ . 1 . 2]" 1
1107 1 50 ALA MB 1 51 ILE H . . 3.760 2.793 2.601 2.974 . 0 0 "[ . 1 . 2]" 1
1108 1 50 ALA MB 1 51 ILE HB . . 5.050 4.621 4.370 4.892 . 0 0 "[ . 1 . 2]" 1
1109 1 50 ALA MB 1 52 LYS H . . 5.500 4.597 4.275 4.839 . 0 0 "[ . 1 . 2]" 1
1110 1 50 ALA MB 1 67 VAL MG2 . . 3.830 2.096 1.946 2.288 . 0 0 "[ . 1 . 2]" 1
1111 1 50 ALA MB 1 69 LEU H . . 5.500 4.899 4.512 5.474 . 0 0 "[ . 1 . 2]" 1
1112 1 50 ALA MB 1 69 LEU HA . . 4.410 2.958 2.491 3.288 . 0 0 "[ . 1 . 2]" 1
1113 1 50 ALA MB 1 69 LEU MD2 . . 2.980 2.016 1.922 2.169 . 0 0 "[ . 1 . 2]" 1
1114 1 50 ALA MB 1 70 ILE H . . 5.010 3.976 3.566 4.324 . 0 0 "[ . 1 . 2]" 1
1115 1 51 ILE H 1 51 ILE HB . . 3.640 2.369 2.250 2.479 . 0 0 "[ . 1 . 2]" 1
1116 1 51 ILE H 1 51 ILE MD . . 4.130 3.417 3.270 3.566 . 0 0 "[ . 1 . 2]" 1
1117 1 51 ILE H 1 51 ILE HG12 . . 3.870 2.595 2.478 2.810 . 0 0 "[ . 1 . 2]" 1
1118 1 51 ILE H 1 51 ILE HG13 . . 4.280 3.923 3.835 4.072 . 0 0 "[ . 1 . 2]" 1
1119 1 51 ILE H 1 51 ILE MG . . 4.540 3.757 3.659 3.808 . 0 0 "[ . 1 . 2]" 1
1120 1 51 ILE H 1 54 ASP QB . . 5.500 4.331 3.770 5.608 0.108 9 0 "[ . 1 . 2]" 1
1121 1 51 ILE HA 1 51 ILE MD . . 3.500 2.164 2.093 2.304 . 0 0 "[ . 1 . 2]" 1
1122 1 51 ILE HA 1 52 LYS H . . 3.340 1.972 1.903 2.043 . 0 0 "[ . 1 . 2]" 1
1123 1 51 ILE HA 1 52 LYS HA . . 4.190 4.282 4.275 4.288 0.098 3 0 "[ . 1 . 2]" 1
1124 1 51 ILE HA 1 52 LYS HB2 . . 4.770 4.225 4.029 4.342 . 0 0 "[ . 1 . 2]" 1
1125 1 51 ILE HA 1 53 ASP H . . 5.450 4.027 3.777 4.231 . 0 0 "[ . 1 . 2]" 1
1126 1 51 ILE HA 1 54 ASP H . . 5.500 4.546 4.304 4.844 . 0 0 "[ . 1 . 2]" 1
1127 1 51 ILE HA 1 69 LEU HA . . 5.500 4.653 4.401 4.873 . 0 0 "[ . 1 . 2]" 1
1128 1 51 ILE HA 1 70 ILE H . . 4.430 3.547 3.301 3.718 . 0 0 "[ . 1 . 2]" 1
1129 1 51 ILE HA 1 70 ILE HG13 . . 4.880 3.554 3.194 3.703 . 0 0 "[ . 1 . 2]" 1
1130 1 51 ILE HA 1 72 TYR QD . . 5.090 5.128 4.724 5.195 0.105 6 0 "[ . 1 . 2]" 1
1131 1 51 ILE HB 1 52 LYS H . . 5.380 4.460 4.396 4.521 . 0 0 "[ . 1 . 2]" 1
1132 1 51 ILE HB 1 53 ASP H . . 5.500 5.075 4.745 5.273 . 0 0 "[ . 1 . 2]" 1
1133 1 51 ILE HB 1 54 ASP H . . 4.640 3.484 3.139 3.689 . 0 0 "[ . 1 . 2]" 1
1134 1 51 ILE HB 1 54 ASP QB . . 4.650 2.636 2.189 4.020 . 0 0 "[ . 1 . 2]" 1
1135 1 51 ILE HB 1 55 PHE H . . 5.360 4.254 3.963 4.604 . 0 0 "[ . 1 . 2]" 1
1136 1 51 ILE MD 1 51 ILE MG . . 3.390 2.120 2.064 2.270 . 0 0 "[ . 1 . 2]" 1
1137 1 51 ILE MD 1 52 LYS H . . 4.260 3.599 3.489 3.699 . 0 0 "[ . 1 . 2]" 1
1138 1 51 ILE MD 1 53 ASP H . . 5.500 4.642 4.442 4.846 . 0 0 "[ . 1 . 2]" 1
1139 1 51 ILE MD 1 54 ASP H . . 5.500 4.919 4.813 5.033 . 0 0 "[ . 1 . 2]" 1
1140 1 51 ILE MD 1 70 ILE H . . 5.080 4.189 4.045 4.333 . 0 0 "[ . 1 . 2]" 1
1141 1 51 ILE MD 1 70 ILE HA . . 5.500 5.316 5.078 5.474 . 0 0 "[ . 1 . 2]" 1
1142 1 51 ILE MD 1 70 ILE HB . . 5.500 4.658 4.248 4.880 . 0 0 "[ . 1 . 2]" 1
1143 1 51 ILE MD 1 70 ILE MD . . 4.430 3.014 2.527 3.224 . 0 0 "[ . 1 . 2]" 1
1144 1 51 ILE MD 1 70 ILE HG12 . . 4.940 3.040 2.621 3.297 . 0 0 "[ . 1 . 2]" 1
1145 1 51 ILE MD 1 70 ILE HG13 . . 3.980 2.566 2.135 2.791 . 0 0 "[ . 1 . 2]" 1
1146 1 51 ILE MD 1 70 ILE MG . . 5.190 4.690 4.312 4.871 . 0 0 "[ . 1 . 2]" 1
1147 1 51 ILE MD 1 71 THR HA . . 5.080 3.686 3.123 3.909 . 0 0 "[ . 1 . 2]" 1
1148 1 51 ILE MD 1 72 TYR H . . 5.500 3.322 3.055 3.602 . 0 0 "[ . 1 . 2]" 1
1149 1 51 ILE MD 1 72 TYR HA . . 4.240 2.082 1.980 2.190 . 0 0 "[ . 1 . 2]" 1
1150 1 51 ILE MD 1 72 TYR QD . . 4.480 2.875 2.237 3.800 . 0 0 "[ . 1 . 2]" 1
1151 1 51 ILE MD 1 72 TYR QE . . 4.690 3.999 3.360 4.653 . 0 0 "[ . 1 . 2]" 1
1152 1 51 ILE MD 1 75 PHE H . . 4.710 3.466 3.183 3.609 . 0 0 "[ . 1 . 2]" 1
1153 1 51 ILE MD 1 75 PHE HB2 . . 3.940 2.182 2.038 2.359 . 0 0 "[ . 1 . 2]" 1
1154 1 51 ILE MD 1 75 PHE HB3 . . 4.360 2.395 2.148 2.729 . 0 0 "[ . 1 . 2]" 1
1155 1 51 ILE MD 1 75 PHE QD . . 4.630 2.703 2.333 3.504 . 0 0 "[ . 1 . 2]" 1
1156 1 51 ILE MD 1 76 ILE H . . 5.500 4.745 4.508 4.989 . 0 0 "[ . 1 . 2]" 1
1157 1 51 ILE MD 1 76 ILE MD . . 4.790 4.818 4.592 4.910 0.120 5 0 "[ . 1 . 2]" 1
1158 1 51 ILE HG12 1 72 TYR QE . . 5.260 4.709 4.063 5.345 0.085 19 0 "[ . 1 . 2]" 1
1159 1 51 ILE HG13 1 54 ASP H . . 4.850 4.926 4.905 4.938 0.088 13 0 "[ . 1 . 2]" 1
1160 1 51 ILE HG13 1 54 ASP QB . . 5.410 4.291 3.913 5.107 . 0 0 "[ . 1 . 2]" 1
1161 1 51 ILE HG13 1 72 TYR QE . . 5.290 3.099 2.331 4.006 . 0 0 "[ . 1 . 2]" 1
1162 1 51 ILE MG 1 52 LYS H . . 4.190 3.174 3.058 3.375 . 0 0 "[ . 1 . 2]" 1
1163 1 51 ILE MG 1 52 LYS HA . . 5.440 4.321 4.221 4.444 . 0 0 "[ . 1 . 2]" 1
1164 1 51 ILE MG 1 53 ASP H . . 3.860 2.601 2.376 2.804 . 0 0 "[ . 1 . 2]" 1
1165 1 51 ILE MG 1 53 ASP HA . . 4.980 4.235 3.992 4.398 . 0 0 "[ . 1 . 2]" 1
1166 1 51 ILE MG 1 53 ASP HB2 . . 4.210 2.776 2.348 3.673 . 0 0 "[ . 1 . 2]" 1
1167 1 51 ILE MG 1 53 ASP HB3 . . 4.270 3.489 2.564 4.213 . 0 0 "[ . 1 . 2]" 1
1168 1 51 ILE MG 1 54 ASP H . . 3.490 1.640 1.559 1.712 . 0 0 "[ . 1 . 2]" 1
1169 1 51 ILE MG 1 54 ASP HA . . 5.150 3.975 3.827 4.179 . 0 0 "[ . 1 . 2]" 1
1170 1 51 ILE MG 1 54 ASP QB . . 5.090 2.459 2.120 3.068 . 0 0 "[ . 1 . 2]" 1
1171 1 51 ILE MG 1 55 PHE H . . 4.300 3.513 3.292 3.748 . 0 0 "[ . 1 . 2]" 1
1172 1 51 ILE MG 1 70 ILE H . . 5.500 5.407 5.141 5.583 0.083 13 0 "[ . 1 . 2]" 1
1173 1 51 ILE MG 1 71 THR HA . . 4.730 3.751 3.223 4.171 . 0 0 "[ . 1 . 2]" 1
1174 1 51 ILE MG 1 71 THR HB . . 5.500 5.236 4.908 5.569 0.069 13 0 "[ . 1 . 2]" 1
1175 1 51 ILE MG 1 72 TYR H . . 5.500 3.378 3.030 3.657 . 0 0 "[ . 1 . 2]" 1
1176 1 51 ILE MG 1 72 TYR HA . . 5.000 3.395 3.030 3.829 . 0 0 "[ . 1 . 2]" 1
1177 1 51 ILE MG 1 72 TYR QD . . 3.610 2.746 2.050 3.154 . 0 0 "[ . 1 . 2]" 1
1178 1 51 ILE MG 1 72 TYR QE . . 4.250 2.480 2.134 2.819 . 0 0 "[ . 1 . 2]" 1
1179 1 52 LYS H 1 52 LYS HB2 . . 4.070 2.300 2.173 2.418 . 0 0 "[ . 1 . 2]" 1
1180 1 52 LYS H 1 52 LYS HB3 . . 4.100 2.642 2.410 2.780 . 0 0 "[ . 1 . 2]" 1
1181 1 52 LYS H 1 52 LYS QD . . 5.100 4.421 3.966 4.663 . 0 0 "[ . 1 . 2]" 1
1182 1 52 LYS H 1 52 LYS HG3 . . 5.350 4.268 4.152 4.370 . 0 0 "[ . 1 . 2]" 1
1183 1 52 LYS H 1 69 LEU HA . . 5.150 3.908 3.697 4.171 . 0 0 "[ . 1 . 2]" 1
1184 1 52 LYS H 1 69 LEU HB2 . . 5.450 5.321 5.073 5.491 0.041 13 0 "[ . 1 . 2]" 1
1185 1 52 LYS H 1 69 LEU HB3 . . 5.430 3.802 3.583 3.965 . 0 0 "[ . 1 . 2]" 1
1186 1 52 LYS H 1 69 LEU MD2 . . 4.810 3.966 3.549 4.835 0.025 17 0 "[ . 1 . 2]" 1
1187 1 52 LYS H 1 70 ILE HA . . 5.500 4.592 4.437 4.837 . 0 0 "[ . 1 . 2]" 1
1188 1 52 LYS H 1 71 THR HA . . 4.620 3.562 3.202 3.819 . 0 0 "[ . 1 . 2]" 1
1189 1 52 LYS H 1 71 THR MG . . 4.900 4.724 3.976 4.992 0.092 8 0 "[ . 1 . 2]" 1
1190 1 52 LYS HA 1 52 LYS QD . . 4.880 3.745 3.181 4.029 . 0 0 "[ . 1 . 2]" 1
1191 1 52 LYS HA 1 52 LYS QE . . 5.500 4.642 4.440 5.167 . 0 0 "[ . 1 . 2]" 1
1192 1 52 LYS HA 1 52 LYS HG2 . . 4.060 3.208 2.847 3.647 . 0 0 "[ . 1 . 2]" 1
1193 1 52 LYS HA 1 52 LYS HG3 . . 4.090 2.324 2.186 2.678 . 0 0 "[ . 1 . 2]" 1
1194 1 52 LYS HA 1 54 ASP H . . 5.500 4.660 4.415 5.115 . 0 0 "[ . 1 . 2]" 1
1195 1 52 LYS HA 1 55 PHE H . . 4.700 3.492 3.274 3.832 . 0 0 "[ . 1 . 2]" 1
