NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
652852 |
6yhz   |
50219 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6yhz
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 1402
_Distance_constraint_stats_list.Viol_count 1000
_Distance_constraint_stats_list.Viol_total 581.796
_Distance_constraint_stats_list.Viol_max 0.406
_Distance_constraint_stats_list.Viol_rms 0.0214
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0041
_Distance_constraint_stats_list.Viol_average_violations_only 0.0582
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 ARG 1.370 0.194 9 0 "[ . 1]"
1 2 ASN 0.448 0.170 5 0 "[ . 1]"
1 3 LEU 3.598 0.218 4 0 "[ . 1]"
1 4 ALA 0.094 0.047 10 0 "[ . 1]"
1 5 GLU 0.221 0.112 6 0 "[ . 1]"
1 6 LEU 2.967 0.218 4 0 "[ . 1]"
1 7 HIS 0.340 0.194 1 0 "[ . 1]"
1 8 ILE 1.721 0.120 1 0 "[ . 1]"
1 9 GLY 0.889 0.113 1 0 "[ . 1]"
1 10 GLN 0.896 0.132 7 0 "[ . 1]"
1 11 PRO 0.642 0.132 7 0 "[ . 1]"
1 12 VAL 0.477 0.072 8 0 "[ . 1]"
1 13 VAL 4.094 0.205 3 0 "[ . 1]"
1 14 HIS 4.363 0.270 8 0 "[ . 1]"
1 15 LEU 1.858 0.077 8 0 "[ . 1]"
1 16 GLU 0.862 0.077 1 0 "[ . 1]"
1 17 HIS 1.749 0.196 10 0 "[ . 1]"
1 18 GLY 0.876 0.142 4 0 "[ . 1]"
1 19 VAL 1.122 0.194 8 0 "[ . 1]"
1 20 GLY 1.099 0.095 8 0 "[ . 1]"
1 21 ARG 1.617 0.136 3 0 "[ . 1]"
1 22 TYR 3.851 0.137 7 0 "[ . 1]"
1 23 ALA 3.289 0.398 4 0 "[ . 1]"
1 24 GLY 1.057 0.360 10 0 "[ . 1]"
1 25 MET 2.589 0.343 3 0 "[ . 1]"
1 26 THR 2.313 0.343 3 0 "[ . 1]"
1 27 THR 1.376 0.130 3 0 "[ . 1]"
1 28 LEU 0.572 0.074 7 0 "[ . 1]"
1 29 GLU 0.242 0.069 6 0 "[ . 1]"
1 30 ALA 1.870 0.158 10 0 "[ . 1]"
1 31 GLY 0.097 0.043 7 0 "[ . 1]"
1 32 GLY 0.000 0.000 . 0 "[ . 1]"
1 33 ILE 0.846 0.093 4 0 "[ . 1]"
1 34 THR 1.334 0.158 10 0 "[ . 1]"
1 35 GLY 0.691 0.091 9 0 "[ . 1]"
1 36 GLU 1.303 0.132 10 0 "[ . 1]"
1 37 TYR 4.327 0.244 8 0 "[ . 1]"
1 38 LEU 6.491 0.291 9 0 "[ . 1]"
1 39 MET 2.436 0.360 10 0 "[ . 1]"
1 40 LEU 6.980 0.406 10 0 "[ . 1]"
1 41 THR 1.409 0.167 3 0 "[ . 1]"
1 42 TYR 1.240 0.153 8 0 "[ . 1]"
1 43 ALA 0.921 0.100 7 0 "[ . 1]"
1 44 ASN 0.335 0.088 7 0 "[ . 1]"
1 45 ASP 0.613 0.054 10 0 "[ . 1]"
1 46 ALA 0.497 0.063 10 0 "[ . 1]"
1 47 LYS 0.650 0.117 3 0 "[ . 1]"
1 48 LEU 3.411 0.406 10 0 "[ . 1]"
1 49 TYR 1.759 0.208 10 0 "[ . 1]"
1 50 VAL 3.179 0.291 9 0 "[ . 1]"
1 51 PRO 1.107 0.099 3 0 "[ . 1]"
1 52 VAL 0.704 0.090 3 0 "[ . 1]"
1 53 SER 0.228 0.036 8 0 "[ . 1]"
1 54 SER 0.203 0.068 3 0 "[ . 1]"
1 55 LEU 2.215 0.194 9 0 "[ . 1]"
1 56 HIS 0.112 0.077 4 0 "[ . 1]"
1 57 LEU 1.318 0.077 4 0 "[ . 1]"
1 58 ILE 4.493 0.196 10 0 "[ . 1]"
1 59 SER 4.594 0.331 5 0 "[ . 1]"
1 60 ARG 2.829 0.331 5 0 "[ . 1]"
1 61 TYR 2.311 0.174 9 0 "[ . 1]"
1 62 ALA 0.000 0.000 . 0 "[ . 1]"
1 63 GLY 0.000 0.000 . 0 "[ . 1]"
1 66 GLU 0.138 0.062 9 0 "[ . 1]"
1 67 GLU 0.064 0.057 3 0 "[ . 1]"
1 68 ASN 0.000 0.000 . 0 "[ . 1]"
1 69 ALA 0.000 0.000 . 0 "[ . 1]"
1 70 PRO 1.004 0.120 2 0 "[ . 1]"
1 71 LEU 0.841 0.153 8 0 "[ . 1]"
1 72 HIS 0.490 0.104 8 0 "[ . 1]"
1 73 LYS 0.210 0.082 9 0 "[ . 1]"
1 74 LEU 1.168 0.117 3 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 ARG HA 1 1 ARG QG . . 3.700 2.982 2.393 3.346 . 0 0 "[ . 1]" 1
2 1 1 ARG QB 1 1 ARG QD . . 3.310 2.336 2.143 2.781 . 0 0 "[ . 1]" 1
3 1 1 ARG QB 1 3 LEU QD . . 4.790 2.889 2.014 3.957 . 0 0 "[ . 1]" 1
4 1 1 ARG QB 1 59 SER HB2 . . 5.500 5.099 3.618 5.624 0.124 10 0 "[ . 1]" 1
5 1 1 ARG QB 1 59 SER HB3 . . 5.500 4.725 4.013 5.546 0.046 7 0 "[ . 1]" 1
6 1 1 ARG QD 1 3 LEU MD1 . . 4.860 3.634 1.857 4.482 . 0 0 "[ . 1]" 1
7 1 1 ARG QD 1 3 LEU QD . . 4.040 2.250 1.836 2.951 . 0 0 "[ . 1]" 1
8 1 1 ARG QD 1 3 LEU MD2 . . 4.860 2.448 1.872 3.000 . 0 0 "[ . 1]" 1
9 1 1 ARG QD 1 55 LEU MD2 . . 5.500 5.601 5.516 5.694 0.194 9 0 "[ . 1]" 1
10 1 1 ARG QG 1 3 LEU QD . . 3.530 2.684 1.815 3.575 0.045 8 0 "[ . 1]" 1
11 1 1 ARG QG 1 59 SER HA . . 4.680 3.418 2.038 4.611 . 0 0 "[ . 1]" 1
12 1 2 ASN HA 1 3 LEU MD1 . . 5.500 5.102 4.248 5.670 0.170 5 0 "[ . 1]" 1
13 1 2 ASN HA 1 3 LEU QD . . 4.510 3.445 2.894 4.149 . 0 0 "[ . 1]" 1
14 1 2 ASN HA 1 3 LEU MD2 . . 5.500 3.522 2.945 4.419 . 0 0 "[ . 1]" 1
15 1 2 ASN QB 1 3 LEU HB2 . . 5.340 4.948 4.553 5.478 0.138 2 0 "[ . 1]" 1
16 1 3 LEU HA 1 3 LEU MD1 . . 3.720 2.319 1.890 3.713 . 0 0 "[ . 1]" 1
17 1 3 LEU HA 1 3 LEU QD . . 2.820 1.939 1.870 2.010 . 0 0 "[ . 1]" 1
18 1 3 LEU HA 1 3 LEU MD2 . . 3.720 2.785 1.931 3.407 . 0 0 "[ . 1]" 1
19 1 3 LEU HA 1 3 LEU HG . . 3.870 3.583 3.210 3.776 . 0 0 "[ . 1]" 1
20 1 3 LEU HA 1 6 LEU HB2 . . 4.510 4.471 4.178 4.631 0.121 9 0 "[ . 1]" 1
21 1 3 LEU HA 1 6 LEU MD1 . . 4.160 2.860 2.096 3.298 . 0 0 "[ . 1]" 1
22 1 3 LEU HA 1 6 LEU MD2 . . 4.090 3.167 2.483 3.739 . 0 0 "[ . 1]" 1
23 1 3 LEU HA 1 6 LEU HG . . 4.600 2.246 1.922 2.546 . 0 0 "[ . 1]" 1
24 1 3 LEU HA 1 38 LEU QD . . 5.440 5.213 4.475 5.567 0.127 9 0 "[ . 1]" 1
25 1 3 LEU HB2 1 3 LEU QD . . 3.010 2.282 2.166 2.450 . 0 0 "[ . 1]" 1
26 1 3 LEU HB3 1 4 ALA H . . 4.740 3.069 1.629 4.370 . 0 0 "[ . 1]" 1
27 1 3 LEU HB3 1 58 ILE HG13 . . 5.350 5.324 5.035 5.493 0.143 10 0 "[ . 1]" 1
28 1 3 LEU QD 1 6 LEU MD1 . . 2.930 1.781 1.674 1.969 . 0 0 "[ . 1]" 1
29 1 3 LEU QD 1 6 LEU MD2 . . 3.670 1.943 1.819 2.199 . 0 0 "[ . 1]" 1
30 1 3 LEU QD 1 6 LEU HG . . 3.920 2.530 2.161 3.105 . 0 0 "[ . 1]" 1
31 1 3 LEU QD 1 55 LEU HA . . 3.130 2.925 2.241 3.226 0.096 1 0 "[ . 1]" 1
32 1 3 LEU QD 1 55 LEU HB3 . . 3.850 2.254 1.826 3.002 . 0 0 "[ . 1]" 1
33 1 3 LEU QD 1 55 LEU MD2 . . 3.940 2.312 1.741 2.912 . 0 0 "[ . 1]" 1
34 1 3 LEU QD 1 58 ILE H . . 4.680 3.325 2.957 3.612 . 0 0 "[ . 1]" 1
35 1 3 LEU QD 1 58 ILE HB . . 3.230 1.954 1.689 2.358 . 0 0 "[ . 1]" 1
36 1 3 LEU QD 1 58 ILE HG12 . . 4.850 3.559 2.896 4.070 . 0 0 "[ . 1]" 1
37 1 3 LEU QD 1 58 ILE HG13 . . 3.650 3.012 1.939 3.764 0.114 7 0 "[ . 1]" 1
38 1 3 LEU QD 1 59 SER HA . . 4.650 3.214 2.691 3.690 . 0 0 "[ . 1]" 1
39 1 3 LEU QD 1 60 ARG QD . . 4.930 4.482 3.586 4.959 0.029 1 0 "[ . 1]" 1
40 1 3 LEU MD1 1 6 LEU MD1 . . 3.480 1.818 1.688 1.977 . 0 0 "[ . 1]" 1
41 1 3 LEU MD1 1 6 LEU MD2 . . 4.580 2.227 1.820 3.532 . 0 0 "[ . 1]" 1
42 1 3 LEU MD1 1 6 LEU HG . . 4.750 2.851 2.166 3.742 . 0 0 "[ . 1]" 1
43 1 3 LEU MD1 1 58 ILE HB . . 3.770 2.503 1.821 3.250 . 0 0 "[ . 1]" 1
44 1 3 LEU MD1 1 58 ILE HG13 . . 4.500 3.489 1.943 4.534 0.034 6 0 "[ . 1]" 1
45 1 3 LEU MD1 1 59 SER HA . . 5.500 4.149 2.802 5.527 0.027 9 0 "[ . 1]" 1
46 1 3 LEU MD2 1 6 LEU MD1 . . 3.480 3.302 1.892 3.698 0.218 4 0 "[ . 1]" 1
47 1 3 LEU MD2 1 6 LEU MD2 . . 4.580 3.578 1.952 4.414 . 0 0 "[ . 1]" 1
48 1 3 LEU MD2 1 6 LEU HG . . 4.750 4.046 2.181 4.808 0.058 7 0 "[ . 1]" 1
49 1 3 LEU MD2 1 58 ILE HB . . 3.770 2.151 1.940 2.480 . 0 0 "[ . 1]" 1
50 1 3 LEU MD2 1 58 ILE HG13 . . 4.500 3.886 3.486 4.272 . 0 0 "[ . 1]" 1
51 1 3 LEU MD2 1 59 SER HA . . 5.500 3.516 2.881 3.955 . 0 0 "[ . 1]" 1
52 1 3 LEU HG 1 6 LEU MD2 . . 5.010 4.289 3.790 4.900 . 0 0 "[ . 1]" 1
53 1 3 LEU HG 1 58 ILE H . . 5.320 4.394 3.728 5.092 . 0 0 "[ . 1]" 1
54 1 3 LEU HG 1 58 ILE HA . . 5.500 5.413 5.221 5.540 0.040 8 0 "[ . 1]" 1
55 1 3 LEU HG 1 58 ILE HG13 . . 4.330 3.595 3.386 3.999 . 0 0 "[ . 1]" 1
56 1 3 LEU HG 1 58 ILE MG . . 3.950 3.201 2.461 3.991 0.041 8 0 "[ . 1]" 1
57 1 4 ALA H 1 55 LEU MD1 . . 5.280 3.856 2.559 5.181 . 0 0 "[ . 1]" 1
58 1 4 ALA HA 1 55 LEU MD1 . . 4.880 4.051 3.097 4.752 . 0 0 "[ . 1]" 1