1196 1 52 LYS HA 1 55 PHE HB2 . . 4.450 3.217 2.627 3.667 . 0 0 "[ . 1 . 2]" 1
1197 1 52 LYS HA 1 55 PHE HB3 . . 4.610 2.741 2.485 3.020 . 0 0 "[ . 1 . 2]" 1
1198 1 52 LYS HA 1 56 LEU H . . 5.240 3.881 3.780 4.075 . 0 0 "[ . 1 . 2]" 1
1199 1 52 LYS HA 1 56 LEU HG . . 3.590 3.679 3.665 3.687 0.097 8 0 "[ . 1 . 2]" 1
1200 1 52 LYS HA 1 69 LEU HA . . 4.830 4.197 3.947 4.415 . 0 0 "[ . 1 . 2]" 1
1201 1 52 LYS HA 1 69 LEU HB2 . . 4.570 4.540 4.209 4.649 0.079 14 0 "[ . 1 . 2]" 1
1202 1 52 LYS HA 1 69 LEU HB3 . . 4.150 2.829 2.614 2.947 . 0 0 "[ . 1 . 2]" 1
1203 1 52 LYS HA 1 69 LEU MD1 . . 3.930 3.343 2.990 3.894 . 0 0 "[ . 1 . 2]" 1
1204 1 52 LYS HA 1 69 LEU MD2 . . 3.580 2.628 2.258 3.617 0.037 17 0 "[ . 1 . 2]" 1
1205 1 52 LYS HA 1 70 ILE H . . 5.280 4.743 4.510 5.043 . 0 0 "[ . 1 . 2]" 1
1206 1 52 LYS HB2 1 53 ASP H . . 4.910 3.777 3.671 3.889 . 0 0 "[ . 1 . 2]" 1
1207 1 52 LYS HB2 1 69 LEU HA . . 5.500 3.703 3.468 4.055 . 0 0 "[ . 1 . 2]" 1
1208 1 52 LYS HB2 1 69 LEU HB3 . . 5.020 2.359 2.220 2.641 . 0 0 "[ . 1 . 2]" 1
1209 1 52 LYS HB2 1 69 LEU MD1 . . 5.500 3.969 3.694 4.429 . 0 0 "[ . 1 . 2]" 1
1210 1 52 LYS HB2 1 69 LEU MD2 . . 5.500 3.740 3.482 4.429 . 0 0 "[ . 1 . 2]" 1
1211 1 52 LYS HB2 1 70 ILE H . . 5.500 3.548 3.170 3.901 . 0 0 "[ . 1 . 2]" 1
1212 1 52 LYS HB2 1 71 THR H . . 5.500 5.123 4.808 5.290 . 0 0 "[ . 1 . 2]" 1
1213 1 52 LYS HB2 1 71 THR HA . . 4.940 4.203 3.934 4.386 . 0 0 "[ . 1 . 2]" 1
1214 1 52 LYS HB3 1 52 LYS QE . . 3.480 2.678 2.265 3.335 . 0 0 "[ . 1 . 2]" 1
1215 1 52 LYS HB3 1 53 ASP H . . 3.870 2.461 2.298 2.538 . 0 0 "[ . 1 . 2]" 1
1216 1 52 LYS HB3 1 71 THR HA . . 3.500 3.411 2.906 3.576 0.076 1 0 "[ . 1 . 2]" 1
1217 1 52 LYS QD 1 56 LEU MD1 . . 4.380 3.289 2.663 4.066 . 0 0 "[ . 1 . 2]" 1
1218 1 52 LYS QD 1 69 LEU HA . . 5.470 4.576 4.090 5.125 . 0 0 "[ . 1 . 2]" 1
1219 1 52 LYS QD 1 71 THR HA . . 5.500 5.424 4.044 5.611 0.111 13 0 "[ . 1 . 2]" 1
1220 1 52 LYS QE 1 56 LEU MD1 . . 3.550 2.925 2.099 3.641 0.091 3 0 "[ . 1 . 2]" 1
1221 1 52 LYS QE 1 69 LEU HB2 . . 5.450 4.846 3.979 5.522 0.072 7 0 "[ . 1 . 2]" 1
1222 1 52 LYS QE 1 69 LEU HB3 . . 5.300 4.448 3.653 5.366 0.066 7 0 "[ . 1 . 2]" 1
1223 1 52 LYS QE 1 70 ILE HA . . 5.500 4.860 3.787 5.373 . 0 0 "[ . 1 . 2]" 1
1224 1 52 LYS QE 1 71 THR HA . . 4.690 4.550 3.874 4.791 0.101 8 0 "[ . 1 . 2]" 1
1225 1 52 LYS QE 1 71 THR MG . . 4.450 3.191 2.009 3.756 . 0 0 "[ . 1 . 2]" 1
1226 1 52 LYS HG2 1 53 ASP H . . 3.840 3.764 3.162 3.911 0.071 16 0 "[ . 1 . 2]" 1
1227 1 52 LYS HG2 1 53 ASP HA . . 4.790 3.957 3.529 4.258 . 0 0 "[ . 1 . 2]" 1
1228 1 52 LYS HG2 1 56 LEU H . . 5.500 4.658 4.155 5.291 . 0 0 "[ . 1 . 2]" 1
1229 1 52 LYS HG2 1 56 LEU MD1 . . 4.420 2.137 2.047 2.505 . 0 0 "[ . 1 . 2]" 1
1230 1 52 LYS HG3 1 53 ASP H . . 5.500 4.521 4.053 4.741 . 0 0 "[ . 1 . 2]" 1
1231 1 52 LYS HG3 1 69 LEU HB3 . . 3.850 2.745 2.299 3.722 . 0 0 "[ . 1 . 2]" 1
1232 1 52 LYS HG3 1 69 LEU MD1 . . 4.060 2.685 2.141 3.848 . 0 0 "[ . 1 . 2]" 1
1233 1 52 LYS HG3 1 69 LEU MD2 . . 5.500 3.621 3.205 4.529 . 0 0 "[ . 1 . 2]" 1
1234 1 53 ASP H 1 53 ASP HB2 . . 3.990 2.341 2.045 2.648 . 0 0 "[ . 1 . 2]" 1
1235 1 53 ASP H 1 53 ASP HB3 . . 3.910 3.428 2.674 3.658 . 0 0 "[ . 1 . 2]" 1
1236 1 53 ASP H 1 54 ASP QB . . 5.500 4.863 4.618 5.517 0.017 18 0 "[ . 1 . 2]" 1
1237 1 53 ASP H 1 56 LEU MD1 . . 5.500 3.878 3.604 4.357 . 0 0 "[ . 1 . 2]" 1
1238 1 53 ASP H 1 71 THR HA . . 5.450 3.757 3.425 4.110 . 0 0 "[ . 1 . 2]" 1
1239 1 53 ASP HA 1 55 PHE H . . 5.440 4.539 4.222 4.830 . 0 0 "[ . 1 . 2]" 1
1240 1 53 ASP HA 1 56 LEU H . . 4.220 3.658 3.417 3.918 . 0 0 "[ . 1 . 2]" 1
1241 1 53 ASP HA 1 56 LEU HB2 . . 3.990 2.698 2.575 2.826 . 0 0 "[ . 1 . 2]" 1
1242 1 53 ASP HA 1 56 LEU HB3 . . 4.160 4.228 4.145 4.250 0.090 10 0 "[ . 1 . 2]" 1
1243 1 53 ASP HA 1 56 LEU MD1 . . 4.120 2.365 2.124 2.719 . 0 0 "[ . 1 . 2]" 1
1244 1 53 ASP HA 1 57 ALA H . . 4.520 4.054 3.886 4.513 . 0 0 "[ . 1 . 2]" 1
1245 1 53 ASP HB2 1 54 ASP H . . 4.000 2.996 2.398 4.043 0.043 18 0 "[ . 1 . 2]" 1
1246 1 53 ASP HB2 1 72 TYR QE . . 4.680 3.419 2.493 4.764 0.084 10 0 "[ . 1 . 2]" 1
1247 1 53 ASP HB3 1 54 ASP H . . 4.050 3.166 2.624 3.694 . 0 0 "[ . 1 . 2]" 1
1248 1 53 ASP HB3 1 55 PHE H . . 5.360 5.399 5.120 5.967 0.607 15 1 "[ . 1 + 2]" 1
1249 1 53 ASP HB3 1 72 TYR QE . . 4.150 3.354 2.332 4.262 0.112 7 0 "[ . 1 . 2]" 1
1250 1 54 ASP H 1 54 ASP QB . . 3.690 2.231 2.003 2.762 . 0 0 "[ . 1 . 2]" 1
1251 1 54 ASP H 1 55 PHE HB2 . . 5.190 4.819 4.573 5.115 . 0 0 "[ . 1 . 2]" 1
1252 1 54 ASP H 1 57 ALA MB . . 5.500 4.478 4.361 4.663 . 0 0 "[ . 1 . 2]" 1
1253 1 54 ASP HA 1 57 ALA H . . 4.000 3.185 2.685 3.413 . 0 0 "[ . 1 . 2]" 1
1254 1 54 ASP HA 1 57 ALA MB . . 3.400 2.254 2.042 2.482 . 0 0 "[ . 1 . 2]" 1
1255 1 54 ASP QB 1 55 PHE H . . 4.230 2.905 2.577 3.772 . 0 0 "[ . 1 . 2]" 1
1256 1 54 ASP QB 1 56 LEU H . . 5.500 4.856 4.661 5.284 . 0 0 "[ . 1 . 2]" 1
1257 1 55 PHE H 1 55 PHE HB2 . . 3.660 2.267 2.058 2.400 . 0 0 "[ . 1 . 2]" 1
1258 1 55 PHE H 1 55 PHE HB3 . . 3.590 2.644 2.439 3.001 . 0 0 "[ . 1 . 2]" 1
1259 1 55 PHE H 1 56 LEU HG . . 5.500 4.451 4.227 4.775 . 0 0 "[ . 1 . 2]" 1
1260 1 55 PHE H 1 58 ARG H . . 5.500 4.684 4.421 4.959 . 0 0 "[ . 1 . 2]" 1
1261 1 55 PHE H 1 69 LEU MD2 . . 5.500 4.535 4.187 5.142 . 0 0 "[ . 1 . 2]" 1
1262 1 55 PHE HA 1 55 PHE QD . . 3.410 2.375 2.102 3.136 . 0 0 "[ . 1 . 2]" 1
1263 1 55 PHE HA 1 57 ALA H . . 5.430 4.369 3.984 4.538 . 0 0 "[ . 1 . 2]" 1
1264 1 55 PHE HA 1 58 ARG H . . 4.900 3.343 3.133 3.547 . 0 0 "[ . 1 . 2]" 1
1265 1 55 PHE HA 1 60 TYR QD . . 4.310 3.490 2.938 4.414 0.104 19 0 "[ . 1 . 2]" 1
1266 1 55 PHE HA 1 69 LEU MD2 . . 5.500 4.999 4.649 5.363 . 0 0 "[ . 1 . 2]" 1
1267 1 55 PHE HB2 1 56 LEU H . . 3.890 3.599 3.341 3.671 . 0 0 "[ . 1 . 2]" 1
1268 1 55 PHE HB2 1 56 LEU HG . . 4.750 4.744 4.318 4.825 0.075 18 0 "[ . 1 . 2]" 1
1269 1 55 PHE HB2 1 57 ALA H . . 5.500 5.531 5.355 5.573 0.073 1 0 "[ . 1 . 2]" 1
1270 1 55 PHE HB2 1 69 LEU MD2 . . 4.430 3.021 2.586 3.424 . 0 0 "[ . 1 . 2]" 1
1271 1 55 PHE HB3 1 56 LEU H . . 4.260 2.441 2.308 2.615 . 0 0 "[ . 1 . 2]" 1
1272 1 55 PHE HB3 1 56 LEU HB3 . . 5.500 5.555 5.489 5.574 0.074 13 0 "[ . 1 . 2]" 1
1273 1 55 PHE HB3 1 56 LEU MD2 . . 4.430 4.132 3.819 4.335 . 0 0 "[ . 1 . 2]" 1
1274 1 55 PHE HB3 1 57 ALA H . . 5.500 4.831 4.704 5.039 . 0 0 "[ . 1 . 2]" 1
1275 1 55 PHE HB3 1 69 LEU MD2 . . 4.400 3.156 2.756 3.569 . 0 0 "[ . 1 . 2]" 1
1276 1 55 PHE QD 1 56 LEU HA . . 4.910 4.571 3.024 4.977 0.067 3 0 "[ . 1 . 2]" 1
1277 1 55 PHE QD 1 56 LEU HG . . 4.860 3.926 2.921 4.754 . 0 0 "[ . 1 . 2]" 1
1278 1 55 PHE QD 1 60 TYR QD . . 4.330 3.204 2.712 4.460 0.130 7 0 "[ . 1 . 2]" 1
1279 1 55 PHE QD 1 62 GLU HA . . 4.160 3.471 3.070 4.251 0.091 8 0 "[ . 1 . 2]" 1
1280 1 55 PHE QD 1 65 SER HB3 . . 4.840 4.406 3.575 5.146 0.306 17 0 "[ . 1 . 2]" 1
1281 1 55 PHE QD 1 69 LEU MD1 . . 3.430 2.493 2.103 3.342 . 0 0 "[ . 1 . 2]" 1
1282 1 55 PHE QD 1 69 LEU MD2 . . 4.360 2.570 2.255 2.913 . 0 0 "[ . 1 . 2]" 1
1283 1 55 PHE QE 1 64 ASP HB2 . . 4.330 2.740 2.130 3.441 . 0 0 "[ . 1 . 2]" 1
1284 1 55 PHE QE 1 65 SER HA . . 3.600 3.524 3.162 3.675 0.075 16 0 "[ . 1 . 2]" 1
1285 1 55 PHE QE 1 65 SER HB2 . . 4.750 2.517 2.070 3.147 . 0 0 "[ . 1 . 2]" 1
1286 1 55 PHE QE 1 65 SER HB3 . . 4.580 3.315 2.109 4.181 . 0 0 "[ . 1 . 2]" 1
1287 1 55 PHE QE 1 69 LEU MD1 . . 4.050 2.806 2.335 4.031 . 0 0 "[ . 1 . 2]" 1
1288 1 55 PHE HZ 1 65 SER HA . . 3.620 2.674 2.374 3.338 . 0 0 "[ . 1 . 2]" 1
1289 1 55 PHE HZ 1 65 SER HB2 . . 4.930 2.964 2.617 3.678 . 0 0 "[ . 1 . 2]" 1
1290 1 56 LEU H 1 56 LEU HB2 . . 3.640 2.353 2.287 2.428 . 0 0 "[ . 1 . 2]" 1
1291 1 56 LEU H 1 56 LEU HB3 . . 3.950 3.534 3.484 3.561 . 0 0 "[ . 1 . 2]" 1
1292 1 56 LEU H 1 56 LEU MD1 . . 3.950 3.416 3.285 3.544 . 0 0 "[ . 1 . 2]" 1
1293 1 56 LEU H 1 56 LEU MD2 . . 3.960 3.573 3.382 3.721 . 0 0 "[ . 1 . 2]" 1
1294 1 56 LEU H 1 56 LEU HG . . 3.590 2.271 2.197 2.405 . 0 0 "[ . 1 . 2]" 1
1295 1 56 LEU H 1 57 ALA HA . . 5.180 5.233 5.197 5.257 0.077 17 0 "[ . 1 . 2]" 1
1296 1 56 LEU H 1 57 ALA MB . . 4.660 4.323 4.157 4.392 . 0 0 "[ . 1 . 2]" 1
1297 1 56 LEU H 1 69 LEU MD2 . . 5.500 5.115 4.735 5.598 0.098 17 0 "[ . 1 . 2]" 1
1298 1 56 LEU HA 1 56 LEU MD2 . . 3.200 2.161 2.093 2.229 . 0 0 "[ . 1 . 2]" 1
1299 1 56 LEU HA 1 57 ALA HA . . 4.660 4.726 4.711 4.736 0.076 13 0 "[ . 1 . 2]" 1
1300 1 56 LEU HA 1 58 ARG H . . 4.790 3.663 3.501 3.891 . 0 0 "[ . 1 . 2]" 1
1301 1 56 LEU HA 1 59 GLY H . . 4.520 4.162 3.845 4.558 0.038 19 0 "[ . 1 . 2]" 1
1302 1 56 LEU HB2 1 56 LEU MD2 . . 3.530 3.247 3.213 3.270 . 0 0 "[ . 1 . 2]" 1
1303 1 56 LEU HB2 1 57 ALA H . . 3.790 2.607 2.378 2.905 . 0 0 "[ . 1 . 2]" 1
1304 1 56 LEU HB2 1 57 ALA HA . . 4.430 4.473 4.355 4.504 0.074 15 0 "[ . 1 . 2]" 1
1305 1 56 LEU HB3 1 56 LEU MD2 . . 3.420 2.376 2.272 2.446 . 0 0 "[ . 1 . 2]" 1
1306 1 56 LEU HB3 1 57 ALA H . . 4.110 3.616 3.397 3.847 . 0 0 "[ . 1 . 2]" 1
1307 1 56 LEU HB3 1 60 TYR H . . 5.500 5.413 4.991 5.590 0.090 10 0 "[ . 1 . 2]" 1
1308 1 56 LEU MD2 1 57 ALA H . . 5.080 4.789 4.710 4.928 . 0 0 "[ . 1 . 2]" 1
1309 1 56 LEU MD2 1 58 ARG H . . 5.500 5.329 5.145 5.567 0.067 12 0 "[ . 1 . 2]" 1
1310 1 56 LEU MD2 1 61 SER HA . . 3.390 2.956 2.105 3.475 0.085 18 0 "[ . 1 . 2]" 1
1311 1 56 LEU MD2 1 62 GLU HG2 . . 3.610 2.747 2.297 3.277 . 0 0 "[ . 1 . 2]" 1
1312 1 56 LEU MD2 1 62 GLU HG3 . . 3.600 3.105 2.438 3.688 0.088 18 0 "[ . 1 . 2]" 1
1313 1 56 LEU HG 1 57 ALA H . . 5.170 4.384 4.252 4.519 . 0 0 "[ . 1 . 2]" 1
1314 1 56 LEU HG 1 58 ARG H . . 5.500 5.584 5.577 5.593 0.093 19 0 "[ . 1 . 2]" 1
1315 1 57 ALA H 1 57 ALA MB . . 3.030 2.267 2.175 2.310 . 0 0 "[ . 1 . 2]" 1
1316 1 57 ALA H 1 58 ARG HA . . 5.500 5.273 5.019 5.413 . 0 0 "[ . 1 . 2]" 1
1317 1 57 ALA H 1 58 ARG HB2 . . 5.500 4.402 4.002 4.886 . 0 0 "[ . 1 . 2]" 1
1318 1 57 ALA H 1 58 ARG HB3 . . 5.500 5.437 4.997 5.584 0.084 20 0 "[ . 1 . 2]" 1
1319 1 57 ALA HA 1 59 GLY H . . 4.220 3.571 3.404 3.905 . 0 0 "[ . 1 . 2]" 1
1320 1 57 ALA MB 1 58 ARG H . . 3.820 3.201 3.021 3.413 . 0 0 "[ . 1 . 2]" 1
1321 1 57 ALA MB 1 59 GLY H . . 4.880 4.482 4.334 4.831 . 0 0 "[ . 1 . 2]" 1
1322 1 58 ARG H 1 58 ARG HB2 . . 3.930 2.400 2.129 2.796 . 0 0 "[ . 1 . 2]" 1
1323 1 58 ARG H 1 58 ARG HB3 . . 3.600 3.041 2.481 3.460 . 0 0 "[ . 1 . 2]" 1
1324 1 58 ARG H 1 59 GLY HA2 . . 5.500 4.755 4.492 4.968 . 0 0 "[ . 1 . 2]" 1
1325 1 58 ARG H 1 59 GLY HA3 . . 5.250 5.170 4.965 5.325 0.075 19 0 "[ . 1 . 2]" 1
1326 1 58 ARG H 1 60 TYR HB2 . . 4.990 4.575 4.144 5.042 0.052 5 0 "[ . 1 . 2]" 1
1327 1 58 ARG HA 1 58 ARG HD2 . . 4.810 4.214 3.632 4.563 . 0 0 "[ . 1 . 2]" 1
1328 1 58 ARG HA 1 58 ARG HD3 . . 4.830 4.147 3.850 4.785 . 0 0 "[ . 1 . 2]" 1
1329 1 58 ARG HA 1 58 ARG QG . . 2.720 2.339 2.159 2.795 0.075 3 0 "[ . 1 . 2]" 1
1330 1 58 ARG HA 1 59 GLY HA3 . . 5.500 4.334 4.250 4.474 . 0 0 "[ . 1 . 2]" 1
1331 1 58 ARG HA 1 60 TYR H . . 5.420 5.054 4.615 5.496 0.076 2 0 "[ . 1 . 2]" 1
1332 1 58 ARG HA 1 60 TYR QD . . 4.760 4.493 4.327 4.635 . 0 0 "[ . 1 . 2]" 1
1333 1 58 ARG HB2 1 59 GLY H . . 5.500 4.387 4.137 4.564 . 0 0 "[ . 1 . 2]" 1
1334 1 58 ARG HB2 1 60 TYR QD . . 3.570 3.532 2.676 3.674 0.104 13 0 "[ . 1 . 2]" 1
1335 1 58 ARG HB3 1 59 GLY H . . 5.220 4.234 4.044 4.400 . 0 0 "[ . 1 . 2]" 1
1336 1 58 ARG HB3 1 60 TYR H . . 5.500 4.310 3.574 5.080 . 0 0 "[ . 1 . 2]" 1
1337 1 58 ARG HB3 1 60 TYR QD . . 3.610 2.190 1.996 2.364 . 0 0 "[ . 1 . 2]" 1
1338 1 58 ARG HD3 1 60 TYR QD . . 5.150 3.911 2.936 5.553 0.403 17 0 "[ . 1 . 2]" 1
1339 1 58 ARG QG 1 59 GLY H . . 5.090 4.814 4.509 4.936 . 0 0 "[ . 1 . 2]" 1
1340 1 58 ARG QG 1 60 TYR QD . . 5.460 4.042 2.433 4.563 . 0 0 "[ . 1 . 2]" 1
1341 1 59 GLY H 1 60 TYR HB2 . . 5.500 5.104 4.836 5.315 . 0 0 "[ . 1 . 2]" 1
1342 1 60 TYR H 1 60 TYR HB2 . . 3.970 2.452 2.344 2.599 . 0 0 "[ . 1 . 2]" 1
1343 1 60 TYR H 1 60 TYR HB3 . . 3.500 3.575 3.553 3.591 0.091 2 0 "[ . 1 . 2]" 1
1344 1 60 TYR H 1 61 SER QB . . 5.500 5.457 5.001 5.606 0.106 2 0 "[ . 1 . 2]" 1
1345 1 60 TYR HA 1 60 TYR QD . . 3.020 3.025 2.864 3.115 0.095 20 0 "[ . 1 . 2]" 1
1346 1 60 TYR HA 1 61 SER H . . 3.150 2.467 2.224 2.690 . 0 0 "[ . 1 . 2]" 1
1347 1 60 TYR HA 1 61 SER HA . . 4.490 4.546 4.497 4.569 0.079 7 0 "[ . 1 . 2]" 1
1348 1 60 TYR HA 1 64 ASP HB2 . . 5.500 4.046 3.551 4.541 . 0 0 "[ . 1 . 2]" 1
1349 1 60 TYR HA 1 64 ASP HB3 . . 5.500 4.572 4.092 5.230 . 0 0 "[ . 1 . 2]" 1
1350 1 60 TYR HB2 1 61 SER H . . 3.690 3.639 3.077 3.760 0.070 18 0 "[ . 1 . 2]" 1
1351 1 60 TYR HB3 1 61 SER H . . 4.030 2.341 1.897 2.557 . 0 0 "[ . 1 . 2]" 1
1352 1 60 TYR HB3 1 64 ASP H . . 5.500 4.458 4.096 5.076 . 0 0 "[ . 1 . 2]" 1
1353 1 60 TYR HB3 1 64 ASP HB2 . . 4.990 2.600 2.303 3.102 . 0 0 "[ . 1 . 2]" 1
1354 1 60 TYR QD 1 64 ASP HB2 . . 4.000 2.562 2.138 2.958 . 0 0 "[ . 1 . 2]" 1
1355 1 60 TYR QD 1 64 ASP HB3 . . 3.940 2.198 1.976 2.492 . 0 0 "[ . 1 . 2]" 1
1356 1 60 TYR QD 1 65 SER HA . . 4.960 5.058 5.044 5.069 0.109 6 0 "[ . 1 . 2]" 1
1357 1 61 SER H 1 61 SER QB . . 3.400 2.447 2.093 3.019 . 0 0 "[ . 1 . 2]" 1
1358 1 61 SER H 1 64 ASP HA . . 5.020 4.999 4.705 5.103 0.083 8 0 "[ . 1 . 2]" 1
1359 1 61 SER H 1 64 ASP HB2 . . 4.360 2.581 1.903 2.984 . 0 0 "[ . 1 . 2]" 1
1360 1 61 SER H 1 64 ASP HB3 . . 4.540 3.779 3.412 4.111 . 0 0 "[ . 1 . 2]" 1
1361 1 61 SER HA 1 61 SER QB . . 2.660 2.404 2.163 2.573 . 0 0 "[ . 1 . 2]" 1
1362 1 61 SER HA 1 62 GLU H . . 3.010 2.555 2.418 2.877 . 0 0 "[ . 1 . 2]" 1
1363 1 61 SER HA 1 62 GLU HA . . 4.910 4.224 3.965 4.420 . 0 0 "[ . 1 . 2]" 1
1364 1 61 SER HA 1 62 GLU HB2 . . 5.500 5.101 4.695 5.503 0.003 7 0 "[ . 1 . 2]" 1
1365 1 61 SER HA 1 62 GLU HG2 . . 4.820 4.547 3.716 4.645 . 0 0 "[ . 1 . 2]" 1
1366 1 61 SER HA 1 62 GLU HG3 . . 4.560 4.020 3.156 4.472 . 0 0 "[ . 1 . 2]" 1
1367 1 61 SER HA 1 63 GLU H . . 4.770 4.461 3.952 4.844 0.074 8 0 "[ . 1 . 2]" 1
1368 1 61 SER HA 1 64 ASP H . . 5.380 4.823 4.635 5.107 . 0 0 "[ . 1 . 2]" 1
1369 1 61 SER QB 1 62 GLU H . . 3.290 3.086 2.257 3.373 0.083 9 0 "[ . 1 . 2]" 1
1370 1 61 SER QB 1 63 GLU H . . 3.790 3.211 2.541 3.872 0.082 8 0 "[ . 1 . 2]" 1
1371 1 61 SER QB 1 63 GLU QB . . 4.670 3.981 3.082 4.584 . 0 0 "[ . 1 . 2]" 1