59 1 4 ALA MB 1 5 GLU H . . 4.360 2.547 2.078 3.056 . 0 0 "[ . 1]" 1
60 1 4 ALA MB 1 5 GLU QG . . 3.620 2.899 2.632 3.200 . 0 0 "[ . 1]" 1
61 1 4 ALA MB 1 6 LEU H . . 4.620 4.208 4.010 4.451 . 0 0 "[ . 1]" 1
62 1 4 ALA MB 1 55 LEU MD1 . . 4.390 3.626 2.535 4.437 0.047 10 0 "[ . 1]" 1
63 1 5 GLU H 1 5 GLU QG . . 4.400 2.497 2.218 3.060 . 0 0 "[ . 1]" 1
64 1 5 GLU H 1 6 LEU H . . 3.880 2.877 2.571 3.091 . 0 0 "[ . 1]" 1
65 1 5 GLU H 1 6 LEU HG . . 5.040 4.016 3.837 4.200 . 0 0 "[ . 1]" 1
66 1 5 GLU QB 1 6 LEU H . . 4.010 3.767 3.709 3.797 . 0 0 "[ . 1]" 1
67 1 5 GLU HB2 1 6 LEU H . . 4.660 4.080 3.985 4.117 . 0 0 "[ . 1]" 1
68 1 5 GLU HB3 1 6 LEU H . . 4.660 4.426 4.353 4.471 . 0 0 "[ . 1]" 1
69 1 5 GLU QG 1 6 LEU H . . 4.600 4.545 4.389 4.712 0.112 6 0 "[ . 1]" 1
70 1 6 LEU H 1 6 LEU HB2 . . 2.960 2.247 2.176 2.348 . 0 0 "[ . 1]" 1
71 1 6 LEU H 1 6 LEU HB3 . . 3.550 3.519 3.480 3.561 0.011 2 0 "[ . 1]" 1
72 1 6 LEU H 1 6 LEU MD1 . . 3.940 3.534 3.068 3.810 . 0 0 "[ . 1]" 1
73 1 6 LEU H 1 6 LEU MD2 . . 4.290 3.877 3.597 4.044 . 0 0 "[ . 1]" 1
74 1 6 LEU H 1 6 LEU HG . . 3.430 2.804 2.515 3.020 . 0 0 "[ . 1]" 1
75 1 6 LEU H 1 7 HIS H . . 4.720 4.543 4.364 4.606 . 0 0 "[ . 1]" 1
76 1 6 LEU HA 1 6 LEU MD1 . . 3.960 3.818 3.793 3.864 . 0 0 "[ . 1]" 1
77 1 6 LEU HA 1 6 LEU MD2 . . 2.900 2.096 1.892 2.456 . 0 0 "[ . 1]" 1
78 1 6 LEU HA 1 7 HIS H . . 2.630 2.190 2.090 2.292 . 0 0 "[ . 1]" 1
79 1 6 LEU HB2 1 6 LEU MD1 . . 3.450 2.239 2.095 2.311 . 0 0 "[ . 1]" 1
80 1 6 LEU HB2 1 7 HIS H . . 4.570 4.151 3.888 4.469 . 0 0 "[ . 1]" 1
81 1 6 LEU HB3 1 6 LEU MD1 . . 3.180 2.488 2.390 2.700 . 0 0 "[ . 1]" 1
82 1 6 LEU HB3 1 6 LEU MD2 . . 2.810 2.272 2.158 2.347 . 0 0 "[ . 1]" 1
83 1 6 LEU HB3 1 7 HIS H . . 3.650 3.037 2.663 3.640 . 0 0 "[ . 1]" 1
84 1 6 LEU HB3 1 8 ILE MD . . 5.050 4.818 4.386 5.072 0.022 6 0 "[ . 1]" 1
85 1 6 LEU HB3 1 22 TYR QD . . 4.640 3.153 2.888 3.597 . 0 0 "[ . 1]" 1
86 1 6 LEU HB3 1 22 TYR QE . . 4.910 3.032 2.614 3.462 . 0 0 "[ . 1]" 1
87 1 6 LEU MD1 1 7 HIS H . . 5.340 4.825 4.404 5.140 . 0 0 "[ . 1]" 1
88 1 6 LEU MD1 1 12 VAL HB . . 5.110 4.710 4.400 4.980 . 0 0 "[ . 1]" 1
89 1 6 LEU MD1 1 12 VAL MG1 . . 4.210 3.186 2.883 3.476 . 0 0 "[ . 1]" 1
90 1 6 LEU MD1 1 12 VAL QG . . 3.230 3.007 2.738 3.245 0.015 2 0 "[ . 1]" 1
91 1 6 LEU MD1 1 12 VAL MG2 . . 4.210 3.705 3.413 3.997 . 0 0 "[ . 1]" 1
92 1 6 LEU MD1 1 22 TYR HB2 . . 4.330 3.851 3.597 4.249 . 0 0 "[ . 1]" 1
93 1 6 LEU MD1 1 22 TYR QD . . 3.980 2.860 2.622 3.169 . 0 0 "[ . 1]" 1
94 1 6 LEU MD1 1 38 LEU QD . . 3.510 2.480 2.266 2.803 . 0 0 "[ . 1]" 1
95 1 6 LEU MD1 1 38 LEU HG . . 5.500 4.081 3.623 5.345 . 0 0 "[ . 1]" 1
96 1 6 LEU MD1 1 40 LEU QD . . 4.580 4.214 3.845 4.557 . 0 0 "[ . 1]" 1
97 1 6 LEU MD1 1 58 ILE MD . . 5.270 5.020 4.747 5.311 0.041 8 0 "[ . 1]" 1
98 1 6 LEU MD1 1 58 ILE MG . . 3.830 3.373 3.096 3.760 . 0 0 "[ . 1]" 1
99 1 6 LEU MD2 1 7 HIS H . . 3.550 3.059 2.777 3.310 . 0 0 "[ . 1]" 1
100 1 6 LEU MD2 1 10 GLN QB . . 4.380 3.245 2.596 3.895 . 0 0 "[ . 1]" 1
101 1 6 LEU MD2 1 12 VAL HA . . 4.970 4.815 4.672 5.004 0.034 5 0 "[ . 1]" 1
102 1 6 LEU MD2 1 12 VAL HB . . 4.770 3.858 3.513 4.040 . 0 0 "[ . 1]" 1
103 1 6 LEU MD2 1 12 VAL MG1 . . 3.850 1.939 1.853 2.056 . 0 0 "[ . 1]" 1
104 1 6 LEU MD2 1 12 VAL QG . . 2.760 1.928 1.845 2.039 . 0 0 "[ . 1]" 1
105 1 6 LEU MD2 1 12 VAL MG2 . . 3.850 3.384 3.193 3.504 . 0 0 "[ . 1]" 1
106 1 6 LEU MD2 1 22 TYR HA . . 5.500 5.256 4.710 5.471 . 0 0 "[ . 1]" 1
107 1 6 LEU MD2 1 22 TYR HB2 . . 4.320 3.262 2.707 3.514 . 0 0 "[ . 1]" 1
108 1 6 LEU MD2 1 22 TYR QD . . 4.240 3.503 3.125 3.655 . 0 0 "[ . 1]" 1
109 1 6 LEU MD2 1 22 TYR QE . . 4.110 4.085 3.919 4.216 0.106 7 0 "[ . 1]" 1
110 1 6 LEU MD2 1 38 LEU MD1 . . 5.500 4.245 3.830 5.526 0.026 9 0 "[ . 1]" 1
111 1 6 LEU MD2 1 38 LEU QD . . 4.260 3.954 3.763 4.339 0.079 9 0 "[ . 1]" 1
112 1 6 LEU MD2 1 38 LEU MD2 . . 5.500 5.344 4.519 5.608 0.108 8 0 "[ . 1]" 1
113 1 6 LEU MD2 1 58 ILE MG . . 3.970 3.624 3.401 3.780 . 0 0 "[ . 1]" 1
114 1 6 LEU MD2 1 60 ARG HA . . 5.500 4.266 3.647 4.707 . 0 0 "[ . 1]" 1
115 1 6 LEU MD2 1 60 ARG QD . . 4.280 3.644 3.038 4.308 0.028 8 0 "[ . 1]" 1
116 1 6 LEU MD2 1 60 ARG QG . . 5.070 3.509 2.993 4.191 . 0 0 "[ . 1]" 1
117 1 6 LEU HG 1 7 HIS H . . 4.840 4.663 4.493 4.900 0.060 2 0 "[ . 1]" 1
118 1 6 LEU HG 1 38 LEU QD . . 5.440 4.834 4.584 5.094 . 0 0 "[ . 1]" 1
119 1 7 HIS H 1 7 HIS QB . . 3.060 2.423 2.225 2.534 . 0 0 "[ . 1]" 1
120 1 7 HIS H 1 7 HIS HD2 . . 4.490 3.698 2.739 4.684 0.194 1 0 "[ . 1]" 1
121 1 7 HIS H 1 8 ILE H . . 5.290 4.520 4.444 4.587 . 0 0 "[ . 1]" 1
122 1 7 HIS H 1 10 GLN QB . . 4.140 2.947 2.641 3.368 . 0 0 "[ . 1]" 1
123 1 7 HIS H 1 10 GLN QG . . 4.620 3.234 2.531 4.148 . 0 0 "[ . 1]" 1
124 1 7 HIS H 1 22 TYR QD . . 5.160 4.159 3.700 4.525 . 0 0 "[ . 1]" 1
125 1 7 HIS HA 1 8 ILE H . . 3.570 2.323 2.249 2.413 . 0 0 "[ . 1]" 1
126 1 7 HIS QB 1 8 ILE H . . 4.050 2.698 2.405 3.661 . 0 0 "[ . 1]" 1
127 1 7 HIS QB 1 10 GLN QB . . 4.310 2.686 1.838 3.493 . 0 0 "[ . 1]" 1
128 1 8 ILE H 1 8 ILE HB . . 3.770 2.588 2.529 2.620 . 0 0 "[ . 1]" 1
129 1 8 ILE H 1 8 ILE MD . . 4.850 3.089 2.950 3.330 . 0 0 "[ . 1]" 1
130 1 8 ILE H 1 8 ILE HG12 . . 4.060 2.108 2.024 2.281 . 0 0 "[ . 1]" 1
131 1 8 ILE H 1 8 ILE QG . . 3.540 2.094 2.013 2.261 . 0 0 "[ . 1]" 1
132 1 8 ILE H 1 8 ILE HG13 . . 4.060 3.617 3.563 3.716 . 0 0 "[ . 1]" 1
133 1 8 ILE H 1 8 ILE MG . . 4.230 3.776 3.768 3.784 . 0 0 "[ . 1]" 1
134 1 8 ILE H 1 10 GLN H . . 5.500 4.831 4.639 5.103 . 0 0 "[ . 1]" 1
135 1 8 ILE HA 1 8 ILE MD . . 3.270 2.093 2.063 2.119 . 0 0 "[ . 1]" 1
136 1 8 ILE HA 1 8 ILE QG . . 3.650 3.018 2.956 3.065 . 0 0 "[ . 1]" 1
137 1 8 ILE HA 1 8 ILE MG . . 3.090 2.365 2.325 2.402 . 0 0 "[ . 1]" 1
138 1 8 ILE HA 1 9 GLY H . . 2.680 2.159 2.140 2.187 . 0 0 "[ . 1]" 1
139 1 8 ILE HA 1 9 GLY HA2 . . 4.790 4.400 4.384 4.422 . 0 0 "[ . 1]" 1
140 1 8 ILE HA 1 9 GLY HA3 . . 4.590 4.409 4.394 4.440 . 0 0 "[ . 1]" 1
141 1 8 ILE HA 1 10 GLN H . . 3.840 3.420 3.323 3.537 . 0 0 "[ . 1]" 1
142 1 8 ILE HA 1 10 GLN QB . . 5.260 4.404 4.114 4.763 . 0 0 "[ . 1]" 1
143 1 8 ILE HA 1 22 TYR HB2 . . 5.500 5.520 5.432 5.601 0.101 6 0 "[ . 1]" 1
144 1 8 ILE HA 1 22 TYR HB3 . . 4.480 3.874 3.748 3.993 . 0 0 "[ . 1]" 1
145 1 8 ILE HA 1 22 TYR QD . . 3.390 2.509 2.316 2.734 . 0 0 "[ . 1]" 1
146 1 8 ILE HA 1 22 TYR QE . . 4.080 3.855 3.376 4.022 . 0 0 "[ . 1]" 1
147 1 8 ILE HB 1 8 ILE MD . . 3.300 3.240 3.236 3.245 . 0 0 "[ . 1]" 1
148 1 8 ILE HB 1 9 GLY H . . 4.260 4.100 4.019 4.198 . 0 0 "[ . 1]" 1
149 1 8 ILE MD 1 8 ILE MG . . 2.580 1.997 1.969 2.034 . 0 0 "[ . 1]" 1
150 1 8 ILE MD 1 9 GLY H . . 3.910 3.760 3.677 3.817 . 0 0 "[ . 1]" 1
151 1 8 ILE MD 1 22 TYR QD . . 3.740 2.899 2.729 3.091 . 0 0 "[ . 1]" 1
152 1 8 ILE MD 1 22 TYR QE . . 3.670 2.576 2.129 2.792 . 0 0 "[ . 1]" 1
153 1 8 ILE MD 1 23 ALA MB . . 5.060 4.073 3.796 4.481 . 0 0 "[ . 1]" 1
154 1 8 ILE MD 1 24 GLY HA2 . . 3.580 2.210 1.999 2.347 . 0 0 "[ . 1]" 1
155 1 8 ILE MD 1 24 GLY HA3 . . 3.590 2.967 2.902 3.057 . 0 0 "[ . 1]" 1
156 1 8 ILE MD 1 25 MET H . . 4.390 4.417 4.287 4.510 0.120 1 0 "[ . 1]" 1
157 1 8 ILE QG 1 8 ILE MG . . 2.880 2.304 2.282 2.334 . 0 0 "[ . 1]" 1
158 1 8 ILE QG 1 9 GLY H . . 5.340 4.692 4.650 4.726 . 0 0 "[ . 1]" 1