1372 1 61 SER QB 1 64 ASP H . . 4.530 3.401 2.532 4.390 . 0 0 "[ . 1 . 2]" 1
1373 1 62 GLU H 1 62 GLU HB2 . . 3.560 2.592 2.339 2.945 . 0 0 "[ . 1 . 2]" 1
1374 1 62 GLU H 1 62 GLU HG2 . . 3.730 3.107 2.476 3.547 . 0 0 "[ . 1 . 2]" 1
1375 1 62 GLU H 1 62 GLU HG3 . . 3.740 2.264 1.990 2.811 . 0 0 "[ . 1 . 2]" 1
1376 1 62 GLU H 1 63 GLU HA . . 5.210 5.265 5.044 5.295 0.085 7 0 "[ . 1 . 2]" 1
1377 1 62 GLU H 1 69 LEU MD1 . . 4.130 4.207 4.128 4.241 0.111 5 0 "[ . 1 . 2]" 1
1378 1 62 GLU HA 1 62 GLU HG2 . . 3.810 2.515 2.280 2.837 . 0 0 "[ . 1 . 2]" 1
1379 1 62 GLU HA 1 62 GLU HG3 . . 3.750 3.294 2.785 3.608 . 0 0 "[ . 1 . 2]" 1
1380 1 62 GLU HA 1 63 GLU HA . . 4.770 4.678 4.547 4.791 0.021 10 0 "[ . 1 . 2]" 1
1381 1 62 GLU HA 1 64 ASP H . . 4.200 3.840 3.655 4.129 . 0 0 "[ . 1 . 2]" 1
1382 1 62 GLU HA 1 65 SER H . . 4.520 4.201 3.711 4.588 0.068 4 0 "[ . 1 . 2]" 1
1383 1 62 GLU HA 1 69 LEU HB2 . . 5.500 4.698 4.423 4.972 . 0 0 "[ . 1 . 2]" 1
1384 1 62 GLU HA 1 69 LEU HB3 . . 5.020 4.841 4.680 5.077 0.057 12 0 "[ . 1 . 2]" 1
1385 1 62 GLU HA 1 69 LEU MD1 . . 3.130 1.974 1.862 2.074 . 0 0 "[ . 1 . 2]" 1
1386 1 62 GLU HA 1 69 LEU MD2 . . 4.240 4.091 3.839 4.304 0.064 7 0 "[ . 1 . 2]" 1
1387 1 62 GLU HB2 1 62 GLU HG2 . . 3.000 3.035 3.008 3.057 0.057 8 0 "[ . 1 . 2]" 1
1388 1 62 GLU HB2 1 69 LEU MD1 . . 3.720 3.776 3.684 3.827 0.107 13 0 "[ . 1 . 2]" 1
1389 1 62 GLU HG2 1 63 GLU H . . 4.750 4.951 4.594 5.264 0.514 10 1 "[ . + . 2]" 1
1390 1 63 GLU H 1 63 GLU QB . . 3.210 2.219 2.056 2.408 . 0 0 "[ . 1 . 2]" 1
1391 1 63 GLU H 1 63 GLU QG . . 4.040 3.517 2.171 4.119 0.079 17 0 "[ . 1 . 2]" 1
1392 1 63 GLU H 1 64 ASP HB2 . . 5.500 4.722 3.994 5.150 . 0 0 "[ . 1 . 2]" 1
1393 1 63 GLU H 1 69 LEU MD1 . . 4.950 4.421 4.167 4.685 . 0 0 "[ . 1 . 2]" 1
1394 1 63 GLU HA 1 63 GLU QG . . 3.420 2.385 2.038 3.407 . 0 0 "[ . 1 . 2]" 1
1395 1 63 GLU HA 1 65 SER H . . 4.160 3.718 3.299 4.224 0.064 16 0 "[ . 1 . 2]" 1
1396 1 63 GLU HA 1 69 LEU MD1 . . 5.450 4.500 4.133 4.986 . 0 0 "[ . 1 . 2]" 1
1397 1 63 GLU QB 1 64 ASP H . . 4.490 3.432 3.038 3.935 . 0 0 "[ . 1 . 2]" 1
1398 1 63 GLU QG 1 64 ASP H . . 4.910 4.422 2.838 4.872 . 0 0 "[ . 1 . 2]" 1
1399 1 64 ASP H 1 64 ASP HB2 . . 3.630 2.411 2.180 2.538 . 0 0 "[ . 1 . 2]" 1
1400 1 64 ASP H 1 64 ASP HB3 . . 3.950 3.588 3.462 3.656 . 0 0 "[ . 1 . 2]" 1
1401 1 64 ASP H 1 65 SER HA . . 5.140 5.065 4.892 5.203 0.063 8 0 "[ . 1 . 2]" 1
1402 1 64 ASP H 1 65 SER HB2 . . 5.500 4.825 4.097 5.579 0.079 16 0 "[ . 1 . 2]" 1
1403 1 64 ASP H 1 65 SER HB3 . . 5.340 4.820 4.231 5.575 0.235 20 0 "[ . 1 . 2]" 1
1404 1 64 ASP H 1 69 LEU MD1 . . 5.500 4.172 3.803 4.716 . 0 0 "[ . 1 . 2]" 1
1405 1 64 ASP HA 1 64 ASP HB3 . . 2.880 2.510 2.437 2.684 . 0 0 "[ . 1 . 2]" 1
1406 1 64 ASP HB2 1 65 SER H . . 4.390 3.175 2.809 3.636 . 0 0 "[ . 1 . 2]" 1
1407 1 64 ASP HB3 1 65 SER H . . 4.250 3.941 3.567 4.211 . 0 0 "[ . 1 . 2]" 1
1408 1 64 ASP HB3 1 65 SER HA . . 5.060 4.286 3.580 4.605 . 0 0 "[ . 1 . 2]" 1
1409 1 65 SER H 1 65 SER HB2 . . 3.370 2.774 2.159 3.417 0.047 7 0 "[ . 1 . 2]" 1
1410 1 65 SER H 1 65 SER HB3 . . 3.530 2.592 2.177 3.341 . 0 0 "[ . 1 . 2]" 1
1411 1 65 SER H 1 69 LEU MD1 . . 4.290 3.358 3.124 3.721 . 0 0 "[ . 1 . 2]" 1
1412 1 65 SER H 1 69 LEU MD2 . . 4.470 4.268 3.846 4.569 0.099 8 0 "[ . 1 . 2]" 1
1413 1 65 SER H 1 69 LEU HG . . 5.500 4.766 4.465 5.074 . 0 0 "[ . 1 . 2]" 1
1414 1 65 SER HA 1 66 LYS H . . 3.220 2.311 2.222 2.447 . 0 0 "[ . 1 . 2]" 1
1415 1 65 SER HA 1 66 LYS HB3 . . 4.600 4.548 4.178 4.676 0.076 10 0 "[ . 1 . 2]" 1
1416 1 65 SER HA 1 66 LYS QG . . 4.970 4.227 4.025 4.767 . 0 0 "[ . 1 . 2]" 1
1417 1 65 SER HA 1 67 VAL H . . 4.150 4.014 3.786 4.232 0.082 17 0 "[ . 1 . 2]" 1
1418 1 65 SER HA 1 67 VAL MG1 . . 5.500 4.870 4.332 5.191 . 0 0 "[ . 1 . 2]" 1
1419 1 65 SER HA 1 69 LEU MD1 . . 5.240 4.826 4.540 5.311 0.071 4 0 "[ . 1 . 2]" 1
1420 1 65 SER HA 1 69 LEU MD2 . . 5.220 4.356 4.204 4.567 . 0 0 "[ . 1 . 2]" 1
1421 1 65 SER HB2 1 66 LYS H . . 4.480 4.126 3.126 4.602 0.122 14 0 "[ . 1 . 2]" 1
1422 1 65 SER HB2 1 67 VAL H . . 4.210 4.070 3.646 4.274 0.064 8 0 "[ . 1 . 2]" 1
1423 1 65 SER HB2 1 67 VAL MG2 . . 5.470 4.094 3.556 4.702 . 0 0 "[ . 1 . 2]" 1
1424 1 65 SER HB2 1 69 LEU MD1 . . 4.170 2.884 2.127 3.796 . 0 0 "[ . 1 . 2]" 1
1425 1 65 SER HB2 1 69 LEU MD2 . . 4.280 2.328 2.094 2.695 . 0 0 "[ . 1 . 2]" 1
1426 1 65 SER HB2 1 69 LEU HG . . 4.720 3.627 2.826 4.535 . 0 0 "[ . 1 . 2]" 1
1427 1 65 SER HB3 1 66 LYS H . . 4.540 4.079 2.772 4.507 . 0 0 "[ . 1 . 2]" 1
1428 1 65 SER HB3 1 67 VAL H . . 4.400 3.211 2.054 4.151 . 0 0 "[ . 1 . 2]" 1
1429 1 65 SER HB3 1 67 VAL MG2 . . 5.500 3.897 2.468 4.518 . 0 0 "[ . 1 . 2]" 1
1430 1 65 SER HB3 1 69 LEU HB3 . . 5.210 5.397 5.243 6.041 0.831 17 3 "[ - 1 . + *]" 1
1431 1 65 SER HB3 1 69 LEU MD1 . . 4.270 2.695 2.116 3.858 . 0 0 "[ . 1 . 2]" 1
1432 1 65 SER HB3 1 69 LEU MD2 . . 3.860 2.592 2.218 2.948 . 0 0 "[ . 1 . 2]" 1
1433 1 65 SER HB3 1 69 LEU HG . . 4.860 2.902 2.510 4.065 . 0 0 "[ . 1 . 2]" 1
1434 1 66 LYS H 1 66 LYS HB2 . . 4.070 3.713 3.635 3.817 . 0 0 "[ . 1 . 2]" 1
1435 1 66 LYS H 1 66 LYS HB3 . . 4.050 2.738 2.460 3.014 . 0 0 "[ . 1 . 2]" 1
1436 1 66 LYS H 1 66 LYS QD . . 5.050 4.082 2.869 4.405 . 0 0 "[ . 1 . 2]" 1
1437 1 66 LYS H 1 66 LYS QG . . 3.880 2.366 2.212 2.717 . 0 0 "[ . 1 . 2]" 1
1438 1 66 LYS H 1 67 VAL HA . . 5.500 5.332 5.110 5.534 0.034 14 0 "[ . 1 . 2]" 1
1439 1 66 LYS H 1 67 VAL MG1 . . 5.410 3.405 2.969 3.688 . 0 0 "[ . 1 . 2]" 1
1440 1 66 LYS H 1 67 VAL MG2 . . 4.380 4.197 3.878 4.469 0.089 19 0 "[ . 1 . 2]" 1
1441 1 66 LYS HA 1 66 LYS QG . . 3.440 3.412 3.386 3.443 0.003 16 0 "[ . 1 . 2]" 1
1442 1 66 LYS HA 1 67 VAL MG1 . . 4.110 4.190 4.077 4.213 0.103 7 0 "[ . 1 . 2]" 1
1443 1 66 LYS HB2 1 67 VAL H . . 5.140 4.598 4.554 4.703 . 0 0 "[ . 1 . 2]" 1
1444 1 66 LYS HB2 1 67 VAL MG1 . . 4.230 4.161 4.049 4.314 0.084 16 0 "[ . 1 . 2]" 1
1445 1 66 LYS HB3 1 66 LYS QD . . 3.270 2.777 2.119 3.172 . 0 0 "[ . 1 . 2]" 1
1446 1 66 LYS HB3 1 67 VAL H . . 4.900 4.653 4.573 4.714 . 0 0 "[ . 1 . 2]" 1
1447 1 66 LYS HB3 1 67 VAL MG1 . . 4.650 4.601 4.181 4.746 0.096 13 0 "[ . 1 . 2]" 1
1448 1 66 LYS QD 1 67 VAL MG1 . . 3.680 3.531 2.792 3.822 0.142 1 0 "[ . 1 . 2]" 1
1449 1 66 LYS QG 1 67 VAL H . . 5.380 3.943 3.743 4.102 . 0 0 "[ . 1 . 2]" 1
1450 1 67 VAL H 1 67 VAL MG1 . . 3.960 3.040 2.904 3.173 . 0 0 "[ . 1 . 2]" 1
1451 1 67 VAL H 1 67 VAL MG2 . . 3.380 2.812 2.605 3.018 . 0 0 "[ . 1 . 2]" 1
1452 1 67 VAL H 1 68 PRO HD2 . . 5.500 4.907 4.804 5.137 . 0 0 "[ . 1 . 2]" 1
1453 1 67 VAL H 1 68 PRO HD3 . . 5.490 4.794 4.690 4.896 . 0 0 "[ . 1 . 2]" 1
1454 1 67 VAL H 1 69 LEU MD1 . . 5.500 5.074 4.628 5.559 0.059 4 0 "[ . 1 . 2]" 1
1455 1 67 VAL H 1 69 LEU MD2 . . 4.330 4.249 3.275 4.426 0.096 10 0 "[ . 1 . 2]" 1
1456 1 67 VAL H 1 69 LEU HG . . 4.750 4.323 3.957 4.631 . 0 0 "[ . 1 . 2]" 1
1457 1 67 VAL HA 1 67 VAL MG1 . . 3.120 2.600 2.444 2.718 . 0 0 "[ . 1 . 2]" 1
1458 1 67 VAL HA 1 68 PRO HB3 . . 4.860 4.920 4.796 4.948 0.088 17 0 "[ . 1 . 2]" 1
1459 1 67 VAL HA 1 68 PRO HD2 . . 3.210 2.774 2.499 3.196 . 0 0 "[ . 1 . 2]" 1
1460 1 67 VAL HA 1 68 PRO HD3 . . 2.970 2.305 2.092 2.436 . 0 0 "[ . 1 . 2]" 1
1461 1 67 VAL HA 1 68 PRO HG3 . . 4.530 4.513 4.088 4.610 0.080 7 0 "[ . 1 . 2]" 1
1462 1 67 VAL HB 1 68 PRO HD2 . . 3.430 2.034 1.949 2.256 . 0 0 "[ . 1 . 2]" 1
1463 1 67 VAL HB 1 68 PRO HD3 . . 4.010 3.053 2.475 3.364 . 0 0 "[ . 1 . 2]" 1
1464 1 67 VAL MG1 1 68 PRO HD3 . . 4.080 4.099 3.689 4.189 0.109 14 0 "[ . 1 . 2]" 1
1465 1 67 VAL MG2 1 68 PRO HA . . 5.500 4.145 3.988 4.270 . 0 0 "[ . 1 . 2]" 1
1466 1 67 VAL MG2 1 68 PRO HB2 . . 5.500 4.878 4.668 5.107 . 0 0 "[ . 1 . 2]" 1
1467 1 67 VAL MG2 1 68 PRO HD2 . . 3.670 2.833 2.453 3.222 . 0 0 "[ . 1 . 2]" 1
1468 1 67 VAL MG2 1 68 PRO HD3 . . 4.540 3.910 3.528 4.237 . 0 0 "[ . 1 . 2]" 1
1469 1 67 VAL MG2 1 69 LEU H . . 5.500 4.403 4.141 4.931 . 0 0 "[ . 1 . 2]" 1
1470 1 67 VAL MG2 1 69 LEU HA . . 4.850 3.877 3.667 4.114 . 0 0 "[ . 1 . 2]" 1
1471 1 67 VAL MG2 1 69 LEU HB2 . . 5.500 5.578 5.485 5.615 0.115 5 0 "[ . 1 . 2]" 1
1472 1 67 VAL MG2 1 69 LEU MD2 . . 3.510 2.975 2.678 3.384 . 0 0 "[ . 1 . 2]" 1
1473 1 67 VAL MG2 1 69 LEU HG . . 4.830 4.020 3.684 4.306 . 0 0 "[ . 1 . 2]" 1
1474 1 68 PRO HA 1 69 LEU H . . 2.850 2.037 1.940 2.279 . 0 0 "[ . 1 . 2]" 1
1475 1 68 PRO HA 1 69 LEU HA . . 4.850 4.398 4.356 4.429 . 0 0 "[ . 1 . 2]" 1
1476 1 68 PRO HA 1 69 LEU HB2 . . 5.110 4.348 4.101 4.609 . 0 0 "[ . 1 . 2]" 1
1477 1 68 PRO HA 1 69 LEU HB3 . . 5.500 5.534 5.427 5.573 0.073 16 0 "[ . 1 . 2]" 1
1478 1 68 PRO HA 1 69 LEU MD1 . . 5.050 5.000 4.592 5.152 0.102 20 0 "[ . 1 . 2]" 1
1479 1 68 PRO HA 1 69 LEU MD2 . . 5.290 4.642 4.113 5.162 . 0 0 "[ . 1 . 2]" 1
1480 1 68 PRO HA 1 69 LEU HG . . 5.200 3.854 3.490 4.015 . 0 0 "[ . 1 . 2]" 1
1481 1 68 PRO HA 1 70 ILE H . . 5.500 5.556 5.454 5.590 0.090 12 0 "[ . 1 . 2]" 1
1482 1 68 PRO HA 1 70 ILE MG . . 5.290 4.327 4.123 4.614 . 0 0 "[ . 1 . 2]" 1
1483 1 68 PRO HB2 1 69 LEU H . . 3.810 3.645 2.900 3.846 0.036 13 0 "[ . 1 . 2]" 1
1484 1 68 PRO HB2 1 69 LEU HA . . 5.500 4.913 4.672 5.004 . 0 0 "[ . 1 . 2]" 1
1485 1 68 PRO HB2 1 70 ILE MG . . 4.320 2.713 2.617 2.832 . 0 0 "[ . 1 . 2]" 1
1486 1 68 PRO HB3 1 69 LEU H . . 4.380 3.930 3.670 4.063 . 0 0 "[ . 1 . 2]" 1
1487 1 68 PRO HB3 1 70 ILE MG . . 4.330 4.162 4.039 4.274 . 0 0 "[ . 1 . 2]" 1
1488 1 68 PRO HD2 1 70 ILE MG . . 5.500 4.914 4.419 5.224 . 0 0 "[ . 1 . 2]" 1
1489 1 68 PRO HD3 1 69 LEU H . . 5.500 5.442 5.266 5.567 0.067 1 0 "[ . 1 . 2]" 1
1490 1 68 PRO HD3 1 70 ILE MG . . 5.500 5.604 5.590 5.617 0.117 14 0 "[ . 1 . 2]" 1
1491 1 68 PRO HG2 1 69 LEU H . . 5.500 5.120 4.518 5.549 0.049 8 0 "[ . 1 . 2]" 1
1492 1 69 LEU H 1 69 LEU HB2 . . 3.560 2.403 2.296 2.587 . 0 0 "[ . 1 . 2]" 1
1493 1 69 LEU H 1 69 LEU MD1 . . 4.270 3.702 3.242 4.080 . 0 0 "[ . 1 . 2]" 1
1494 1 69 LEU H 1 69 LEU MD2 . . 4.190 3.583 3.194 3.942 . 0 0 "[ . 1 . 2]" 1
1495 1 69 LEU H 1 69 LEU HG . . 3.790 2.599 2.181 3.163 . 0 0 "[ . 1 . 2]" 1
1496 1 69 LEU H 1 70 ILE HA . . 5.500 5.120 4.538 5.349 . 0 0 "[ . 1 . 2]" 1
1497 1 69 LEU HA 1 69 LEU MD2 . . 3.250 2.228 2.132 2.409 . 0 0 "[ . 1 . 2]" 1
1498 1 69 LEU HA 1 70 ILE H . . 3.320 2.043 1.981 2.081 . 0 0 "[ . 1 . 2]" 1
1499 1 69 LEU HA 1 70 ILE HA . . 4.800 4.397 4.365 4.433 . 0 0 "[ . 1 . 2]" 1
1500 1 69 LEU HA 1 70 ILE HB . . 5.500 5.586 5.577 5.593 0.093 19 0 "[ . 1 . 2]" 1
1501 1 69 LEU HA 1 70 ILE HG12 . . 5.500 4.103 4.001 4.216 . 0 0 "[ . 1 . 2]" 1
1502 1 69 LEU HA 1 70 ILE MG . . 4.480 3.541 3.437 3.638 . 0 0 "[ . 1 . 2]" 1
1503 1 69 LEU HB2 1 70 ILE H . . 5.020 4.341 4.132 4.495 . 0 0 "[ . 1 . 2]" 1
1504 1 69 LEU HB3 1 70 ILE H . . 5.010 3.662 3.407 4.021 . 0 0 "[ . 1 . 2]" 1
1505 1 69 LEU MD2 1 70 ILE H . . 3.930 3.778 3.613 4.006 0.076 17 0 "[ . 1 . 2]" 1
1506 1 69 LEU HG 1 70 ILE H . . 5.500 5.178 4.852 5.338 . 0 0 "[ . 1 . 2]" 1
1507 1 70 ILE H 1 70 ILE MD . . 5.020 3.955 3.834 4.067 . 0 0 "[ . 1 . 2]" 1
1508 1 70 ILE H 1 70 ILE HG12 . . 4.300 2.357 2.241 2.494 . 0 0 "[ . 1 . 2]" 1
1509 1 70 ILE H 1 70 ILE MG . . 3.980 2.572 2.347 2.715 . 0 0 "[ . 1 . 2]" 1
1510 1 70 ILE HA 1 70 ILE MD . . 4.190 4.199 4.138 4.234 0.044 5 0 "[ . 1 . 2]" 1
1511 1 70 ILE HA 1 70 ILE HG12 . . 4.070 3.881 3.840 3.945 . 0 0 "[ . 1 . 2]" 1
1512 1 70 ILE HA 1 70 ILE MG . . 3.260 2.377 2.339 2.443 . 0 0 "[ . 1 . 2]" 1
1513 1 70 ILE HA 1 71 THR H . . 3.170 2.550 2.448 2.628 . 0 0 "[ . 1 . 2]" 1
1514 1 70 ILE HA 1 71 THR HA . . 4.790 4.405 4.350 4.481 . 0 0 "[ . 1 . 2]" 1
1515 1 70 ILE HA 1 71 THR MG . . 4.160 3.806 3.526 4.242 0.082 5 0 "[ . 1 . 2]" 1
1516 1 70 ILE HA 1 74 GLU HB2 . . 4.530 4.001 3.914 4.161 . 0 0 "[ . 1 . 2]" 1
1517 1 70 ILE HA 1 74 GLU HB3 . . 4.850 4.678 4.448 4.839 . 0 0 "[ . 1 . 2]" 1
1518 1 70 ILE HA 1 74 GLU QG . . 5.500 4.337 3.546 4.941 . 0 0 "[ . 1 . 2]" 1
1519 1 70 ILE HB 1 71 THR H . . 3.950 2.437 2.297 2.592 . 0 0 "[ . 1 . 2]" 1
1520 1 70 ILE HB 1 71 THR HA . . 5.500 4.903 4.816 4.995 . 0 0 "[ . 1 . 2]" 1
1521 1 70 ILE HB 1 74 GLU H . . 4.820 4.448 4.091 4.639 . 0 0 "[ . 1 . 2]" 1
1522 1 70 ILE HB 1 74 GLU HA . . 4.790 4.858 4.777 4.876 0.086 16 0 "[ . 1 . 2]" 1
1523 1 70 ILE HB 1 74 GLU HB2 . . 4.300 2.230 2.069 2.393 . 0 0 "[ . 1 . 2]" 1
1524 1 70 ILE HB 1 74 GLU HB3 . . 4.540 2.523 2.337 2.703 . 0 0 "[ . 1 . 2]" 1
1525 1 70 ILE HB 1 75 PHE H . . 4.920 4.458 4.249 4.718 . 0 0 "[ . 1 . 2]" 1
1526 1 70 ILE MD 1 70 ILE MG . . 3.310 2.120 2.082 2.142 . 0 0 "[ . 1 . 2]" 1
1527 1 70 ILE MD 1 71 THR H . . 5.010 3.951 3.761 4.131 . 0 0 "[ . 1 . 2]" 1
1528 1 70 ILE MD 1 72 TYR HA . . 5.500 4.892 4.556 5.179 . 0 0 "[ . 1 . 2]" 1
1529 1 70 ILE MD 1 74 GLU H . . 5.500 4.098 3.720 4.317 . 0 0 "[ . 1 . 2]" 1
1530 1 70 ILE MD 1 74 GLU HA . . 4.480 3.955 3.848 4.088 . 0 0 "[ . 1 . 2]" 1
1531 1 70 ILE MD 1 74 GLU HB2 . . 4.690 2.590 2.161 2.943 . 0 0 "[ . 1 . 2]" 1
1532 1 70 ILE MD 1 74 GLU HB3 . . 4.710 2.283 2.182 2.488 . 0 0 "[ . 1 . 2]" 1
1533 1 70 ILE MD 1 75 PHE H . . 4.260 2.797 2.598 3.042 . 0 0 "[ . 1 . 2]" 1
1534 1 70 ILE MD 1 75 PHE HA . . 3.550 2.437 2.247 2.620 . 0 0 "[ . 1 . 2]" 1
1535 1 70 ILE MD 1 75 PHE HB2 . . 4.100 2.412 2.232 2.633 . 0 0 "[ . 1 . 2]" 1
1536 1 70 ILE MD 1 75 PHE HB3 . . 4.560 3.594 3.382 3.784 . 0 0 "[ . 1 . 2]" 1
1537 1 70 ILE MD 1 75 PHE QD . . 3.930 3.780 3.525 4.013 0.083 4 0 "[ . 1 . 2]" 1
1538 1 70 ILE MD 1 76 ILE H . . 5.500 4.751 4.577 4.892 . 0 0 "[ . 1 . 2]" 1
1539 1 70 ILE MD 1 78 LEU QD . . 4.440 2.310 1.940 2.597 . 0 0 "[ . 1 . 2]" 1
1540 1 70 ILE HG12 1 75 PHE H . . 5.460 4.946 4.618 5.331 . 0 0 "[ . 1 . 2]" 1
1541 1 70 ILE HG12 1 75 PHE HB2 . . 5.500 4.155 3.933 4.350 . 0 0 "[ . 1 . 2]" 1
1542 1 70 ILE HG12 1 75 PHE HB3 . . 5.500 5.443 5.159 5.577 0.077 19 0 "[ . 1 . 2]" 1
1543 1 70 ILE HG13 1 71 THR H . . 4.590 3.217 3.086 3.373 . 0 0 "[ . 1 . 2]" 1
1544 1 70 ILE HG13 1 71 THR HA . . 5.500 4.159 3.822 4.291 . 0 0 "[ . 1 . 2]" 1
1545 1 70 ILE HG13 1 71 THR HB . . 5.500 5.572 5.558 5.581 0.081 3 0 "[ . 1 . 2]" 1
1546 1 70 ILE HG13 1 72 TYR HA . . 5.500 4.573 4.338 4.743 . 0 0 "[ . 1 . 2]" 1