159 1 8 ILE QG 1 22 TYR QD . . 5.150 4.594 4.453 4.744 . 0 0 "[ . 1]" 1
160 1 8 ILE QG 1 22 TYR QE . . 4.720 4.424 4.109 4.674 . 0 0 "[ . 1]" 1
161 1 8 ILE QG 1 24 GLY HA2 . . 5.280 4.184 3.958 4.327 . 0 0 "[ . 1]" 1
162 1 8 ILE HG12 1 8 ILE MG . . 3.380 3.207 3.204 3.213 . 0 0 "[ . 1]" 1
163 1 8 ILE HG13 1 8 ILE MG . . 3.380 2.362 2.336 2.397 . 0 0 "[ . 1]" 1
164 1 8 ILE MG 1 9 GLY H . . 3.120 2.594 2.488 2.709 . 0 0 "[ . 1]" 1
165 1 8 ILE MG 1 9 GLY HA2 . . 3.870 3.562 3.476 3.652 . 0 0 "[ . 1]" 1
166 1 8 ILE MG 1 9 GLY HA3 . . 3.200 3.287 3.269 3.313 0.113 1 0 "[ . 1]" 1
167 1 8 ILE MG 1 10 GLN H . . 4.900 4.405 4.358 4.449 . 0 0 "[ . 1]" 1
168 1 8 ILE MG 1 22 TYR HB3 . . 5.170 5.112 5.007 5.188 0.018 4 0 "[ . 1]" 1
169 1 8 ILE MG 1 22 TYR QD . . 5.080 4.187 3.897 4.480 . 0 0 "[ . 1]" 1
170 1 8 ILE MG 1 22 TYR QE . . 5.500 4.914 4.415 5.154 . 0 0 "[ . 1]" 1
171 1 8 ILE MG 1 23 ALA H . . 5.500 5.065 4.861 5.287 . 0 0 "[ . 1]" 1
172 1 8 ILE MG 1 23 ALA MB . . 4.320 3.463 3.271 3.710 . 0 0 "[ . 1]" 1
173 1 9 GLY H 1 10 GLN H . . 2.960 2.378 2.335 2.444 . 0 0 "[ . 1]" 1
174 1 9 GLY H 1 22 TYR H . . 5.500 4.230 4.026 4.525 . 0 0 "[ . 1]" 1
175 1 9 GLY H 1 22 TYR HB2 . . 5.420 4.970 4.780 5.161 . 0 0 "[ . 1]" 1
176 1 9 GLY H 1 22 TYR HB3 . . 3.870 3.337 3.142 3.529 . 0 0 "[ . 1]" 1
177 1 9 GLY H 1 22 TYR QD . . 3.630 3.380 3.191 3.553 . 0 0 "[ . 1]" 1
178 1 9 GLY H 1 22 TYR QE . . 5.470 5.355 5.007 5.474 0.004 7 0 "[ . 1]" 1
179 1 9 GLY H 1 23 ALA H . . 5.100 4.815 4.686 5.114 0.014 6 0 "[ . 1]" 1
180 1 9 GLY HA2 1 10 GLN H . . 3.550 3.103 2.908 3.216 . 0 0 "[ . 1]" 1
181 1 9 GLY HA2 1 21 ARG HB3 . . 4.300 3.109 2.420 3.746 . 0 0 "[ . 1]" 1
182 1 10 GLN H 1 10 GLN HB2 . . 3.570 2.515 2.180 2.981 . 0 0 "[ . 1]" 1
183 1 10 GLN H 1 10 GLN HB3 . . 3.570 2.894 2.424 3.627 0.057 2 0 "[ . 1]" 1
184 1 10 GLN H 1 10 GLN HG2 . . 4.780 4.024 2.775 4.664 . 0 0 "[ . 1]" 1
185 1 10 GLN H 1 10 GLN QG . . 4.150 3.644 2.732 4.045 . 0 0 "[ . 1]" 1
186 1 10 GLN H 1 10 GLN HG3 . . 4.780 4.345 3.957 4.592 . 0 0 "[ . 1]" 1
187 1 10 GLN H 1 11 PRO HD2 . . 5.160 4.896 4.819 4.980 . 0 0 "[ . 1]" 1
188 1 10 GLN H 1 11 PRO QD . . 4.490 4.332 4.268 4.382 . 0 0 "[ . 1]" 1
189 1 10 GLN H 1 11 PRO HD3 . . 5.160 4.833 4.695 4.925 . 0 0 "[ . 1]" 1
190 1 10 GLN H 1 12 VAL QG . . 5.280 4.463 4.248 4.605 . 0 0 "[ . 1]" 1
191 1 10 GLN H 1 21 ARG HB3 . . 5.500 4.932 4.629 5.352 . 0 0 "[ . 1]" 1
192 1 10 GLN H 1 22 TYR H . . 3.850 3.443 3.199 3.645 . 0 0 "[ . 1]" 1
193 1 10 GLN H 1 22 TYR HB2 . . 4.090 4.106 3.859 4.179 0.089 2 0 "[ . 1]" 1
194 1 10 GLN H 1 22 TYR HB3 . . 3.260 2.554 2.321 2.676 . 0 0 "[ . 1]" 1
195 1 10 GLN H 1 22 TYR QD . . 3.720 3.519 3.272 3.718 . 0 0 "[ . 1]" 1
196 1 10 GLN HA 1 10 GLN HG2 . . 4.050 3.240 2.338 3.871 . 0 0 "[ . 1]" 1
197 1 10 GLN HA 1 10 GLN QG . . 3.480 2.662 2.311 2.962 . 0 0 "[ . 1]" 1
198 1 10 GLN HA 1 10 GLN HG3 . . 4.050 3.101 2.531 3.652 . 0 0 "[ . 1]" 1
199 1 10 GLN HA 1 11 PRO HD2 . . 3.140 2.225 2.078 2.473 . 0 0 "[ . 1]" 1
200 1 10 GLN HA 1 11 PRO QD . . 2.750 1.982 1.947 2.055 . 0 0 "[ . 1]" 1
201 1 10 GLN HA 1 11 PRO HD3 . . 3.140 2.269 2.057 2.436 . 0 0 "[ . 1]" 1
202 1 10 GLN QB 1 11 PRO QD . . 3.600 3.129 2.181 3.514 . 0 0 "[ . 1]" 1
203 1 10 GLN QB 1 12 VAL QG . . 4.290 2.997 2.693 3.224 . 0 0 "[ . 1]" 1
204 1 10 GLN QB 1 22 TYR HB2 . . 4.560 3.605 3.101 4.034 . 0 0 "[ . 1]" 1
205 1 10 GLN HB2 1 22 TYR HB3 . . 5.500 3.653 2.697 4.516 . 0 0 "[ . 1]" 1
206 1 10 GLN HB3 1 22 TYR HB3 . . 5.500 3.288 2.550 4.727 . 0 0 "[ . 1]" 1
207 1 10 GLN QG 1 11 PRO QD . . 3.480 2.686 1.929 3.612 0.132 7 0 "[ . 1]" 1
208 1 11 PRO HA 1 12 VAL H . . 3.020 2.129 2.116 2.146 . 0 0 "[ . 1]" 1
209 1 11 PRO HA 1 12 VAL MG1 . . 4.850 3.952 3.850 4.023 . 0 0 "[ . 1]" 1
210 1 11 PRO HA 1 12 VAL QG . . 4.130 3.364 3.311 3.411 . 0 0 "[ . 1]" 1
211 1 11 PRO HA 1 12 VAL MG2 . . 4.850 3.646 3.576 3.755 . 0 0 "[ . 1]" 1
212 1 11 PRO HA 1 19 VAL QG . . 4.800 3.554 3.338 3.943 . 0 0 "[ . 1]" 1
213 1 11 PRO HA 1 20 GLY H . . 4.940 4.087 3.923 4.317 . 0 0 "[ . 1]" 1
214 1 11 PRO HA 1 21 ARG HA . . 3.850 2.716 2.534 2.843 . 0 0 "[ . 1]" 1
215 1 11 PRO HA 1 21 ARG HB3 . . 5.500 4.900 4.564 5.028 . 0 0 "[ . 1]" 1
216 1 11 PRO HA 1 21 ARG HD2 . . 4.180 3.764 2.202 4.210 0.030 1 0 "[ . 1]" 1
217 1 11 PRO HA 1 21 ARG HD3 . . 4.180 2.848 2.372 4.190 0.010 6 0 "[ . 1]" 1
218 1 11 PRO HA 1 22 TYR H . . 4.020 3.565 3.389 3.844 . 0 0 "[ . 1]" 1
219 1 11 PRO HA 1 69 ALA MB . . 4.820 4.059 3.845 4.287 . 0 0 "[ . 1]" 1
220 1 11 PRO HB2 1 12 VAL H . . 3.860 3.650 3.502 3.688 . 0 0 "[ . 1]" 1
221 1 11 PRO HB2 1 13 VAL QG . . 4.800 4.623 4.460 4.738 . 0 0 "[ . 1]" 1
222 1 11 PRO HB2 1 19 VAL QG . . 4.420 2.922 2.590 3.315 . 0 0 "[ . 1]" 1
223 1 11 PRO HB2 1 61 TYR H . . 4.500 3.948 3.694 4.426 . 0 0 "[ . 1]" 1
224 1 11 PRO HB2 1 61 TYR HB2 . . 4.130 2.440 2.184 2.874 . 0 0 "[ . 1]" 1
225 1 11 PRO HB2 1 61 TYR HB3 . . 4.400 2.733 2.011 3.897 . 0 0 "[ . 1]" 1
226 1 11 PRO HB2 1 69 ALA MB . . 3.850 2.581 2.370 2.752 . 0 0 "[ . 1]" 1
227 1 11 PRO HB3 1 12 VAL H . . 4.120 4.084 3.989 4.132 0.012 5 0 "[ . 1]" 1
228 1 11 PRO HB3 1 19 VAL QG . . 4.690 3.401 3.048 3.759 . 0 0 "[ . 1]" 1
229 1 11 PRO HB3 1 21 ARG QD . . 4.240 3.003 2.674 3.178 . 0 0 "[ . 1]" 1
230 1 11 PRO HB3 1 61 TYR HB2 . . 4.960 4.158 3.931 4.613 . 0 0 "[ . 1]" 1
231 1 11 PRO HB3 1 61 TYR HB3 . . 5.500 4.250 3.648 5.174 . 0 0 "[ . 1]" 1
232 1 11 PRO HB3 1 69 ALA HA . . 5.470 5.127 4.933 5.302 . 0 0 "[ . 1]" 1
233 1 11 PRO HB3 1 69 ALA MB . . 3.850 2.304 2.130 2.455 . 0 0 "[ . 1]" 1
234 1 11 PRO QD 1 66 GLU QG . . 4.960 3.899 3.226 4.408 . 0 0 "[ . 1]" 1
235 1 11 PRO HD2 1 66 GLU QB . . 3.790 3.143 2.954 3.508 . 0 0 "[ . 1]" 1
236 1 11 PRO HD3 1 66 GLU QB . . 3.790 3.273 2.520 3.852 0.062 9 0 "[ . 1]" 1
237 1 11 PRO HG2 1 12 VAL HA . . 5.100 4.981 4.904 5.103 0.003 4 0 "[ . 1]" 1
238 1 11 PRO HG2 1 61 TYR H . . 4.670 3.710 3.297 4.260 . 0 0 "[ . 1]" 1
239 1 11 PRO HG2 1 66 GLU QB . . 4.160 3.003 1.970 4.172 0.012 8 0 "[ . 1]" 1
240 1 11 PRO HG2 1 69 ALA MB . . 4.610 3.506 3.258 3.848 . 0 0 "[ . 1]" 1
241 1 11 PRO HG3 1 61 TYR HB2 . . 4.950 4.376 3.379 5.055 0.105 9 0 "[ . 1]" 1
242 1 11 PRO HG3 1 69 ALA MB . . 3.630 2.679 2.353 3.107 . 0 0 "[ . 1]" 1
243 1 12 VAL H 1 12 VAL HB . . 4.120 3.832 3.809 3.876 . 0 0 "[ . 1]" 1
244 1 12 VAL H 1 12 VAL MG1 . . 4.750 3.091 2.985 3.138 . 0 0 "[ . 1]" 1
245 1 12 VAL H 1 12 VAL QG . . 3.310 2.159 2.100 2.228 . 0 0 "[ . 1]" 1
246 1 12 VAL H 1 12 VAL MG2 . . 4.750 2.205 2.140 2.282 . 0 0 "[ . 1]" 1
247 1 12 VAL H 1 13 VAL H . . 4.860 4.405 4.366 4.439 . 0 0 "[ . 1]" 1
248 1 12 VAL H 1 13 VAL QG . . 5.100 4.443 4.332 4.593 . 0 0 "[ . 1]" 1
249 1 12 VAL H 1 19 VAL QG . . 4.260 3.397 3.085 3.621 . 0 0 "[ . 1]" 1
250 1 12 VAL H 1 20 GLY H . . 4.100 2.796 2.581 2.947 . 0 0 "[ . 1]" 1
251 1 12 VAL H 1 21 ARG HA . . 4.060 3.542 3.344 3.679 . 0 0 "[ . 1]" 1
252 1 12 VAL H 1 21 ARG QD . . 4.980 4.183 3.797 4.383 . 0 0 "[ . 1]" 1
253 1 12 VAL H 1 22 TYR H . . 4.080 3.765 3.481 3.905 . 0 0 "[ . 1]" 1
254 1 12 VAL H 1 22 TYR HB2 . . 4.980 4.472 4.193 4.749 . 0 0 "[ . 1]" 1
255 1 12 VAL H 1 40 LEU QD . . 5.440 3.288 3.094 3.474 . 0 0 "[ . 1]" 1
256 1 12 VAL H 1 61 TYR H . . 5.500 4.652 4.379 4.843 . 0 0 "[ . 1]" 1
257 1 12 VAL HA 1 12 VAL MG1 . . 3.590 2.321 2.307 2.365 . 0 0 "[ . 1]" 1