1547 1 70 ILE HG13 1 74 GLU H . . 4.440 4.474 4.267 4.520 0.080 15 0 "[ . 1 . 2]" 1
1548 1 70 ILE HG13 1 74 GLU HB2 . . 4.410 3.039 2.781 3.307 . 0 0 "[ . 1 . 2]" 1
1549 1 70 ILE HG13 1 74 GLU HB3 . . 4.110 3.879 3.712 4.174 0.064 16 0 "[ . 1 . 2]" 1
1550 1 70 ILE HG13 1 75 PHE H . . 5.070 3.449 3.074 3.909 . 0 0 "[ . 1 . 2]" 1
1551 1 70 ILE HG13 1 75 PHE HA . . 4.470 4.408 4.137 4.553 0.083 10 0 "[ . 1 . 2]" 1
1552 1 70 ILE HG13 1 75 PHE HB2 . . 5.500 3.425 3.233 3.623 . 0 0 "[ . 1 . 2]" 1
1553 1 70 ILE HG13 1 75 PHE HB3 . . 5.210 4.255 3.948 4.539 . 0 0 "[ . 1 . 2]" 1
1554 1 70 ILE MG 1 71 THR H . . 4.220 3.889 3.739 3.989 . 0 0 "[ . 1 . 2]" 1
1555 1 71 THR H 1 71 THR MG . . 3.410 2.623 2.247 3.379 . 0 0 "[ . 1 . 2]" 1
1556 1 71 THR H 1 72 TYR H . . 5.500 4.580 4.496 4.656 . 0 0 "[ . 1 . 2]" 1
1557 1 71 THR H 1 74 GLU HA . . 5.180 5.116 4.964 5.253 0.073 18 0 "[ . 1 . 2]" 1
1558 1 71 THR H 1 74 GLU HB2 . . 4.180 2.306 2.093 2.569 . 0 0 "[ . 1 . 2]" 1
1559 1 71 THR H 1 74 GLU HB3 . . 4.420 3.755 3.490 4.015 . 0 0 "[ . 1 . 2]" 1
1560 1 71 THR H 1 74 GLU QG . . 4.650 2.816 2.030 3.290 . 0 0 "[ . 1 . 2]" 1
1561 1 71 THR HA 1 71 THR HB . . 2.660 2.519 2.401 2.709 0.049 5 0 "[ . 1 . 2]" 1
1562 1 71 THR HA 1 71 THR MG . . 3.080 2.279 2.120 2.409 . 0 0 "[ . 1 . 2]" 1
1563 1 71 THR HA 1 72 TYR H . . 3.350 2.467 2.305 2.538 . 0 0 "[ . 1 . 2]" 1
1564 1 71 THR HA 1 72 TYR HA . . 5.380 4.462 4.217 4.556 . 0 0 "[ . 1 . 2]" 1
1565 1 71 THR HA 1 72 TYR QD . . 4.950 4.765 4.157 5.040 0.090 9 0 "[ . 1 . 2]" 1
1566 1 71 THR HA 1 73 SER H . . 4.600 4.380 4.088 4.657 0.057 10 0 "[ . 1 . 2]" 1
1567 1 71 THR HA 1 74 GLU H . . 5.500 4.678 4.526 4.904 . 0 0 "[ . 1 . 2]" 1
1568 1 71 THR HA 1 74 GLU QG . . 5.500 5.177 4.570 5.574 0.074 10 0 "[ . 1 . 2]" 1
1569 1 71 THR HB 1 72 TYR H . . 3.450 2.409 2.149 2.664 . 0 0 "[ . 1 . 2]" 1
1570 1 71 THR HB 1 72 TYR HA . . 5.310 4.725 4.571 4.956 . 0 0 "[ . 1 . 2]" 1
1571 1 71 THR HB 1 72 TYR HB2 . . 4.100 3.909 3.773 4.123 0.023 11 0 "[ . 1 . 2]" 1
1572 1 71 THR HB 1 72 TYR HB3 . . 5.210 5.195 4.789 5.286 0.076 5 0 "[ . 1 . 2]" 1
1573 1 71 THR HB 1 73 SER H . . 3.930 2.645 2.328 2.933 . 0 0 "[ . 1 . 2]" 1
1574 1 71 THR HB 1 73 SER QB . . 4.780 4.259 3.616 4.686 . 0 0 "[ . 1 . 2]" 1
1575 1 71 THR HB 1 74 GLU H . . 5.020 3.636 3.378 4.043 . 0 0 "[ . 1 . 2]" 1
1576 1 71 THR HB 1 74 GLU QG . . 5.500 4.485 4.160 4.877 . 0 0 "[ . 1 . 2]" 1
1577 1 71 THR MG 1 72 TYR H . . 4.010 3.574 3.032 3.845 . 0 0 "[ . 1 . 2]" 1
1578 1 71 THR MG 1 73 SER H . . 4.680 4.208 3.916 4.558 . 0 0 "[ . 1 . 2]" 1
1579 1 71 THR MG 1 74 GLU H . . 5.480 4.329 3.948 5.192 . 0 0 "[ . 1 . 2]" 1
1580 1 71 THR MG 1 74 GLU HB2 . . 5.500 4.339 3.690 5.227 . 0 0 "[ . 1 . 2]" 1
1581 1 71 THR MG 1 74 GLU QG . . 5.490 3.707 2.960 4.993 . 0 0 "[ . 1 . 2]" 1
1582 1 72 TYR H 1 72 TYR HB2 . . 4.060 2.310 2.075 2.498 . 0 0 "[ . 1 . 2]" 1
1583 1 72 TYR H 1 73 SER QB . . 5.500 5.076 4.820 5.262 . 0 0 "[ . 1 . 2]" 1
1584 1 72 TYR HA 1 72 TYR QD . . 3.270 2.536 2.094 3.126 . 0 0 "[ . 1 . 2]" 1
1585 1 72 TYR HA 1 72 TYR QE . . 4.650 4.523 4.351 4.740 0.090 3 0 "[ . 1 . 2]" 1
1586 1 72 TYR HA 1 74 GLU H . . 5.390 4.489 4.077 4.724 . 0 0 "[ . 1 . 2]" 1
1587 1 72 TYR HA 1 75 PHE H . . 3.920 3.508 3.357 3.817 . 0 0 "[ . 1 . 2]" 1
1588 1 72 TYR HA 1 75 PHE HB2 . . 3.720 3.748 3.563 3.806 0.086 19 0 "[ . 1 . 2]" 1
1589 1 72 TYR HA 1 75 PHE HB3 . . 3.690 2.684 2.408 3.334 . 0 0 "[ . 1 . 2]" 1
1590 1 72 TYR HA 1 75 PHE QD . . 4.270 3.207 2.787 4.068 . 0 0 "[ . 1 . 2]" 1
1591 1 72 TYR HA 1 76 ILE H . . 4.680 4.455 4.147 4.761 0.081 19 0 "[ . 1 . 2]" 1
1592 1 72 TYR HA 1 76 ILE MD . . 5.500 4.690 4.503 4.964 . 0 0 "[ . 1 . 2]" 1
1593 1 72 TYR HB2 1 73 SER H . . 4.270 2.930 2.559 3.428 . 0 0 "[ . 1 . 2]" 1
1594 1 72 TYR HB3 1 73 SER H . . 4.790 3.505 3.044 3.820 . 0 0 "[ . 1 . 2]" 1
1595 1 73 SER H 1 73 SER QB . . 3.330 2.580 2.411 2.774 . 0 0 "[ . 1 . 2]" 1
1596 1 73 SER HA 1 75 PHE H . . 5.500 4.111 3.902 4.378 . 0 0 "[ . 1 . 2]" 1
1597 1 73 SER HA 1 76 ILE H . . 4.660 3.088 2.859 3.337 . 0 0 "[ . 1 . 2]" 1
1598 1 73 SER HA 1 76 ILE HB . . 3.100 2.864 2.668 3.114 0.014 5 0 "[ . 1 . 2]" 1
1599 1 73 SER HA 1 76 ILE MD . . 4.790 4.180 3.945 4.365 . 0 0 "[ . 1 . 2]" 1
1600 1 73 SER HA 1 76 ILE QG . . 5.500 2.456 2.195 2.657 . 0 0 "[ . 1 . 2]" 1
1601 1 73 SER HA 1 76 ILE MG . . 4.990 4.241 4.076 4.475 . 0 0 "[ . 1 . 2]" 1
1602 1 73 SER HA 1 77 ASP H . . 4.820 4.432 4.163 4.803 . 0 0 "[ . 1 . 2]" 1
1603 1 73 SER QB 1 74 GLU H . . 3.960 3.248 2.700 3.609 . 0 0 "[ . 1 . 2]" 1
1604 1 73 SER QB 1 74 GLU QG . . 5.010 4.201 3.324 4.751 . 0 0 "[ . 1 . 2]" 1
1605 1 73 SER QB 1 76 ILE HB . . 4.170 4.020 3.820 4.110 . 0 0 "[ . 1 . 2]" 1
1606 1 73 SER QB 1 76 ILE QG . . 4.790 4.001 3.780 4.275 . 0 0 "[ . 1 . 2]" 1
1607 1 74 GLU H 1 74 GLU HB2 . . 3.620 2.302 2.173 2.455 . 0 0 "[ . 1 . 2]" 1
1608 1 74 GLU H 1 74 GLU HB3 . . 4.100 3.558 3.459 3.663 . 0 0 "[ . 1 . 2]" 1
1609 1 74 GLU H 1 74 GLU QG . . 3.720 2.711 2.435 3.040 . 0 0 "[ . 1 . 2]" 1
1610 1 74 GLU H 1 75 PHE HB2 . . 5.500 5.251 5.016 5.450 . 0 0 "[ . 1 . 2]" 1
1611 1 74 GLU H 1 75 PHE HB3 . . 5.480 4.532 4.237 4.875 . 0 0 "[ . 1 . 2]" 1
1612 1 74 GLU H 1 76 ILE H . . 5.500 4.201 3.872 4.418 . 0 0 "[ . 1 . 2]" 1
1613 1 74 GLU H 1 77 ASP HB3 . . 5.500 5.462 4.863 5.589 0.089 3 0 "[ . 1 . 2]" 1
1614 1 74 GLU HA 1 74 GLU QG . . 3.340 2.282 2.120 2.505 . 0 0 "[ . 1 . 2]" 1
1615 1 74 GLU HA 1 77 ASP H . . 3.860 3.469 3.277 3.673 . 0 0 "[ . 1 . 2]" 1
1616 1 74 GLU HA 1 77 ASP HB2 . . 3.840 3.748 3.370 3.920 0.080 1 0 "[ . 1 . 2]" 1
1617 1 74 GLU HA 1 77 ASP HB3 . . 3.810 2.885 2.403 3.087 . 0 0 "[ . 1 . 2]" 1
1618 1 74 GLU HB2 1 75 PHE H . . 4.790 2.919 2.646 3.310 . 0 0 "[ . 1 . 2]" 1
1619 1 74 GLU HB3 1 75 PHE H . . 4.790 3.646 3.450 3.839 . 0 0 "[ . 1 . 2]" 1
1620 1 74 GLU HB3 1 78 LEU QD . . 5.500 3.807 2.881 4.341 . 0 0 "[ . 1 . 2]" 1
1621 1 74 GLU QG 1 75 PHE H . . 4.960 4.360 4.086 4.552 . 0 0 "[ . 1 . 2]" 1
1622 1 74 GLU QG 1 77 ASP H . . 5.500 5.395 5.148 5.576 0.076 4 0 "[ . 1 . 2]" 1
1623 1 75 PHE H 1 75 PHE HB2 . . 3.620 2.774 2.594 2.973 . 0 0 "[ . 1 . 2]" 1
1624 1 75 PHE H 1 75 PHE HB3 . . 3.550 2.234 2.111 2.474 . 0 0 "[ . 1 . 2]" 1
1625 1 75 PHE H 1 78 LEU QD . . 5.500 4.387 3.790 4.623 . 0 0 "[ . 1 . 2]" 1
1626 1 75 PHE HA 1 75 PHE QD . . 3.570 2.532 2.268 2.696 . 0 0 "[ . 1 . 2]" 1
1627 1 75 PHE HA 1 75 PHE QE . . 5.000 4.827 4.596 4.969 . 0 0 "[ . 1 . 2]" 1
1628 1 75 PHE HA 1 78 LEU H . . 4.520 3.436 3.192 3.649 . 0 0 "[ . 1 . 2]" 1
1629 1 75 PHE HA 1 78 LEU HB2 . . 4.390 3.128 2.036 3.477 . 0 0 "[ . 1 . 2]" 1
1630 1 75 PHE HA 1 78 LEU HB3 . . 4.680 4.604 3.533 4.765 0.085 2 0 "[ . 1 . 2]" 1
1631 1 75 PHE HA 1 78 LEU QD . . 3.760 2.330 2.026 2.728 . 0 0 "[ . 1 . 2]" 1
1632 1 75 PHE HA 1 78 LEU HG . . 4.350 3.156 2.301 4.443 0.093 17 0 "[ . 1 . 2]" 1
1633 1 75 PHE HB2 1 76 ILE H . . 4.450 4.075 3.769 4.298 . 0 0 "[ . 1 . 2]" 1
1634 1 75 PHE HB2 1 78 LEU QD . . 5.350 3.840 3.466 4.182 . 0 0 "[ . 1 . 2]" 1
1635 1 75 PHE HB3 1 76 ILE H . . 4.100 2.785 2.355 3.108 . 0 0 "[ . 1 . 2]" 1
1636 1 75 PHE HB3 1 76 ILE MD . . 5.500 3.707 3.337 4.043 . 0 0 "[ . 1 . 2]" 1
1637 1 75 PHE HB3 1 76 ILE QG . . 5.500 3.874 3.265 4.157 . 0 0 "[ . 1 . 2]" 1
1638 1 75 PHE QD 1 76 ILE HA . . 5.010 4.251 4.058 4.391 . 0 0 "[ . 1 . 2]" 1
1639 1 75 PHE QD 1 76 ILE MD . . 4.020 2.981 2.279 3.230 . 0 0 "[ . 1 . 2]" 1
1640 1 75 PHE QD 1 76 ILE QG . . 4.060 3.978 3.817 4.029 . 0 0 "[ . 1 . 2]" 1
1641 1 75 PHE QD 1 78 LEU QD . . 4.760 3.082 2.386 3.747 . 0 0 "[ . 1 . 2]" 1
1642 1 75 PHE QD 1 79 LEU QD . . 4.850 2.966 2.449 3.273 . 0 0 "[ . 1 . 2]" 1
1643 1 75 PHE QE 1 76 ILE HA . . 5.110 5.066 4.663 5.192 0.082 18 0 "[ . 1 . 2]" 1
1644 1 75 PHE QE 1 76 ILE MD . . 3.810 3.568 3.033 3.811 0.001 20 0 "[ . 1 . 2]" 1
1645 1 75 PHE QE 1 79 LEU QD . . 4.020 2.279 2.103 2.527 . 0 0 "[ . 1 . 2]" 1
1646 1 75 PHE HZ 1 76 ILE MD . . 4.830 4.721 4.190 4.907 0.077 19 0 "[ . 1 . 2]" 1
1647 1 75 PHE HZ 1 79 LEU QD . . 3.880 2.979 2.429 3.391 . 0 0 "[ . 1 . 2]" 1
1648 1 75 PHE HZ 1 79 LEU HG . . 5.500 4.875 4.284 5.369 . 0 0 "[ . 1 . 2]" 1
1649 1 76 ILE H 1 76 ILE HB . . 3.350 2.586 2.510 2.705 . 0 0 "[ . 1 . 2]" 1
1650 1 76 ILE H 1 76 ILE MD . . 4.050 2.884 2.585 3.042 . 0 0 "[ . 1 . 2]" 1
1651 1 76 ILE H 1 76 ILE QG . . 3.940 2.198 1.961 2.334 . 0 0 "[ . 1 . 2]" 1
1652 1 76 ILE H 1 76 ILE MG . . 4.010 3.814 3.789 3.850 . 0 0 "[ . 1 . 2]" 1
1653 1 76 ILE H 1 77 ASP HB2 . . 5.500 5.409 4.909 5.567 0.067 1 0 "[ . 1 . 2]" 1
1654 1 76 ILE HA 1 76 ILE MD . . 3.430 2.158 2.050 2.207 . 0 0 "[ . 1 . 2]" 1
1655 1 76 ILE HA 1 76 ILE MG . . 3.310 2.445 2.382 2.488 . 0 0 "[ . 1 . 2]" 1
1656 1 76 ILE HA 1 78 LEU H . . 5.180 3.960 3.634 4.377 . 0 0 "[ . 1 . 2]" 1
1657 1 76 ILE HA 1 79 LEU H . . 4.080 3.406 3.166 3.587 . 0 0 "[ . 1 . 2]" 1
1658 1 76 ILE HA 1 79 LEU HA . . 5.430 5.462 5.321 5.519 0.089 1 0 "[ . 1 . 2]" 1
1659 1 76 ILE HA 1 79 LEU HB2 . . 4.240 3.103 2.813 3.268 . 0 0 "[ . 1 . 2]" 1
1660 1 76 ILE HA 1 79 LEU HB3 . . 4.820 4.629 4.388 4.784 . 0 0 "[ . 1 . 2]" 1
1661 1 76 ILE HA 1 79 LEU QD . . 3.810 2.383 1.895 2.961 . 0 0 "[ . 1 . 2]" 1
1662 1 76 ILE HA 1 79 LEU HG . . 3.630 3.043 2.316 3.710 0.080 8 0 "[ . 1 . 2]" 1
1663 1 76 ILE HA 1 80 GLU H . . 5.500 4.348 3.642 5.320 . 0 0 "[ . 1 . 2]" 1
1664 1 76 ILE HB 1 77 ASP H . . 3.640 2.847 2.694 3.199 . 0 0 "[ . 1 . 2]" 1
1665 1 76 ILE HB 1 77 ASP HB3 . . 5.490 4.983 4.521 5.208 . 0 0 "[ . 1 . 2]" 1
1666 1 76 ILE HB 1 78 LEU H . . 5.500 5.066 4.959 5.216 . 0 0 "[ . 1 . 2]" 1
1667 1 76 ILE MD 1 76 ILE MG . . 3.130 2.239 2.189 2.318 . 0 0 "[ . 1 . 2]" 1
1668 1 76 ILE MD 1 77 ASP H . . 5.500 4.684 4.574 4.767 . 0 0 "[ . 1 . 2]" 1
1669 1 76 ILE MD 1 79 LEU H . . 5.260 4.946 4.596 5.276 0.016 19 0 "[ . 1 . 2]" 1
1670 1 76 ILE MG 1 77 ASP H . . 3.960 3.589 3.416 3.756 . 0 0 "[ . 1 . 2]" 1
1671 1 76 ILE MG 1 77 ASP HB2 . . 4.790 4.750 4.486 4.896 0.106 14 0 "[ . 1 . 2]" 1
1672 1 76 ILE MG 1 77 ASP HB3 . . 5.430 5.268 5.069 5.450 0.020 20 0 "[ . 1 . 2]" 1
1673 1 76 ILE MG 1 78 LEU H . . 5.400 4.851 4.664 5.166 . 0 0 "[ . 1 . 2]" 1
1674 1 76 ILE MG 1 79 LEU HB2 . . 4.420 3.396 2.990 3.577 . 0 0 "[ . 1 . 2]" 1
1675 1 76 ILE MG 1 79 LEU QD . . 3.540 3.307 2.420 3.574 0.034 1 0 "[ . 1 . 2]" 1
1676 1 76 ILE MG 1 80 GLU H . . 5.460 3.723 3.129 4.698 . 0 0 "[ . 1 . 2]" 1
1677 1 76 ILE MG 1 80 GLU HA . . 4.520 4.380 3.476 4.629 0.109 14 0 "[ . 1 . 2]" 1
1678 1 76 ILE MG 1 80 GLU QB . . 4.870 4.800 4.559 4.988 0.118 17 0 "[ . 1 . 2]" 1
1679 1 76 ILE MG 1 80 GLU QG . . 3.980 3.177 2.848 3.535 . 0 0 "[ . 1 . 2]" 1
1680 1 77 ASP H 1 77 ASP HB2 . . 3.300 2.655 2.325 2.971 . 0 0 "[ . 1 . 2]" 1
1681 1 77 ASP H 1 77 ASP HB3 . . 3.390 2.285 2.013 2.514 . 0 0 "[ . 1 . 2]" 1
1682 1 77 ASP H 1 78 LEU H . . 5.100 2.694 2.452 2.831 . 0 0 "[ . 1 . 2]" 1
1683 1 77 ASP H 1 78 LEU HA . . 5.410 5.269 5.070 5.419 0.009 14 0 "[ . 1 . 2]" 1
1684 1 77 ASP H 1 78 LEU HB2 . . 5.080 4.992 4.348 5.154 0.074 3 0 "[ . 1 . 2]" 1
1685 1 77 ASP H 1 78 LEU QD . . 5.500 4.477 3.171 4.833 . 0 0 "[ . 1 . 2]" 1
1686 1 77 ASP HA 1 80 GLU H . . 4.830 4.265 3.380 4.871 0.041 17 0 "[ . 1 . 2]" 1
1687 1 77 ASP HA 1 80 GLU QG . . 3.190 2.190 2.000 2.458 . 0 0 "[ . 1 . 2]" 1
1688 1 77 ASP HB2 1 78 LEU HA . . 5.500 5.583 5.571 5.597 0.097 5 0 "[ . 1 . 2]" 1
1689 1 77 ASP HB2 1 80 GLU QG . . 4.500 4.088 3.819 4.287 . 0 0 "[ . 1 . 2]" 1
1690 1 77 ASP HB3 1 78 LEU H . . 3.900 2.982 2.580 3.552 . 0 0 "[ . 1 . 2]" 1
1691 1 77 ASP HB3 1 78 LEU HA . . 5.210 4.592 4.318 5.223 0.013 5 0 "[ . 1 . 2]" 1
1692 1 77 ASP HB3 1 78 LEU HB2 . . 5.500 5.202 4.603 5.568 0.068 15 0 "[ . 1 . 2]" 1
1693 1 77 ASP HB3 1 78 LEU QD . . 5.500 3.638 2.619 4.460 . 0 0 "[ . 1 . 2]" 1
1694 1 77 ASP HB3 1 78 LEU HG . . 5.500 3.766 3.039 5.588 0.088 2 0 "[ . 1 . 2]" 1
1695 1 78 LEU H 1 78 LEU HB2 . . 3.400 2.506 2.180 2.810 . 0 0 "[ . 1 . 2]" 1
1696 1 78 LEU H 1 78 LEU HB3 . . 3.670 3.616 3.433 3.690 0.020 15 0 "[ . 1 . 2]" 1
1697 1 78 LEU H 1 78 LEU QD . . 4.250 3.002 2.135 3.319 . 0 0 "[ . 1 . 2]" 1
1698 1 78 LEU H 1 78 LEU HG . . 3.650 2.526 2.165 3.738 0.088 17 0 "[ . 1 . 2]" 1
1699 1 78 LEU HA 1 78 LEU QD . . 3.100 2.205 2.047 2.486 . 0 0 "[ . 1 . 2]" 1
1700 1 78 LEU HA 1 78 LEU HG . . 4.020 3.116 2.511 3.693 . 0 0 "[ . 1 . 2]" 1
1701 1 78 LEU HA 1 79 LEU HA . . 4.760 4.770 4.603 4.836 0.076 1 0 "[ . 1 . 2]" 1
1702 1 78 LEU HB2 1 79 LEU H . . 5.250 3.329 2.943 3.704 . 0 0 "[ . 1 . 2]" 1
1703 1 79 LEU H 1 79 LEU HB2 . . 3.590 2.541 2.332 2.772 . 0 0 "[ . 1 . 2]" 1
1704 1 79 LEU H 1 79 LEU HB3 . . 3.770 3.657 3.516 3.799 0.029 12 0 "[ . 1 . 2]" 1
1705 1 79 LEU H 1 79 LEU QD . . 4.320 2.838 1.844 3.451 . 0 0 "[ . 1 . 2]" 1
1706 1 79 LEU H 1 79 LEU HG . . 3.720 3.000 2.251 3.816 0.096 2 0 "[ . 1 . 2]" 1
1707 1 79 LEU H 1 80 GLU H . . 3.950 2.774 2.099 3.291 . 0 0 "[ . 1 . 2]" 1
1708 1 79 LEU HA 1 79 LEU QD . . 3.500 2.142 2.009 2.282 . 0 0 "[ . 1 . 2]" 1
1709 1 79 LEU HA 1 80 GLU QG . . 5.070 4.965 4.903 5.012 . 0 0 "[ . 1 . 2]" 1
1710 1 79 LEU HA 1 81 GLY H . . 5.500 4.662 3.877 5.300 . 0 0 "[ . 1 . 2]" 1
1711 1 79 LEU HA 1 82 GLU H . . 3.960 3.507 3.047 4.041 0.081 17 0 "[ . 1 . 2]" 1
1712 1 79 LEU HA 1 82 GLU QB . . 4.730 2.717 2.231 4.241 . 0 0 "[ . 1 . 2]" 1
1713 1 79 LEU HA 1 82 GLU QG . . 4.380 4.123 2.160 4.462 0.082 3 0 "[ . 1 . 2]" 1
1714 1 79 LEU HA 1 86 ILE MD . . 3.960 4.069 4.038 4.086 0.126 2 0 "[ . 1 . 2]" 1
1715 1 79 LEU HB2 1 80 GLU H . . 4.530 2.118 1.819 3.666 . 0 0 "[ . 1 . 2]" 1
1716 1 79 LEU HB2 1 80 GLU QG . . 5.500 3.725 3.416 4.249 . 0 0 "[ . 1 . 2]" 1
1717 1 79 LEU HB2 1 82 GLU H . . 4.740 4.705 4.404 4.826 0.086 3 0 "[ . 1 . 2]" 1
1718 1 79 LEU HB3 1 80 GLU H . . 4.270 3.029 2.417 4.327 0.057 2 0 "[ . 1 . 2]" 1
1719 1 79 LEU HB3 1 82 GLU H . . 4.280 3.568 3.083 4.049 . 0 0 "[ . 1 . 2]" 1
1720 1 79 LEU QD 1 80 GLU H . . 4.680 3.685 3.418 4.256 . 0 0 "[ . 1 . 2]" 1
1721 1 79 LEU QD 1 82 GLU H . . 4.840 4.186 3.750 4.641 . 0 0 "[ . 1 . 2]" 1
1722 1 79 LEU QD 1 82 GLU QB . . 5.500 3.520 2.488 4.214 . 0 0 "[ . 1 . 2]" 1
1723 1 79 LEU QD 1 85 PHE QB . . 5.020 4.585 4.252 4.853 . 0 0 "[ . 1 . 2]" 1