258 1 12 VAL HA 1 12 VAL QG . . 2.980 2.270 2.257 2.307 . 0 0 "[ . 1]" 1
259 1 12 VAL HA 1 12 VAL MG2 . . 3.590 3.206 3.202 3.210 . 0 0 "[ . 1]" 1
260 1 12 VAL HA 1 13 VAL H . . 2.780 2.326 2.185 2.529 . 0 0 "[ . 1]" 1
261 1 12 VAL HA 1 13 VAL QG . . 3.700 3.209 3.175 3.267 . 0 0 "[ . 1]" 1
262 1 12 VAL HA 1 58 ILE MG . . 4.350 4.215 3.894 4.422 0.072 8 0 "[ . 1]" 1
263 1 12 VAL HA 1 59 SER H . . 5.490 4.825 4.449 5.187 . 0 0 "[ . 1]" 1
264 1 12 VAL HA 1 60 ARG HA . . 3.610 2.395 1.856 2.794 . 0 0 "[ . 1]" 1
265 1 12 VAL HA 1 61 TYR H . . 3.720 2.486 2.115 2.864 . 0 0 "[ . 1]" 1
266 1 12 VAL HB 1 13 VAL H . . 3.180 2.623 2.229 2.946 . 0 0 "[ . 1]" 1
267 1 12 VAL HB 1 13 VAL QG . . 4.730 3.946 3.780 4.060 . 0 0 "[ . 1]" 1
268 1 12 VAL HB 1 22 TYR QD . . 5.500 5.262 4.925 5.430 . 0 0 "[ . 1]" 1
269 1 12 VAL HB 1 40 LEU MD1 . . 4.420 3.932 3.725 4.439 0.019 4 0 "[ . 1]" 1
270 1 12 VAL HB 1 40 LEU MD2 . . 4.420 4.296 4.108 4.407 . 0 0 "[ . 1]" 1
271 1 12 VAL HB 1 59 SER H . . 4.680 3.744 3.383 4.036 . 0 0 "[ . 1]" 1
272 1 12 VAL QG 1 13 VAL H . . 4.160 3.253 3.048 3.390 . 0 0 "[ . 1]" 1
273 1 12 VAL QG 1 13 VAL HA . . 4.540 3.960 3.690 4.158 . 0 0 "[ . 1]" 1
274 1 12 VAL QG 1 19 VAL HA . . 4.900 4.422 4.151 4.702 . 0 0 "[ . 1]" 1
275 1 12 VAL QG 1 20 GLY H . . 3.650 3.326 2.927 3.537 . 0 0 "[ . 1]" 1
276 1 12 VAL QG 1 20 GLY HA3 . . 4.080 3.917 3.491 4.105 0.025 10 0 "[ . 1]" 1
277 1 12 VAL QG 1 21 ARG HA . . 4.980 3.662 3.450 3.834 . 0 0 "[ . 1]" 1
278 1 12 VAL QG 1 21 ARG HB3 . . 5.440 5.404 5.257 5.501 0.061 6 0 "[ . 1]" 1
279 1 12 VAL QG 1 22 TYR H . . 3.230 2.845 2.454 3.094 . 0 0 "[ . 1]" 1
280 1 12 VAL QG 1 22 TYR HA . . 3.800 3.287 3.058 3.392 . 0 0 "[ . 1]" 1
281 1 12 VAL QG 1 22 TYR HB2 . . 3.220 2.219 2.065 2.398 . 0 0 "[ . 1]" 1
282 1 12 VAL QG 1 22 TYR HB3 . . 3.710 3.286 3.063 3.510 . 0 0 "[ . 1]" 1
283 1 12 VAL QG 1 22 TYR QD . . 3.880 2.831 2.543 3.065 . 0 0 "[ . 1]" 1
284 1 12 VAL QG 1 23 ALA H . . 5.440 4.891 4.691 4.970 . 0 0 "[ . 1]" 1
285 1 12 VAL QG 1 40 LEU QD . . 2.480 1.755 1.686 1.795 . 0 0 "[ . 1]" 1
286 1 12 VAL QG 1 40 LEU HG . . 3.700 3.029 2.911 3.155 . 0 0 "[ . 1]" 1
287 1 12 VAL QG 1 59 SER H . . 5.330 4.259 3.996 4.477 . 0 0 "[ . 1]" 1
288 1 12 VAL QG 1 60 ARG HA . . 3.900 2.187 1.985 2.605 . 0 0 "[ . 1]" 1
289 1 12 VAL QG 1 60 ARG QD . . 5.280 3.940 3.449 4.249 . 0 0 "[ . 1]" 1
290 1 12 VAL QG 1 60 ARG QG . . 3.700 2.662 2.144 3.629 . 0 0 "[ . 1]" 1
291 1 12 VAL QG 1 61 TYR H . . 5.310 3.249 2.776 3.597 . 0 0 "[ . 1]" 1
292 1 12 VAL MG1 1 22 TYR H . . 4.530 3.868 3.503 4.119 . 0 0 "[ . 1]" 1
293 1 12 VAL MG1 1 22 TYR HB2 . . 3.760 2.808 2.564 3.022 . 0 0 "[ . 1]" 1
294 1 12 VAL MG1 1 22 TYR HB3 . . 4.260 3.699 3.329 3.930 . 0 0 "[ . 1]" 1
295 1 12 VAL MG1 1 22 TYR QD . . 4.630 3.811 3.547 4.011 . 0 0 "[ . 1]" 1
296 1 12 VAL MG2 1 22 TYR H . . 4.530 2.931 2.504 3.198 . 0 0 "[ . 1]" 1
297 1 12 VAL MG2 1 22 TYR HB2 . . 3.760 2.336 2.178 2.556 . 0 0 "[ . 1]" 1
298 1 12 VAL MG2 1 22 TYR HB3 . . 4.260 3.696 3.577 3.951 . 0 0 "[ . 1]" 1
299 1 12 VAL MG2 1 22 TYR QD . . 4.630 2.925 2.605 3.223 . 0 0 "[ . 1]" 1
300 1 13 VAL H 1 13 VAL HB . . 3.790 3.742 3.677 3.820 0.030 9 0 "[ . 1]" 1
301 1 13 VAL H 1 13 VAL MG1 . . 3.170 2.665 2.296 2.835 . 0 0 "[ . 1]" 1
302 1 13 VAL H 1 13 VAL QG . . 2.740 1.997 1.914 2.114 . 0 0 "[ . 1]" 1
303 1 13 VAL H 1 13 VAL MG2 . . 3.170 2.067 1.958 2.181 . 0 0 "[ . 1]" 1
304 1 13 VAL H 1 14 HIS HA . . 5.500 5.094 4.942 5.196 . 0 0 "[ . 1]" 1
305 1 13 VAL H 1 58 ILE HA . . 5.500 4.765 4.578 5.415 . 0 0 "[ . 1]" 1
306 1 13 VAL H 1 58 ILE MG . . 4.110 3.345 3.111 3.788 . 0 0 "[ . 1]" 1
307 1 13 VAL H 1 59 SER H . . 3.410 2.938 2.670 3.460 0.050 8 0 "[ . 1]" 1
308 1 13 VAL H 1 59 SER HA . . 4.990 4.664 4.592 4.823 . 0 0 "[ . 1]" 1
309 1 13 VAL H 1 60 ARG HA . . 4.190 3.376 2.504 3.657 . 0 0 "[ . 1]" 1
310 1 13 VAL H 1 61 TYR H . . 5.010 4.078 3.938 4.306 . 0 0 "[ . 1]" 1
311 1 13 VAL HA 1 13 VAL MG1 . . 3.330 2.333 2.288 2.415 . 0 0 "[ . 1]" 1
312 1 13 VAL HA 1 13 VAL QG . . 2.770 2.279 2.241 2.346 . 0 0 "[ . 1]" 1
313 1 13 VAL HA 1 13 VAL MG2 . . 3.330 3.200 3.186 3.209 . 0 0 "[ . 1]" 1
314 1 13 VAL HA 1 14 HIS H . . 3.010 2.112 2.059 2.288 . 0 0 "[ . 1]" 1
315 1 13 VAL HA 1 19 VAL HA . . 3.910 2.090 1.964 2.290 . 0 0 "[ . 1]" 1
316 1 13 VAL HA 1 19 VAL QG . . 3.930 3.628 3.319 3.922 . 0 0 "[ . 1]" 1
317 1 13 VAL HA 1 20 GLY H . . 3.530 3.273 3.051 3.523 . 0 0 "[ . 1]" 1
318 1 13 VAL HB 1 14 HIS H . . 4.680 2.988 2.779 3.151 . 0 0 "[ . 1]" 1
319 1 13 VAL HB 1 59 SER H . . 5.160 4.682 4.530 4.847 . 0 0 "[ . 1]" 1
320 1 13 VAL HB 1 59 SER HB2 . . 5.500 4.592 4.148 5.571 0.071 7 0 "[ . 1]" 1
321 1 13 VAL HB 1 59 SER HB3 . . 5.500 5.440 4.547 5.705 0.205 3 0 "[ . 1]" 1
322 1 13 VAL QG 1 14 HIS H . . 3.250 3.382 3.253 3.453 0.203 3 0 "[ . 1]" 1
323 1 13 VAL QG 1 14 HIS HA . . 4.330 3.925 3.706 4.076 . 0 0 "[ . 1]" 1
324 1 13 VAL QG 1 14 HIS HB3 . . 5.420 5.191 5.140 5.314 . 0 0 "[ . 1]" 1
325 1 13 VAL QG 1 15 LEU H . . 4.330 4.291 4.100 4.361 0.031 1 0 "[ . 1]" 1
326 1 13 VAL QG 1 19 VAL HA . . 3.540 2.357 2.056 3.167 . 0 0 "[ . 1]" 1
327 1 13 VAL QG 1 19 VAL QG . . 3.190 2.586 1.765 2.948 . 0 0 "[ . 1]" 1
328 1 13 VAL QG 1 20 GLY H . . 4.810 3.889 3.638 4.400 . 0 0 "[ . 1]" 1
329 1 13 VAL QG 1 58 ILE HA . . 4.750 3.670 3.465 3.906 . 0 0 "[ . 1]" 1
330 1 13 VAL QG 1 59 SER H . . 3.750 2.408 2.339 2.470 . 0 0 "[ . 1]" 1
331 1 13 VAL QG 1 59 SER HA . . 4.650 3.731 3.633 3.843 . 0 0 "[ . 1]" 1
332 1 13 VAL QG 1 59 SER QB . . 3.670 1.839 1.676 2.239 . 0 0 "[ . 1]" 1
333 1 13 VAL QG 1 60 ARG H . . 5.240 3.931 3.442 4.208 . 0 0 "[ . 1]" 1
334 1 13 VAL QG 1 61 TYR H . . 3.950 3.735 3.350 3.929 . 0 0 "[ . 1]" 1
335 1 13 VAL QG 1 61 TYR HA . . 3.800 3.126 2.630 3.816 0.016 8 0 "[ . 1]" 1
336 1 13 VAL QG 1 61 TYR HB2 . . 4.450 3.295 2.751 4.462 0.012 8 0 "[ . 1]" 1
337 1 13 VAL QG 1 61 TYR QD . . 3.020 2.373 2.034 2.720 . 0 0 "[ . 1]" 1
338 1 13 VAL QG 1 61 TYR QE . . 3.650 3.353 2.327 3.703 0.053 4 0 "[ . 1]" 1
339 1 13 VAL QG 1 70 PRO HD2 . . 5.440 5.296 4.953 5.512 0.072 1 0 "[ . 1]" 1
340 1 13 VAL MG1 1 14 HIS H . . 4.230 3.798 3.711 3.916 . 0 0 "[ . 1]" 1
341 1 13 VAL MG1 1 19 VAL HA . . 4.570 2.368 2.059 3.215 . 0 0 "[ . 1]" 1
342 1 13 VAL MG1 1 59 SER H . . 4.550 4.624 4.560 4.694 0.144 3 0 "[ . 1]" 1
343 1 13 VAL MG1 1 59 SER HB2 . . 5.420 4.335 3.831 5.274 . 0 0 "[ . 1]" 1
344 1 13 VAL MG1 1 59 SER HB3 . . 5.420 4.467 3.956 4.787 . 0 0 "[ . 1]" 1
345 1 13 VAL MG2 1 14 HIS H . . 4.230 3.808 3.476 3.969 . 0 0 "[ . 1]" 1
346 1 13 VAL MG2 1 19 VAL HA . . 4.570 4.540 4.390 4.764 0.194 8 0 "[ . 1]" 1
347 1 13 VAL MG2 1 59 SER H . . 4.550 2.416 2.345 2.479 . 0 0 "[ . 1]" 1
348 1 13 VAL MG2 1 59 SER HB2 . . 5.420 2.065 1.690 2.880 . 0 0 "[ . 1]" 1
349 1 13 VAL MG2 1 59 SER HB3 . . 5.420 2.592 1.908 2.823 . 0 0 "[ . 1]" 1
350 1 14 HIS H 1 14 HIS HB2 . . 3.630 2.766 2.652 2.932 . 0 0 "[ . 1]" 1
351 1 14 HIS H 1 14 HIS HB3 . . 3.510 2.648 2.503 3.126 . 0 0 "[ . 1]" 1
352 1 14 HIS H 1 14 HIS HD2 . . 5.240 5.079 4.998 5.367 0.127 8 0 "[ . 1]" 1
353 1 14 HIS H 1 15 LEU H . . 4.450 4.310 4.113 4.439 . 0 0 "[ . 1]" 1
354 1 14 HIS H 1 15 LEU HA . . 5.310 4.952 4.681 5.139 . 0 0 "[ . 1]" 1
355 1 14 HIS H 1 17 HIS H . . 4.840 4.395 4.223 4.785 . 0 0 "[ . 1]" 1