1724 1 79 LEU QD 1 85 PHE QD . . 4.420 3.265 2.495 3.636 . 0 0 "[ . 1 . 2]" 1
1725 1 79 LEU QD 1 86 ILE MD . . 3.510 1.882 1.786 1.986 . 0 0 "[ . 1 . 2]" 1
1726 1 79 LEU QD 1 86 ILE HG12 . . 4.470 4.062 3.177 4.218 . 0 0 "[ . 1 . 2]" 1
1727 1 80 GLU H 1 80 GLU QB . . 3.500 3.052 2.500 3.281 . 0 0 "[ . 1 . 2]" 1
1728 1 80 GLU H 1 80 GLU QG . . 4.400 2.268 1.933 2.574 . 0 0 "[ . 1 . 2]" 1
1729 1 80 GLU HA 1 80 GLU QG . . 3.580 2.783 2.335 3.101 . 0 0 "[ . 1 . 2]" 1
1730 1 80 GLU HA 1 81 GLY H . . 3.360 2.616 2.140 3.442 0.082 5 0 "[ . 1 . 2]" 1
1731 1 80 GLU QB 1 81 GLY H . . 4.330 3.602 1.978 3.992 . 0 0 "[ . 1 . 2]" 1
1732 1 80 GLU QB 1 81 GLY QA . . 4.250 4.110 3.523 4.341 0.091 1 0 "[ . 1 . 2]" 1
1733 1 80 GLU QG 1 81 GLY H . . 5.460 4.630 3.913 4.905 . 0 0 "[ . 1 . 2]" 1
1734 1 81 GLY QA 1 82 GLU QG . . 5.140 3.948 3.194 5.254 0.114 4 0 "[ . 1 . 2]" 1
1735 1 82 GLU H 1 82 GLU QB . . 3.730 2.604 2.394 3.109 . 0 0 "[ . 1 . 2]" 1
1736 1 82 GLU H 1 82 GLU QG . . 4.030 3.316 2.475 4.106 0.076 4 0 "[ . 1 . 2]" 1
1737 1 82 GLU H 1 83 GLU HA . . 5.500 4.458 3.460 4.936 . 0 0 "[ . 1 . 2]" 1
1738 1 82 GLU H 1 83 GLU QB . . 5.040 4.425 3.216 4.926 . 0 0 "[ . 1 . 2]" 1
1739 1 82 GLU H 1 83 GLU QG . . 4.030 3.986 3.480 4.141 0.111 12 0 "[ . 1 . 2]" 1
1740 1 82 GLU HA 1 82 GLU QG . . 3.700 2.729 2.122 3.442 . 0 0 "[ . 1 . 2]" 1
1741 1 82 GLU HA 1 83 GLU H . . 3.580 2.387 2.111 2.738 . 0 0 "[ . 1 . 2]" 1
1742 1 82 GLU HA 1 83 GLU QB . . 5.180 4.415 3.597 4.974 . 0 0 "[ . 1 . 2]" 1
1743 1 82 GLU HA 1 84 LYS QE . . 4.390 3.013 2.246 4.456 0.066 13 0 "[ . 1 . 2]" 1
1744 1 82 GLU QB 1 83 GLU H . . 4.450 3.494 2.508 4.068 . 0 0 "[ . 1 . 2]" 1
1745 1 82 GLU QB 1 84 LYS H . . 4.710 3.723 3.050 4.603 . 0 0 "[ . 1 . 2]" 1
1746 1 82 GLU QB 1 85 PHE QD . . 5.100 3.979 2.946 4.977 . 0 0 "[ . 1 . 2]" 1
1747 1 82 GLU QB 1 86 ILE MD . . 5.190 4.234 2.651 4.922 . 0 0 "[ . 1 . 2]" 1
1748 1 83 GLU H 1 83 GLU QG . . 4.490 2.973 1.715 4.190 . 0 0 "[ . 1 . 2]" 1
1749 1 83 GLU H 1 84 LYS QG . . 5.500 4.227 2.820 5.229 . 0 0 "[ . 1 . 2]" 1
1750 1 83 GLU HA 1 83 GLU QG . . 3.220 2.579 2.075 3.316 0.096 10 0 "[ . 1 . 2]" 1
1751 1 83 GLU HA 1 84 LYS H . . 3.410 2.470 2.138 2.763 . 0 0 "[ . 1 . 2]" 1
1752 1 83 GLU HA 1 84 LYS QB . . 4.580 4.649 4.564 4.685 0.105 1 0 "[ . 1 . 2]" 1
1753 1 83 GLU HA 1 85 PHE QD . . 4.800 4.725 4.045 4.914 0.114 3 0 "[ . 1 . 2]" 1
1754 1 83 GLU HA 1 86 ILE MD . . 4.160 1.969 1.841 2.174 . 0 0 "[ . 1 . 2]" 1
1755 1 83 GLU QB 1 84 LYS H . . 4.420 3.984 3.855 4.077 . 0 0 "[ . 1 . 2]" 1
1756 1 83 GLU QG 1 84 LYS H . . 4.740 4.253 3.976 4.635 . 0 0 "[ . 1 . 2]" 1
1757 1 83 GLU QG 1 84 LYS QG . . 5.500 5.276 3.668 5.621 0.121 3 0 "[ . 1 . 2]" 1
1758 1 83 GLU QG 1 86 ILE MD . . 4.420 3.172 2.139 4.437 0.017 6 0 "[ . 1 . 2]" 1
1759 1 84 LYS H 1 84 LYS QB . . 3.540 2.862 2.318 3.388 . 0 0 "[ . 1 . 2]" 1
1760 1 84 LYS H 1 84 LYS QG . . 4.030 3.062 2.214 4.112 0.082 14 0 "[ . 1 . 2]" 1
1761 1 84 LYS H 1 85 PHE HA . . 5.500 4.873 4.629 5.075 . 0 0 "[ . 1 . 2]" 1
1762 1 84 LYS H 1 85 PHE QB . . 5.500 4.440 3.968 4.793 . 0 0 "[ . 1 . 2]" 1
1763 1 84 LYS H 1 86 ILE MD . . 5.500 2.414 1.710 3.260 . 0 0 "[ . 1 . 2]" 1
1764 1 84 LYS HA 1 84 LYS QE . . 4.410 3.741 2.610 4.378 . 0 0 "[ . 1 . 2]" 1
1765 1 84 LYS HA 1 84 LYS QG . . 3.710 2.840 2.053 3.512 . 0 0 "[ . 1 . 2]" 1
1766 1 84 LYS HA 1 85 PHE H . . 3.030 2.928 2.797 3.059 0.029 17 0 "[ . 1 . 2]" 1
1767 1 84 LYS HA 1 85 PHE HA . . 4.330 4.345 4.087 4.408 0.078 7 0 "[ . 1 . 2]" 1
1768 1 84 LYS HA 1 85 PHE QB . . 4.800 4.803 4.713 4.878 0.078 12 0 "[ . 1 . 2]" 1
1769 1 84 LYS QB 1 84 LYS QE . . 4.550 2.371 1.968 3.523 . 0 0 "[ . 1 . 2]" 1
1770 1 84 LYS QB 1 85 PHE H . . 4.170 3.979 3.779 4.167 . 0 0 "[ . 1 . 2]" 1
1771 1 84 LYS QB 1 85 PHE HA . . 5.290 4.842 4.644 5.136 . 0 0 "[ . 1 . 2]" 1
1772 1 84 LYS QB 1 86 ILE MD . . 5.030 4.440 4.077 4.840 . 0 0 "[ . 1 . 2]" 1
1773 1 84 LYS QE 1 84 LYS QG . . 3.160 2.227 2.021 2.441 . 0 0 "[ . 1 . 2]" 1
1774 1 84 LYS QE 1 86 ILE MD . . 4.170 4.254 3.746 4.310 0.140 3 0 "[ . 1 . 2]" 1
1775 1 84 LYS QG 1 85 PHE H . . 4.540 4.258 3.609 4.640 0.100 16 0 "[ . 1 . 2]" 1
1776 1 85 PHE H 1 85 PHE QB . . 3.580 3.400 3.200 3.552 . 0 0 "[ . 1 . 2]" 1
1777 1 85 PHE H 1 86 ILE H . . 2.670 2.401 2.149 2.744 0.074 12 0 "[ . 1 . 2]" 1
1778 1 85 PHE H 1 86 ILE HA . . 5.160 4.016 3.800 4.226 . 0 0 "[ . 1 . 2]" 1
1779 1 85 PHE H 1 86 ILE MD . . 5.500 1.962 1.707 2.165 . 0 0 "[ . 1 . 2]" 1
1780 1 85 PHE H 1 86 ILE HG12 . . 5.500 2.610 1.771 4.473 . 0 0 "[ . 1 . 2]" 1
1781 1 85 PHE H 1 86 ILE HG13 . . 5.500 3.895 3.223 4.582 . 0 0 "[ . 1 . 2]" 1
1782 1 85 PHE H 1 86 ILE MG . . 5.500 4.428 4.149 5.014 . 0 0 "[ . 1 . 2]" 1
1783 1 85 PHE HA 1 85 PHE QD . . 3.770 3.781 3.723 3.835 0.065 14 0 "[ . 1 . 2]" 1
1784 1 85 PHE HA 1 86 ILE H . . 3.220 2.609 2.233 2.895 . 0 0 "[ . 1 . 2]" 1
1785 1 85 PHE HA 1 86 ILE HA . . 5.010 4.548 4.486 4.609 . 0 0 "[ . 1 . 2]" 1
1786 1 85 PHE HA 1 86 ILE MD . . 4.900 4.043 3.944 4.270 . 0 0 "[ . 1 . 2]" 1
1787 1 85 PHE HA 1 86 ILE MG . . 5.500 5.604 5.529 5.624 0.124 14 0 "[ . 1 . 2]" 1
1788 1 85 PHE QB 1 86 ILE H . . 4.140 4.013 3.777 4.102 . 0 0 "[ . 1 . 2]" 1
1789 1 85 PHE QB 1 86 ILE MD . . 4.470 4.094 3.690 4.541 0.071 8 0 "[ . 1 . 2]" 1
1790 1 85 PHE QD 1 86 ILE HA . . 5.060 4.152 3.571 4.562 . 0 0 "[ . 1 . 2]" 1
1791 1 85 PHE QD 1 86 ILE MD . . 4.050 3.226 2.072 4.131 0.081 8 0 "[ . 1 . 2]" 1
1792 1 86 ILE H 1 86 ILE HB . . 3.480 2.868 2.139 3.050 . 0 0 "[ . 1 . 2]" 1
1793 1 86 ILE H 1 86 ILE MD . . 4.870 2.852 2.436 3.424 . 0 0 "[ . 1 . 2]" 1
1794 1 86 ILE H 1 86 ILE HG12 . . 4.160 2.185 1.819 3.867 . 0 0 "[ . 1 . 2]" 1
1795 1 86 ILE H 1 86 ILE HG13 . . 4.350 3.630 3.357 4.000 . 0 0 "[ . 1 . 2]" 1
1796 1 86 ILE HA 1 86 ILE MD . . 3.880 2.526 2.273 2.894 . 0 0 "[ . 1 . 2]" 1
1797 1 86 ILE HA 1 86 ILE HG12 . . 3.950 3.599 3.498 3.785 . 0 0 "[ . 1 . 2]" 1
1798 1 86 ILE HA 1 86 ILE HG13 . . 3.840 3.911 2.656 4.032 0.192 2 0 "[ . 1 . 2]" 1
1799 1 86 ILE HA 1 86 ILE MG . . 3.340 2.174 2.090 2.611 . 0 0 "[ . 1 . 2]" 1
1800 1 86 ILE HA 1 87 GLY H . . 2.750 2.745 2.606 2.816 0.066 18 0 "[ . 1 . 2]" 1
1801 1 86 ILE HB 1 86 ILE MD . . 3.550 3.277 2.652 3.365 . 0 0 "[ . 1 . 2]" 1
1802 1 86 ILE HB 1 87 GLY H . . 4.520 2.872 2.494 3.907 . 0 0 "[ . 1 . 2]" 1
1803 1 86 ILE MD 1 86 ILE MG . . 3.040 2.209 2.075 3.201 0.161 16 0 "[ . 1 . 2]" 1
1804 1 86 ILE MD 1 87 GLY H . . 5.130 4.466 4.323 4.766 . 0 0 "[ . 1 . 2]" 1
1805 1 86 ILE HG12 1 86 ILE MG . . 3.690 3.134 2.099 3.216 . 0 0 "[ . 1 . 2]" 1
1806 1 86 ILE HG12 1 87 GLY H . . 5.500 4.938 4.690 5.156 . 0 0 "[ . 1 . 2]" 1
1807 1 86 ILE HG13 1 86 ILE MG . . 3.640 2.258 2.164 2.331 . 0 0 "[ . 1 . 2]" 1
1808 1 86 ILE HG13 1 87 GLY H . . 5.120 4.778 4.106 4.961 . 0 0 "[ . 1 . 2]" 1
1809 1 86 ILE MG 1 87 GLY H . . 3.910 1.812 1.614 2.135 . 0 0 "[ . 1 . 2]" 1
1810 1 86 ILE MG 1 87 GLY HA2 . . 5.130 3.608 2.417 4.037 . 0 0 "[ . 1 . 2]" 1
1811 1 86 ILE MG 1 87 GLY HA3 . . 4.420 4.285 3.688 4.466 0.046 2 0 "[ . 1 . 2]" 1
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