356 1 14 HIS H 1 18 GLY H . . 3.750 2.870 2.644 3.380 . 0 0 "[ . 1]" 1
357 1 14 HIS H 1 19 VAL HA . . 4.180 3.552 3.213 3.839 . 0 0 "[ . 1]" 1
358 1 14 HIS H 1 19 VAL QG . . 5.280 4.747 4.462 5.019 . 0 0 "[ . 1]" 1
359 1 14 HIS H 1 20 GLY H . . 4.910 4.509 4.276 4.941 0.031 8 0 "[ . 1]" 1
360 1 14 HIS HA 1 14 HIS HD2 . . 4.780 2.495 2.343 3.384 . 0 0 "[ . 1]" 1
361 1 14 HIS HA 1 15 LEU H . . 2.660 2.151 2.105 2.171 . 0 0 "[ . 1]" 1
362 1 14 HIS HA 1 15 LEU HA . . 4.480 4.346 4.308 4.360 . 0 0 "[ . 1]" 1
363 1 14 HIS HA 1 15 LEU HB3 . . 4.370 4.405 4.383 4.427 0.057 10 0 "[ . 1]" 1
364 1 14 HIS HA 1 15 LEU MD1 . . 5.150 3.290 3.111 3.376 . 0 0 "[ . 1]" 1
365 1 14 HIS HA 1 16 GLU H . . 4.170 3.732 3.587 3.804 . 0 0 "[ . 1]" 1
366 1 14 HIS HA 1 16 GLU HB2 . . 5.290 5.286 5.184 5.350 0.060 6 0 "[ . 1]" 1
367 1 14 HIS HA 1 17 HIS H . . 4.890 4.655 4.551 4.781 . 0 0 "[ . 1]" 1
368 1 14 HIS HA 1 40 LEU QD . . 5.440 4.542 4.329 5.293 . 0 0 "[ . 1]" 1
369 1 14 HIS HA 1 48 LEU QD . . 4.650 4.411 4.254 4.673 0.023 8 0 "[ . 1]" 1
370 1 14 HIS HA 1 50 VAL MG1 . . 5.500 5.392 5.134 5.770 0.270 8 0 "[ . 1]" 1
371 1 14 HIS HA 1 58 ILE MD . . 3.450 2.225 2.050 2.898 . 0 0 "[ . 1]" 1
372 1 14 HIS HB2 1 15 LEU H . . 4.420 4.406 4.333 4.491 0.071 8 0 "[ . 1]" 1
373 1 14 HIS HB2 1 17 HIS H . . 4.260 4.179 3.995 4.351 0.091 4 0 "[ . 1]" 1
374 1 14 HIS HB2 1 17 HIS QB . . 4.980 4.511 4.283 4.776 . 0 0 "[ . 1]" 1
375 1 14 HIS HB2 1 18 GLY H . . 3.700 3.724 3.089 3.842 0.142 4 0 "[ . 1]" 1
376 1 14 HIS HB2 1 40 LEU QD . . 3.880 3.134 2.952 3.914 0.034 4 0 "[ . 1]" 1
377 1 14 HIS HB2 1 58 ILE MD . . 4.410 3.162 2.842 4.284 . 0 0 "[ . 1]" 1
378 1 14 HIS HB2 1 58 ILE MG . . 4.610 4.104 3.903 4.271 . 0 0 "[ . 1]" 1
379 1 14 HIS HB3 1 15 LEU H . . 4.750 4.176 3.918 4.385 . 0 0 "[ . 1]" 1
380 1 14 HIS HB3 1 16 GLU H . . 4.790 3.449 3.041 3.976 . 0 0 "[ . 1]" 1
381 1 14 HIS HB3 1 17 HIS H . . 3.600 2.502 2.263 2.898 . 0 0 "[ . 1]" 1
382 1 14 HIS HB3 1 17 HIS HB2 . . 4.940 3.345 3.042 3.613 . 0 0 "[ . 1]" 1
383 1 14 HIS HB3 1 17 HIS QB . . 4.200 3.245 2.984 3.485 . 0 0 "[ . 1]" 1
384 1 14 HIS HB3 1 17 HIS HB3 . . 4.940 4.432 3.966 4.961 0.021 8 0 "[ . 1]" 1
385 1 14 HIS HB3 1 18 GLY H . . 3.410 2.196 1.942 2.331 . 0 0 "[ . 1]" 1
386 1 14 HIS HB3 1 40 LEU MD1 . . 5.500 4.510 4.325 5.226 . 0 0 "[ . 1]" 1
387 1 14 HIS HB3 1 40 LEU QD . . 4.550 4.300 4.178 4.776 0.226 4 0 "[ . 1]" 1
388 1 14 HIS HB3 1 40 LEU MD2 . . 5.500 5.476 5.180 5.544 0.044 2 0 "[ . 1]" 1
389 1 14 HIS HB3 1 58 ILE MD . . 5.210 4.161 3.958 4.484 . 0 0 "[ . 1]" 1
390 1 14 HIS HD2 1 15 LEU MD1 . . 4.010 2.234 2.010 2.400 . 0 0 "[ . 1]" 1
391 1 14 HIS HD2 1 15 LEU MD2 . . 4.730 4.649 4.007 4.770 0.040 3 0 "[ . 1]" 1
392 1 14 HIS HD2 1 48 LEU QD . . 4.850 3.900 3.019 4.277 . 0 0 "[ . 1]" 1
393 1 14 HIS HD2 1 50 VAL MG2 . . 3.520 3.447 3.172 3.674 0.154 8 0 "[ . 1]" 1
394 1 14 HIS HD2 1 58 ILE MD . . 3.460 2.159 1.934 3.165 . 0 0 "[ . 1]" 1
395 1 14 HIS HD2 1 58 ILE MG . . 4.530 4.444 4.377 4.597 0.067 8 0 "[ . 1]" 1
396 1 15 LEU H 1 15 LEU HB2 . . 3.660 3.563 3.558 3.577 . 0 0 "[ . 1]" 1
397 1 15 LEU H 1 15 LEU HB3 . . 2.810 2.351 2.328 2.415 . 0 0 "[ . 1]" 1
398 1 15 LEU H 1 15 LEU MD1 . . 4.110 1.988 1.895 2.023 . 0 0 "[ . 1]" 1
399 1 15 LEU H 1 15 LEU MD2 . . 4.460 3.900 3.760 3.957 . 0 0 "[ . 1]" 1
400 1 15 LEU H 1 15 LEU HG . . 4.300 3.668 3.651 3.685 . 0 0 "[ . 1]" 1
401 1 15 LEU H 1 16 GLU H . . 3.520 2.815 2.729 2.867 . 0 0 "[ . 1]" 1
402 1 15 LEU H 1 17 HIS H . . 5.060 4.691 4.555 4.825 . 0 0 "[ . 1]" 1
403 1 15 LEU H 1 57 LEU HB2 . . 4.640 4.529 4.403 4.657 0.017 8 0 "[ . 1]" 1
404 1 15 LEU H 1 57 LEU HB3 . . 4.570 3.767 3.472 4.234 . 0 0 "[ . 1]" 1
405 1 15 LEU H 1 57 LEU QD . . 4.730 4.611 4.382 4.807 0.077 8 0 "[ . 1]" 1
406 1 15 LEU H 1 58 ILE HA . . 4.440 3.515 3.282 3.658 . 0 0 "[ . 1]" 1
407 1 15 LEU H 1 58 ILE MG . . 5.500 4.737 4.193 5.011 . 0 0 "[ . 1]" 1
408 1 15 LEU HA 1 15 LEU MD1 . . 3.540 3.473 3.462 3.479 . 0 0 "[ . 1]" 1
409 1 15 LEU HA 1 15 LEU MD2 . . 3.550 3.566 3.558 3.576 0.026 1 0 "[ . 1]" 1
410 1 15 LEU HA 1 16 GLU QG . . 5.340 5.068 4.957 5.314 . 0 0 "[ . 1]" 1
411 1 15 LEU HA 1 17 HIS H . . 4.930 4.750 4.584 4.896 . 0 0 "[ . 1]" 1
412 1 15 LEU HB2 1 15 LEU MD2 . . 3.280 2.261 2.241 2.280 . 0 0 "[ . 1]" 1
413 1 15 LEU HB2 1 15 LEU HG . . 2.640 2.546 2.525 2.561 . 0 0 "[ . 1]" 1
414 1 15 LEU HB2 1 57 LEU QD . . 4.420 4.095 3.720 4.334 . 0 0 "[ . 1]" 1
415 1 15 LEU HB3 1 15 LEU MD1 . . 3.350 2.565 2.547 2.580 . 0 0 "[ . 1]" 1
416 1 15 LEU HB3 1 57 LEU HB2 . . 4.620 4.646 4.570 4.681 0.061 9 0 "[ . 1]" 1
417 1 15 LEU HB3 1 57 LEU QD . . 4.080 3.798 3.383 4.042 . 0 0 "[ . 1]" 1
418 1 15 LEU HB3 1 58 ILE HA . . 5.500 4.621 4.212 4.861 . 0 0 "[ . 1]" 1
419 1 15 LEU MD1 1 16 GLU QG . . 4.510 1.954 1.868 2.087 . 0 0 "[ . 1]" 1
420 1 15 LEU MD1 1 54 SER QB . . 4.540 4.356 4.126 4.608 0.068 3 0 "[ . 1]" 1
421 1 15 LEU MD1 1 57 LEU HB2 . . 3.530 2.606 2.398 2.732 . 0 0 "[ . 1]" 1
422 1 15 LEU MD1 1 57 LEU HB3 . . 3.660 1.934 1.809 2.310 . 0 0 "[ . 1]" 1
423 1 15 LEU MD1 1 57 LEU QD . . 2.640 2.269 2.170 2.421 . 0 0 "[ . 1]" 1
424 1 15 LEU MD1 1 58 ILE H . . 5.410 4.553 4.244 4.745 . 0 0 "[ . 1]" 1
425 1 15 LEU MD1 1 58 ILE HA . . 5.500 3.968 3.400 4.280 . 0 0 "[ . 1]" 1
426 1 15 LEU MD1 1 58 ILE HG12 . . 4.280 4.198 3.907 4.303 0.023 10 0 "[ . 1]" 1
427 1 15 LEU MD2 1 16 GLU H . . 4.340 3.047 2.917 3.234 . 0 0 "[ . 1]" 1
428 1 15 LEU MD2 1 16 GLU QG . . 4.630 2.319 2.126 2.520 . 0 0 "[ . 1]" 1
429 1 15 LEU MD2 1 57 LEU QD . . 2.840 2.672 2.425 2.762 . 0 0 "[ . 1]" 1
430 1 15 LEU HG 1 57 LEU H . . 5.500 5.528 5.438 5.561 0.061 1 0 "[ . 1]" 1
431 1 15 LEU HG 1 57 LEU HA . . 4.130 3.549 3.219 4.126 . 0 0 "[ . 1]" 1
432 1 15 LEU HG 1 57 LEU QD . . 3.170 2.271 1.970 2.492 . 0 0 "[ . 1]" 1
433 1 16 GLU H 1 16 GLU HB2 . . 3.190 2.361 2.288 2.457 . 0 0 "[ . 1]" 1
434 1 16 GLU H 1 16 GLU HB3 . . 3.630 3.581 3.558 3.610 . 0 0 "[ . 1]" 1
435 1 16 GLU H 1 16 GLU HG2 . . 4.090 3.448 2.638 3.842 . 0 0 "[ . 1]" 1
436 1 16 GLU H 1 16 GLU QG . . 3.500 2.539 2.384 2.747 . 0 0 "[ . 1]" 1
437 1 16 GLU H 1 16 GLU HG3 . . 4.090 2.915 2.415 3.993 . 0 0 "[ . 1]" 1
438 1 16 GLU H 1 17 HIS H . . 2.920 2.534 2.460 2.579 . 0 0 "[ . 1]" 1
439 1 16 GLU H 1 17 HIS QB . . 5.130 4.666 4.479 4.873 . 0 0 "[ . 1]" 1
440 1 16 GLU H 1 18 GLY H . . 4.020 3.903 3.655 4.031 0.011 7 0 "[ . 1]" 1
441 1 16 GLU H 1 48 LEU QD . . 5.310 4.897 4.310 5.321 0.011 10 0 "[ . 1]" 1
442 1 16 GLU H 1 57 LEU QD . . 5.430 5.135 5.062 5.278 . 0 0 "[ . 1]" 1
443 1 16 GLU HA 1 16 GLU HG2 . . 3.880 2.649 2.465 2.908 . 0 0 "[ . 1]" 1
444 1 16 GLU HA 1 16 GLU QG . . 3.350 2.506 2.357 2.799 . 0 0 "[ . 1]" 1
445 1 16 GLU HA 1 16 GLU HG3 . . 3.880 3.149 2.788 3.726 . 0 0 "[ . 1]" 1
446 1 16 GLU HA 1 18 GLY H . . 5.480 5.345 5.036 5.490 0.010 7 0 "[ . 1]" 1
447 1 16 GLU HB2 1 17 HIS H . . 3.550 2.554 2.367 2.712 . 0 0 "[ . 1]" 1
448 1 16 GLU HB2 1 18 GLY H . . 4.770 4.562 4.302 4.768 . 0 0 "[ . 1]" 1
449 1 16 GLU HB3 1 17 HIS H . . 3.620 3.457 3.248 3.645 0.025 4 0 "[ . 1]" 1
450 1 16 GLU QG 1 17 HIS H . . 4.140 4.149 4.022 4.197 0.057 5 0 "[ . 1]" 1
451 1 16 GLU QG 1 57 LEU QD . . 3.900 3.887 3.660 3.977 0.077 1 0 "[ . 1]" 1
452 1 17 HIS H 1 17 HIS HB2 . . 3.840 2.503 2.387 2.609 . 0 0 "[ . 1]" 1
453 1 17 HIS H 1 17 HIS QB . . 3.170 2.460 2.354 2.564 . 0 0 "[ . 1]" 1
454 1 17 HIS H 1 17 HIS HB3 . . 3.840 3.614 3.461 3.768 . 0 0 "[ . 1]" 1
455 1 17 HIS H 1 18 GLY H . . 3.080 2.111 1.996 2.237 . 0 0 "[ . 1]" 1
456 1 17 HIS H 1 48 LEU QD . . 5.140 4.343 3.659 4.766 . 0 0 "[ . 1]" 1
457 1 17 HIS H 1 58 ILE MD . . 5.500 5.624 5.531 5.696 0.196 10 0 "[ . 1]" 1
458 1 17 HIS HA 1 74 LEU QD . . 4.920 4.800 4.551 4.984 0.064 3 0 "[ . 1]" 1
459 1 17 HIS QB 1 18 GLY H . . 3.610 2.892 2.750 3.171 . 0 0 "[ . 1]" 1
460 1 17 HIS QB 1 48 LEU QD . . 4.850 3.453 2.900 3.900 . 0 0 "[ . 1]" 1
461 1 17 HIS QB 1 74 LEU QD . . 4.010 2.620 2.417 2.952 . 0 0 "[ . 1]" 1
462 1 17 HIS HB2 1 18 GLY H . . 4.350 3.115 2.844 3.369 . 0 0 "[ . 1]" 1
463 1 17 HIS HB3 1 18 GLY H . . 4.350 3.468 3.120 3.863 . 0 0 "[ . 1]" 1
464 1 19 VAL HA 1 19 VAL MG1 . . 3.250 3.029 2.302 3.217 . 0 0 "[ . 1]" 1
465 1 19 VAL HA 1 19 VAL QG . . 2.800 2.314 2.138 2.398 . 0 0 "[ . 1]" 1
466 1 19 VAL HA 1 19 VAL MG2 . . 3.250 2.441 2.391 2.541 . 0 0 "[ . 1]" 1
467 1 19 VAL HA 1 20 GLY H . . 2.740 2.139 2.104 2.181 . 0 0 "[ . 1]" 1
468 1 19 VAL HB 1 20 GLY H . . 4.280 4.074 3.931 4.149 . 0 0 "[ . 1]" 1
469 1 19 VAL QG 1 20 GLY H . . 3.060 2.527 2.412 2.642 . 0 0 "[ . 1]" 1
470 1 19 VAL QG 1 20 GLY HA2 . . 4.470 3.207 3.118 3.425 . 0 0 "[ . 1]" 1
471 1 19 VAL QG 1 20 GLY HA3 . . 4.690 4.003 3.923 4.161 . 0 0 "[ . 1]" 1
472 1 19 VAL QG 1 40 LEU QD . . 5.220 4.434 4.250 4.649 . 0 0 "[ . 1]" 1
473 1 19 VAL QG 1 61 TYR QD . . 3.530 2.404 2.122 2.655 . 0 0 "[ . 1]" 1
474 1 19 VAL QG 1 61 TYR QE . . 3.670 2.560 2.047 3.043 . 0 0 "[ . 1]" 1
475 1 19 VAL QG 1 69 ALA HA . . 4.970 3.678 2.775 4.451 . 0 0 "[ . 1]" 1
476 1 19 VAL QG 1 69 ALA MB . . 3.530 2.335 1.879 2.864 . 0 0 "[ . 1]" 1
477 1 19 VAL QG 1 70 PRO HB3 . . 4.620 4.185 3.867 4.623 0.003 5 0 "[ . 1]" 1
478 1 19 VAL QG 1 70 PRO HD2 . . 3.580 2.415 1.847 2.966 . 0 0 "[ . 1]" 1
479 1 19 VAL QG 1 70 PRO HD3 . . 4.340 3.671 3.148 4.105 . 0 0 "[ . 1]" 1
480 1 19 VAL QG 1 70 PRO QG . . 3.130 1.947 1.741 2.540 . 0 0 "[ . 1]" 1
481 1 19 VAL QG 1 71 LEU QD . . 4.300 3.324 2.988 3.694 . 0 0 "[ . 1]" 1
482 1 19 VAL MG1 1 20 GLY H . . 4.040 3.698 2.467 4.063 0.023 10 0 "[ . 1]" 1
483 1 19 VAL MG1 1 61 TYR QD . . 4.950 3.819 2.246 4.974 0.024 8 0 "[ . 1]" 1
484 1 19 VAL MG1 1 61 TYR QE . . 4.200 3.201 2.919 3.740 . 0 0 "[ . 1]" 1
485 1 19 VAL MG1 1 69 ALA MB . . 5.020 3.588 1.885 4.310 . 0 0 "[ . 1]" 1
486 1 19 VAL MG1 1 70 PRO HB3 . . 5.380 4.423 3.985 5.162 . 0 0 "[ . 1]" 1
487 1 19 VAL MG1 1 70 PRO HD2 . . 4.490 2.843 2.040 3.589 . 0 0 "[ . 1]" 1
488 1 19 VAL MG1 1 70 PRO HG2 . . 4.410 2.134 1.759 3.456 . 0 0 "[ . 1]" 1
489 1 19 VAL MG1 1 70 PRO HG3 . . 4.410 3.545 3.039 4.453 0.043 9 0 "[ . 1]" 1
490 1 19 VAL MG2 1 20 GLY H . . 4.040 2.865 2.437 4.111 0.071 5 0 "[ . 1]" 1
491 1 19 VAL MG2 1 61 TYR QD . . 4.950 2.495 2.254 2.744 . 0 0 "[ . 1]" 1
492 1 19 VAL MG2 1 61 TYR QE . . 4.200 2.751 2.064 3.243 . 0 0 "[ . 1]" 1
493 1 19 VAL MG2 1 69 ALA MB . . 5.020 2.692 2.083 3.900 . 0 0 "[ . 1]" 1
494 1 19 VAL MG2 1 70 PRO HB3 . . 5.380 5.277 5.121 5.384 0.004 4 0 "[ . 1]" 1
495 1 19 VAL MG2 1 70 PRO HD2 . . 4.490 2.643 2.110 3.164 . 0 0 "[ . 1]" 1
496 1 19 VAL MG2 1 70 PRO HG2 . . 4.410 3.083 2.650 3.392 . 0 0 "[ . 1]" 1
497 1 19 VAL MG2 1 70 PRO HG3 . . 4.410 4.329 3.670 4.530 0.120 2 0 "[ . 1]" 1
498 1 20 GLY H 1 21 ARG H . . 4.410 4.396 4.376 4.423 0.013 8 0 "[ . 1]" 1
499 1 20 GLY H 1 40 LEU QD . . 5.150 3.331 3.122 3.548 . 0 0 "[ . 1]" 1
500 1 20 GLY H 1 61 TYR QD . . 5.040 5.086 5.047 5.124 0.084 8 0 "[ . 1]" 1
501 1 20 GLY HA2 1 21 ARG H . . 3.200 2.579 2.525 2.662 . 0 0 "[ . 1]" 1
502 1 20 GLY HA2 1 40 LEU QD . . 4.120 3.498 3.364 3.627 . 0 0 "[ . 1]" 1
503 1 20 GLY HA2 1 42 TYR HA . . 5.010 3.368 2.871 3.813 . 0 0 "[ . 1]" 1
504 1 20 GLY HA2 1 71 LEU QD . . 3.690 2.200 1.926 2.632 . 0 0 "[ . 1]" 1
505 1 20 GLY HA3 1 21 ARG H . . 3.390 2.587 2.525 2.646 . 0 0 "[ . 1]" 1
506 1 20 GLY HA3 1 40 LEU HB2 . . 5.500 5.542 5.514 5.595 0.095 8 0 "[ . 1]" 1
507 1 20 GLY HA3 1 71 LEU QD . . 4.180 3.513 3.199 3.879 . 0 0 "[ . 1]" 1
508 1 20 GLY HA3 1 72 HIS H . . 5.500 4.847 4.655 5.154 . 0 0 "[ . 1]" 1
509 1 21 ARG H 1 21 ARG HB2 . . 3.550 2.503 2.455 2.624 . 0 0 "[ . 1]" 1
510 1 21 ARG H 1 21 ARG QD . . 4.880 3.909 3.593 4.042 . 0 0 "[ . 1]" 1
511 1 21 ARG H 1 21 ARG HG2 . . 4.120 2.815 2.513 2.965 . 0 0 "[ . 1]" 1
512 1 21 ARG H 1 21 ARG HG3 . . 4.630 4.037 3.907 4.125 . 0 0 "[ . 1]" 1
513 1 21 ARG H 1 40 LEU HA . . 5.000 4.915 4.823 4.987 . 0 0 "[ . 1]" 1
514 1 21 ARG H 1 40 LEU QD . . 4.500 2.572 2.453 2.687 . 0 0 "[ . 1]" 1
515 1 21 ARG H 1 41 THR H . . 3.130 3.130 3.051 3.204 0.074 4 0 "[ . 1]" 1
516 1 21 ARG H 1 41 THR HB . . 4.790 4.451 3.661 4.814 0.024 10 0 "[ . 1]" 1
517 1 21 ARG H 1 42 TYR H . . 5.500 4.832 4.551 5.092 . 0 0 "[ . 1]" 1
518 1 21 ARG H 1 42 TYR HA . . 4.940 3.319 2.995 3.649 . 0 0 "[ . 1]" 1
519 1 21 ARG H 1 71 LEU QD . . 3.700 2.774 2.484 3.195 . 0 0 "[ . 1]" 1
520 1 21 ARG HA 1 21 ARG HD2 . . 4.080 2.809 1.971 3.123 . 0 0 "[ . 1]" 1
521 1 21 ARG HA 1 21 ARG HD3 . . 4.080 2.356 1.914 3.589 . 0 0 "[ . 1]" 1
522 1 21 ARG HA 1 22 TYR H . . 2.830 2.120 2.088 2.158 . 0 0 "[ . 1]" 1
523 1 21 ARG HA 1 40 LEU QD . . 4.510 3.272 3.206 3.348 . 0 0 "[ . 1]" 1
524 1 21 ARG HB2 1 22 TYR H . . 4.410 4.332 4.244 4.428 0.018 4 0 "[ . 1]" 1
525 1 21 ARG HB2 1 41 THR H . . 4.040 3.551 3.250 3.708 . 0 0 "[ . 1]" 1
526 1 21 ARG HB2 1 41 THR HB . . 4.030 3.412 2.585 3.833 . 0 0 "[ . 1]" 1
527 1 21 ARG HB2 1 71 LEU QD . . 4.080 3.160 2.655 3.638 . 0 0 "[ . 1]" 1
528 1 21 ARG HB3 1 21 ARG HD2 . . 4.160 2.544 2.354 2.952 . 0 0 "[ . 1]" 1
529 1 21 ARG HB3 1 21 ARG QD . . 3.580 2.438 2.278 2.841 . 0 0 "[ . 1]" 1
530 1 21 ARG HB3 1 21 ARG HD3 . . 4.160 3.146 2.901 3.698 . 0 0 "[ . 1]" 1
531 1 21 ARG HB3 1 22 TYR H . . 3.720 3.518 3.387 3.715 . 0 0 "[ . 1]" 1
532 1 21 ARG HB3 1 22 TYR HA . . 5.230 5.108 5.044 5.230 0.000 4 0 "[ . 1]" 1
533 1 21 ARG HB3 1 40 LEU QD . . 4.470 4.402 4.295 4.542 0.072 10 0 "[ . 1]" 1
534 1 21 ARG HB3 1 41 THR HB . . 5.150 4.813 3.989 5.158 0.008 1 0 "[ . 1]" 1
535 1 21 ARG HB3 1 71 LEU QD . . 5.440 4.121 3.746 4.305 . 0 0 "[ . 1]" 1
536 1 21 ARG QD 1 22 TYR H . . 4.660 3.632 3.379 3.912 . 0 0 "[ . 1]" 1
537 1 21 ARG QD 1 71 LEU QD . . 4.170 3.428 2.614 3.838 . 0 0 "[ . 1]" 1
538 1 21 ARG HD2 1 22 TYR H . . 5.320 4.311 3.712 4.780 . 0 0 "[ . 1]" 1
539 1 21 ARG HD3 1 22 TYR H . . 5.320 4.167 3.521 5.427 0.107 9 0 "[ . 1]" 1
540 1 21 ARG HG2 1 40 LEU QD . . 4.550 4.631 4.570 4.686 0.136 3 0 "[ . 1]" 1
541 1 21 ARG HG2 1 71 LEU QB . . 5.110 4.307 3.881 4.973 . 0 0 "[ . 1]" 1
542 1 21 ARG HG2 1 71 LEU MD1 . . 4.160 2.107 1.919 2.474 . 0 0 "[ . 1]" 1
543 1 21 ARG HG2 1 71 LEU QD . . 3.450 2.058 1.907 2.317 . 0 0 "[ . 1]" 1
544 1 21 ARG HG2 1 71 LEU MD2 . . 4.160 3.315 2.417 4.027 . 0 0 "[ . 1]" 1
545 1 21 ARG HG2 1 71 LEU HG . . 5.170 4.522 2.258 5.203 0.033 4 0 "[ . 1]" 1
546 1 21 ARG HG3 1 71 LEU QD . . 3.280 2.704 2.261 2.955 . 0 0 "[ . 1]" 1
547 1 22 TYR H 1 22 TYR HB2 . . 2.900 2.520 2.475 2.584 . 0 0 "[ . 1]" 1
548 1 22 TYR H 1 22 TYR HB3 . . 2.960 2.518 2.466 2.590 . 0 0 "[ . 1]" 1
549 1 22 TYR H 1 22 TYR QD . . 4.230 4.187 4.168 4.211 . 0 0 "[ . 1]" 1
550 1 22 TYR H 1 40 LEU QD . . 3.710 3.008 2.762 3.153 . 0 0 "[ . 1]" 1
551 1 22 TYR H 1 40 LEU HG . . 5.360 4.526 4.152 5.469 0.109 4 0 "[ . 1]" 1
552 1 22 TYR H 1 41 THR H . . 5.500 4.701 4.620 4.753 . 0 0 "[ . 1]" 1
553 1 22 TYR HA 1 22 TYR QD . . 3.460 2.675 2.503 2.837 . 0 0 "[ . 1]" 1
554 1 22 TYR HA 1 23 ALA H . . 2.700 2.185 2.161 2.199 . 0 0 "[ . 1]" 1
555 1 22 TYR HA 1 38 LEU QD . . 4.630 3.906 3.787 4.095 . 0 0 "[ . 1]" 1
556 1 22 TYR HA 1 40 LEU HA . . 4.220 2.523 2.395 2.604 . 0 0 "[ . 1]" 1
557 1 22 TYR HA 1 40 LEU MD1 . . 4.540 3.621 2.225 3.861 . 0 0 "[ . 1]" 1
558 1 22 TYR HA 1 40 LEU QD . . 3.150 2.424 1.846 2.654 . 0 0 "[ . 1]" 1
559 1 22 TYR HA 1 40 LEU MD2 . . 4.540 2.470 1.972 2.709 . 0 0 "[ . 1]" 1
560 1 22 TYR HA 1 41 THR H . . 4.120 3.571 3.452 3.678 . 0 0 "[ . 1]" 1
561 1 22 TYR HB2 1 23 ALA H . . 4.450 4.229 4.199 4.287 . 0 0 "[ . 1]" 1
562 1 22 TYR HB2 1 40 LEU QD . . 3.960 3.134 2.893 3.283 . 0 0 "[ . 1]" 1
563 1 22 TYR HB3 1 23 ALA H . . 4.370 4.149 4.119 4.272 . 0 0 "[ . 1]" 1
564 1 22 TYR QD 1 23 ALA H . . 3.610 3.450 3.352 3.533 . 0 0 "[ . 1]" 1
565 1 22 TYR QD 1 23 ALA MB . . 5.500 4.786 4.686 4.857 . 0 0 "[ . 1]" 1
566 1 22 TYR QD 1 38 LEU QB . . 4.740 4.433 3.455 4.743 0.003 1 0 "[ . 1]" 1
567 1 22 TYR QD 1 38 LEU MD1 . . 3.960 2.603 2.428 2.790 . 0 0 "[ . 1]" 1
568 1 22 TYR QD 1 38 LEU MD2 . . 3.960 3.132 2.994 3.405 . 0 0 "[ . 1]" 1
569 1 22 TYR QD 1 38 LEU HG . . 5.500 3.330 2.693 5.527 0.027 10 0 "[ . 1]" 1
570 1 22 TYR QD 1 40 LEU HB2 . . 5.500 4.886 4.441 5.180 . 0 0 "[ . 1]" 1
571 1 22 TYR QD 1 40 LEU MD1 . . 4.170 3.224 3.044 3.826 . 0 0 "[ . 1]" 1
572 1 22 TYR QD 1 40 LEU QD . . 3.590 2.896 2.104 3.015 . 0 0 "[ . 1]" 1
573 1 22 TYR QD 1 40 LEU MD2 . . 4.170 3.528 2.114 3.822 . 0 0 "[ . 1]" 1
574 1 22 TYR QD 1 40 LEU HG . . 4.900 2.838 2.490 4.794 . 0 0 "[ . 1]" 1
575 1 22 TYR QD 1 48 LEU QD . . 5.500 5.483 4.582 5.637 0.137 7 0 "[ . 1]" 1
576 1 22 TYR QE 1 23 ALA H . . 4.400 4.421 4.384 4.464 0.064 4 0 "[ . 1]" 1
577 1 22 TYR QE 1 24 GLY HA2 . . 4.580 3.354 3.112 3.503 . 0 0 "[ . 1]" 1
578 1 22 TYR QE 1 25 MET H . . 5.500 5.383 5.256 5.517 0.017 9 0 "[ . 1]" 1
579 1 22 TYR QE 1 25 MET HA . . 5.190 4.707 4.512 4.851 . 0 0 "[ . 1]" 1
580 1 22 TYR QE 1 38 LEU H . . 5.500 5.494 5.324 5.575 0.075 1 0 "[ . 1]" 1
581 1 22 TYR QE 1 38 LEU QB . . 4.210 2.852 1.796 3.174 . 0 0 "[ . 1]" 1
582 1 22 TYR QE 1 38 LEU MD1 . . 3.870 2.311 2.014 2.859 . 0 0 "[ . 1]" 1
583 1 22 TYR QE 1 38 LEU QD . . 3.310 2.180 2.001 2.478 . 0 0 "[ . 1]" 1
584 1 22 TYR QE 1 38 LEU MD2 . . 3.870 3.220 2.269 3.549 . 0 0 "[ . 1]" 1
585 1 22 TYR QE 1 38 LEU HG . . 4.340 2.289 1.756 4.323 . 0 0 "[ . 1]" 1
586 1 22 TYR QE 1 39 MET H . . 4.350 3.550 3.170 3.994 . 0 0 "[ . 1]" 1
587 1 22 TYR QE 1 40 LEU QD . . 4.230 4.204 3.588 4.356 0.126 5 0 "[ . 1]" 1
588 1 22 TYR QE 1 50 VAL HB . . 5.500 5.548 5.490 5.604 0.104 4 0 "[ . 1]" 1
589 1 23 ALA H 1 23 ALA MB . . 2.940 2.580 2.523 2.607 . 0 0 "[ . 1]" 1
590 1 23 ALA H 1 24 GLY HA3 . . 5.500 5.354 5.318 5.479 . 0 0 "[ . 1]" 1
591 1 23 ALA H 1 38 LEU QD . . 4.900 4.215 4.029 4.330 . 0 0 "[ . 1]" 1
592 1 23 ALA H 1 39 MET H . . 4.360 4.301 4.184 4.382 0.022 4 0 "[ . 1]" 1
593 1 23 ALA H 1 39 MET HB2 . . 5.070 5.030 4.632 5.109 0.039 7 0 "[ . 1]" 1
594 1 23 ALA H 1 39 MET HB3 . . 5.000 3.745 3.584 4.106 . 0 0 "[ . 1]" 1
595 1 23 ALA H 1 40 LEU HA . . 3.420 2.469 2.099 2.617 . 0 0 "[ . 1]" 1
596 1 23 ALA H 1 40 LEU HB2 . . 5.500 5.027 4.778 5.188 . 0 0 "[ . 1]" 1
597 1 23 ALA H 1 40 LEU MD1 . . 4.790 4.772 3.310 4.984 0.194 6 0 "[ . 1]" 1
598 1 23 ALA H 1 40 LEU QD . . 4.040 3.703 2.561 4.022 . 0 0 "[ . 1]" 1
599 1 23 ALA H 1 40 LEU MD2 . . 4.790 3.863 2.666 4.284 . 0 0 "[ . 1]" 1
600 1 23 ALA H 1 40 LEU HG . . 4.900 3.687 3.454 5.298 0.398 4 0 "[ . 1]" 1
601 1 23 ALA H 1 41 THR H . . 4.730 3.924 3.490 4.094 . 0 0 "[ . 1]" 1
602 1 23 ALA HA 1 24 GLY HA3 . . 4.490 4.261 4.239 4.279 . 0 0 "[ . 1]" 1
603 1 23 ALA MB 1 24 GLY HA2 . . 5.500 4.917 4.892 4.938 . 0 0 "[ . 1]" 1
604 1 23 ALA MB 1 24 GLY HA3 . . 5.210 4.162 4.127 4.186 . 0 0 "[ . 1]" 1
605 1 23 ALA MB 1 25 MET H . . 5.500 5.590 5.547 5.633 0.133 6 0 "[ . 1]" 1
606 1 23 ALA MB 1 39 MET HA . . 5.160 4.968 4.795 5.084 . 0 0 "[ . 1]" 1
607 1 23 ALA MB 1 39 MET HB3 . . 3.080 2.982 2.759 3.120 0.040 8 0 "[ . 1]" 1
608 1 23 ALA MB 1 40 LEU H . . 4.750 4.675 4.289 4.842 0.092 10 0 "[ . 1]" 1
609 1 23 ALA MB 1 40 LEU HA . . 3.760 3.434 3.139 3.524 . 0 0 "[ . 1]" 1
610 1 23 ALA MB 1 41 THR H . . 3.980 3.642 3.110 3.784 . 0 0 "[ . 1]" 1
611 1 23 ALA MB 1 41 THR HB . . 4.570 4.286 3.908 4.579 0.009 9 0 "[ . 1]" 1
612 1 24 GLY HA2 1 25 MET H . . 3.000 2.841 2.782 2.880 . 0 0 "[ . 1]" 1
613 1 24 GLY HA2 1 25 MET HB2 . . 4.930 4.310 4.215 4.428 . 0 0 "[ . 1]" 1
614 1 24 GLY HA2 1 39 MET HB2 . . 5.500 5.582 5.365 5.860 0.360 10 0 "[ . 1]" 1
615 1 24 GLY HA3 1 25 MET H . . 2.780 2.222 2.192 2.247 . 0 0 "[ . 1]" 1
616 1 25 MET H 1 25 MET HB2 . . 2.950 2.708 2.665 2.753 . 0 0 "[ . 1]" 1
617 1 25 MET H 1 25 MET HB3 . . 3.780 3.719 3.678 3.778 . 0 0 "[ . 1]" 1
618 1 25 MET H 1 25 MET HG2 . . 4.970 4.566 4.380 4.621 . 0 0 "[ . 1]" 1
619 1 25 MET H 1 25 MET HG3 . . 4.330 3.762 3.608 3.877 . 0 0 "[ . 1]" 1
620 1 25 MET H 1 26 THR H . . 4.540 4.355 4.336 4.380 . 0 0 "[ . 1]" 1
621 1 25 MET H 1 26 THR MG . . 5.500 5.215 5.144 5.347 . 0 0 "[ . 1]" 1
622 1 25 MET H 1 39 MET HB2 . . 4.330 4.156 3.954 4.376 0.046 10 0 "[ . 1]" 1
623 1 25 MET HA 1 25 MET HG2 . . 4.120 2.440 2.386 2.534 . 0 0 "[ . 1]" 1
624 1 25 MET HA 1 25 MET HG3 . . 4.010 2.739 2.694 2.951 . 0 0 "[ . 1]" 1
625 1 25 MET HA 1 26 THR H . . 2.580 2.255 2.224 2.296 . 0 0 "[ . 1]" 1
626 1 25 MET HA 1 26 THR MG . . 4.250 3.456 3.378 3.559 . 0 0 "[ . 1]" 1
627 1 25 MET HA 1 37 TYR H . . 5.500 5.243 5.091 5.371 . 0 0 "[ . 1]" 1
628 1 25 MET HA 1 38 LEU H . . 5.500 5.180 4.846 5.401 . 0 0 "[ . 1]" 1
629 1 25 MET HA 1 38 LEU HA . . 3.430 2.715 2.037 3.042 . 0 0 "[ . 1]" 1
630 1 25 MET HA 1 38 LEU QD . . 5.440 4.767 4.542 4.875 . 0 0 "[ . 1]" 1
631 1 25 MET HA 1 39 MET H . . 3.390 2.395 2.323 2.498 . 0 0 "[ . 1]" 1
632 1 25 MET HA 1 39 MET HB2 . . 4.920 2.694 2.293 3.254 . 0 0 "[ . 1]" 1
633 1 25 MET HA 1 39 MET HG3 . . 5.280 4.763 4.409 5.188 . 0 0 "[ . 1]" 1
634 1 25 MET HB2 1 26 THR H . . 4.650 4.012 3.948 4.067 . 0 0 "[ . 1]" 1
635 1 25 MET HB3 1 26 THR H . . 3.210 2.733 2.655 2.814 . 0 0 "[ . 1]" 1
636 1 25 MET HB3 1 26 THR MG . . 4.760 4.570 4.504 4.664 . 0 0 "[ . 1]" 1
637 1 25 MET HB3 1 27 THR HA . . 5.500 5.472 5.349 5.554 0.054 5 0 "[ . 1]" 1
638 1 25 MET HB3 1 37 TYR H . . 4.630 4.054 3.852 4.234 . 0 0 "[ . 1]" 1
639 1 25 MET HB3 1 38 LEU HA . . 5.040 3.933 3.419 4.273 . 0 0 "[ . 1]" 1
640 1 25 MET HG2 1 26 THR H . . 4.850 3.440 3.271 3.678 . 0 0 "[ . 1]" 1
641 1 25 MET HG2 1 38 LEU HA . . 4.440 2.020 1.925 2.249 . 0 0 "[ . 1]" 1
642 1 25 MET HG2 1 38 LEU QD . . 5.440 4.315 4.096 4.519 . 0 0 "[ . 1]" 1
643 1 25 MET HG2 1 38 LEU HG . . 5.260 4.467 4.147 5.283 0.023 10 0 "[ . 1]" 1
644 1 25 MET HG2 1 52 VAL MG1 . . 4.790 4.051 3.798 4.308 . 0 0 "[ . 1]" 1
645 1 25 MET HG3 1 26 THR H . . 4.400 4.499 4.425 4.743 0.343 3 0 "[ . 1]" 1
646 1 25 MET HG3 1 38 LEU HA . . 4.920 3.232 3.113 3.514 . 0 0 "[ . 1]" 1
647 1 25 MET HG3 1 38 LEU QD . . 4.810 4.681 4.503 4.825 0.015 10 0 "[ . 1]" 1
648 1 25 MET HG3 1 52 VAL MG1 . . 5.500 5.097 4.825 5.365 . 0 0 "[ . 1]" 1
649 1 26 THR H 1 26 THR HB . . 3.600 3.273 3.201 3.319 . 0 0 "[ . 1]" 1
650 1 26 THR H 1 26 THR MG . . 2.970 2.203 2.160 2.267 . 0 0 "[ . 1]" 1
651 1 26 THR H 1 27 THR HA . . 5.000 4.677 4.619 4.705 . 0 0 "[ . 1]" 1
652 1 26 THR H 1 37 TYR H . . 3.900 3.504 3.385 3.646 . 0 0 "[ . 1]" 1
653 1 26 THR H 1 37 TYR HA . . 5.080 4.908 4.822 4.981 . 0 0 "[ . 1]" 1
654 1 26 THR H 1 37 TYR HB2 . . 4.690 3.815 3.698 3.955 . 0 0 "[ . 1]" 1
655 1 26 THR H 1 37 TYR HB3 . . 4.930 4.579 4.446 4.694 . 0 0 "[ . 1]" 1
656 1 26 THR H 1 38 LEU HA . . 3.650 3.455 2.789 3.682 0.032 8 0 "[ . 1]" 1
657 1 26 THR H 1 39 MET H . . 4.320 3.778 3.694 3.895 . 0 0 "[ . 1]" 1
658 1 26 THR H 1 39 MET HB2 . . 4.280 3.292 2.921 4.119 . 0 0 "[ . 1]" 1
659 1 26 THR H 1 39 MET HG3 . . 5.370 4.343 3.955 4.708 . 0 0 "[ . 1]" 1
660 1 26 THR HA 1 26 THR MG . . 3.710 3.214 3.209 3.222 . 0 0 "[ . 1]" 1
661 1 26 THR HB 1 39 MET HB2 . . 3.760 3.311 2.906 3.774 0.014 9 0 "[ . 1]" 1
662 1 26 THR MG 1 27 THR H . . 4.490 3.935 3.800 4.042 . 0 0 "[ . 1]" 1
663 1 26 THR MG 1 27 THR HA . . 4.960 4.134 3.993 4.243 . 0 0 "[ . 1]" 1
664 1 26 THR MG 1 28 LEU H . . 4.820 4.602 4.484 4.804 . 0 0 "[ . 1]" 1
665 1 26 THR MG 1 28 LEU MD1 . . 3.600 3.222 2.991 3.520 . 0 0 "[ . 1]" 1
666 1 26 THR MG 1 28 LEU QD . . 3.000 2.630 2.497 2.758 . 0 0 "[ . 1]" 1
667 1 26 THR MG 1 28 LEU MD2 . . 3.600 2.798 2.628 3.083 . 0 0 "[ . 1]" 1
668 1 26 THR MG 1 37 TYR H . . 4.460 3.857 3.783 3.997 . 0 0 "[ . 1]" 1
669 1 26 THR MG 1 37 TYR HA . . 4.610 4.640 4.597 4.680 0.070 7 0 "[ . 1]" 1
670 1 26 THR MG 1 37 TYR HB2 . . 3.660 2.443 2.388 2.547 . 0 0 "[ . 1]" 1
671 1 26 THR MG 1 37 TYR HB3 . . 3.500 3.245 3.190 3.332 . 0 0 "[ . 1]" 1
672 1 26 THR MG 1 37 TYR QD . . 4.340 4.117 3.985 4.237 . 0 0 "[ . 1]" 1
673 1 26 THR MG 1 38 LEU QD . . 4.640 4.583 4.336 4.674 0.034 4 0 "[ . 1]" 1
674 1 26 THR MG 1 39 MET H . . 3.810 3.734 3.461 3.856 0.046 4 0 "[ . 1]" 1
675 1 26 THR MG 1 39 MET HB2 . . 3.280 2.554 2.277 3.344 0.064 9 0 "[ . 1]" 1
676 1 26 THR MG 1 39 MET HG2 . . 3.400 3.445 3.166 3.514 0.114 7 0 "[ . 1]" 1
677 1 26 THR MG 1 39 MET HG3 . . 3.470 2.003 1.879 2.054 . 0 0 "[ . 1]" 1
678 1 26 THR MG 1 49 TYR HB2 . . 5.220 4.801 4.638 4.945 . 0 0 "[ . 1]" 1
679 1 26 THR MG 1 49 TYR QD . . 3.360 1.977 1.833 2.212 . 0 0 "[ . 1]" 1
680 1 26 THR MG 1 49 TYR QE . . 3.630 2.197 1.989 2.543 . 0 0 "[ . 1]" 1
681 1 27 THR H 1 27 THR HB . . 4.090 3.208 2.750 3.578 . 0 0 "[ . 1]" 1
682 1 27 THR H 1 27 THR MG . . 4.710 3.484 3.123 3.813 . 0 0 "[ . 1]" 1
683 1 27 THR HA 1 27 THR MG . . 2.950 2.167 2.135 2.222 . 0 0 "[ . 1]" 1
684 1 27 THR HA 1 28 LEU H . . 2.650 2.165 2.124 2.190 . 0 0 "[ . 1]" 1
685 1 27 THR HA 1 35 GLY H . . 5.400 4.919 4.645 5.250 . 0 0 "[ . 1]" 1
686 1 27 THR HA 1 36 GLU HA . . 3.350 2.548 2.340 2.868 . 0 0 "[ . 1]" 1
687 1 27 THR HA 1 36 GLU QB . . 4.870 4.424 4.164 4.753 . 0 0 "[ . 1]" 1
688 1 27 THR HA 1 36 GLU QG . . 5.340 4.177 3.806 4.614 . 0 0 "[ . 1]" 1
689 1 27 THR HA 1 37 TYR H . . 3.550 2.702 2.437 2.860 . 0 0 "[ . 1]" 1
690 1 27 THR HA 1 37 TYR QD . . 3.930 2.889 2.645 3.155 . 0 0 "[ . 1]" 1
691 1 27 THR HA 1 37 TYR QE . . 4.950 4.719 4.469 5.003 0.053 9 0 "[ . 1]" 1
692 1 27 THR HB 1 28 LEU H . . 3.800 3.569 3.214 3.851 0.051 3 0 "[ . 1]" 1
693 1 27 THR HB 1 35 GLY H . . 5.500 5.274 4.475 5.591 0.091 9 0 "[ . 1]" 1
694 1 27 THR MG 1 28 LEU H . . 3.360 3.051 2.497 3.434 0.074 7 0 "[ . 1]" 1
695 1 27 THR MG 1 28 LEU HA . . 5.360 4.858 4.140 5.344 . 0 0 "[ . 1]" 1
696 1 27 THR MG 1 35 GLY HA2 . . 5.400 3.803 3.399 4.420 . 0 0 "[ . 1]" 1
697 1 27 THR MG 1 35 GLY HA3 . . 5.400 4.568 4.170 4.995 . 0 0 "[ . 1]" 1
698 1 27 THR MG 1 36 GLU H . . 4.610 3.825 3.540 4.114 . 0 0 "[ . 1]" 1
699 1 27 THR MG 1 36 GLU HA . . 3.360 2.102 2.001 2.268 . 0 0 "[ . 1]" 1
700 1 27 THR MG 1 36 GLU QB . . 4.470 3.481 3.160 3.866 . 0 0 "[ . 1]" 1
701 1 27 THR MG 1 36 GLU HG2 . . 4.040 2.582 2.076 3.588 . 0 0 "[ . 1]" 1
702 1 27 THR MG 1 36 GLU QG . . 3.320 2.365 2.043 2.728 . 0 0 "[ . 1]" 1
703 1 27 THR MG 1 36 GLU HG3 . . 4.040 3.124 2.203 3.707 . 0 0 "[ . 1]" 1
704 1 27 THR MG 1 37 TYR H . . 3.540 3.481 3.215 3.670 0.130 3 0 "[ . 1]" 1
705 1 27 THR MG 1 37 TYR HB2 . . 5.090 5.039 4.711 5.127 0.037 9 0 "[ . 1]" 1
706 1 27 THR MG 1 37 TYR QD . . 4.710 3.812 3.654 3.926 . 0 0 "[ . 1]" 1
707 1 27 THR MG 1 37 TYR QE . . 4.790 4.687 4.374 4.835 0.045 4 0 "[ . 1]" 1
708 1 28 LEU H 1 28 LEU HB2 . . 3.400 2.596 2.544 2.694 . 0 0 "[ . 1]" 1
709 1 28 LEU H 1 28 LEU MD1 . . 4.740 4.055 4.000 4.153 . 0 0 "[ . 1]" 1
710 1 28 LEU H 1 28 LEU QD . . 4.050 3.384 3.324 3.496 . 0 0 "[ . 1]" 1
711 1 28 LEU H 1 28 LEU MD2 . . 4.740 3.625 3.554 3.761 . 0 0 "[ . 1]" 1
712 1 28 LEU H 1 28 LEU HG . . 3.630 2.908 2.802 3.072 . 0 0 "[ . 1]" 1
713 1 28 LEU H 1 29 GLU H . . 5.230 4.343 4.162 4.450 . 0 0 "[ . 1]" 1
714 1 28 LEU H 1 34 THR HA . . 5.450 5.125 4.889 5.414 . 0 0 "[ . 1]" 1
715 1 28 LEU H 1 35 GLY H . . 3.930 3.499 3.123 3.779 . 0 0 "[ . 1]" 1
716 1 28 LEU H 1 35 GLY QA . . 5.340 4.588 4.143 4.826 . 0 0 "[ . 1]" 1
717 1 28 LEU H 1 36 GLU HA . . 4.040 3.679 3.394 3.956 . 0 0 "[ . 1]" 1
718 1 28 LEU H 1 37 TYR H . . 4.630 3.916 3.698 4.050 . 0 0 "[ . 1]" 1
719 1 28 LEU H 1 37 TYR QD . . 3.390 2.085 1.854 2.472 . 0 0 "[ . 1]" 1
720 1 28 LEU H 1 37 TYR QE . . 3.470 3.093 2.775 3.471 0.001 3 0 "[ . 1]" 1
721 1 28 LEU HA 1 28 LEU MD1 . . 4.060 3.847 3.809 3.874 . 0 0 "[ . 1]" 1
722 1 28 LEU HA 1 28 LEU QD . . 2.930 2.037 1.970 2.074 . 0 0 "[ . 1]" 1
723 1 28 LEU HA 1 28 LEU MD2 . . 4.060 2.045 1.976 2.083 . 0 0 "[ . 1]" 1
724 1 28 LEU HB2 1 28 LEU QD . . 2.900 2.303 2.284 2.325 . 0 0 "[ . 1]" 1
725 1 28 LEU HB2 1 35 GLY H . . 4.550 4.254 3.714 4.584 0.034 4 0 "[ . 1]" 1
726 1 28 LEU HB2 1 37 TYR QD . . 4.600 2.847 2.620 2.990 . 0 0 "[ . 1]" 1
727 1 28 LEU HB2 1 37 TYR QE . . 3.860 2.678 2.413 2.795 . 0 0 "[ . 1]" 1
728 1 28 LEU HB3 1 28 LEU MD1 . . 3.530 2.343 2.330 2.365 . 0 0 "[ . 1]" 1
729 1 28 LEU HB3 1 28 LEU MD2 . . 3.530 2.409 2.389 2.435 . 0 0 "[ . 1]" 1
730 1 28 LEU HB3 1 29 GLU H . . 4.370 3.233 2.771 3.669 . 0 0 "[ . 1]" 1
731 1 28 LEU HB3 1 37 TYR QD . . 4.900 4.397 4.234 4.535 . 0 0 "[ . 1]" 1
732 1 28 LEU HB3 1 37 TYR QE . . 4.220 4.161 3.968 4.230 0.010 3 0 "[ . 1]" 1
733 1 28 LEU QD 1 29 GLU H . . 4.720 3.528 3.383 3.743 . 0 0 "[ . 1]" 1
734 1 28 LEU QD 1 37 TYR HB2 . . 3.900 3.019 2.847 3.193 . 0 0 "[ . 1]" 1
735 1 28 LEU QD 1 37 TYR HB3 . . 4.710 3.211 2.980 3.427 . 0 0 "[ . 1]" 1
736 1 28 LEU QD 1 37 TYR QD . . 3.640 2.910 2.758 3.102 . 0 0 "[ . 1]" 1
737 1 28 LEU QD 1 37 TYR QE . . 3.800 3.359 3.023 3.558 . 0 0 "[ . 1]" 1
738 1 28 LEU QD 1 49 TYR HB2 . . 4.410 3.029 2.651 3.177 . 0 0 "[ . 1]" 1
739 1 28 LEU QD 1 49 TYR HB3 . . 4.130 2.334 2.114 2.586 . 0 0 "[ . 1]" 1
740 1 28 LEU QD 1 49 TYR QD . . 3.640 2.773 2.403 3.073 . 0 0 "[ . 1]" 1
741 1 28 LEU QD 1 49 TYR QE . . 3.960 3.261 2.699 3.589 . 0 0 "[ . 1]" 1
742 1 28 LEU MD1 1 37 TYR HB2 . . 4.630 3.138 2.935 3.330 . 0 0 "[ . 1]" 1
743 1 28 LEU MD1 1 37 TYR QD . . 4.440 2.965 2.790 3.204 . 0 0 "[ . 1]" 1
744 1 28 LEU MD1 1 49 TYR QD . . 4.190 2.920 2.559 3.239 . 0 0 "[ . 1]" 1
745 1 28 LEU MD1 1 49 TYR QE . . 4.580 3.967 3.512 4.111 . 0 0 "[ . 1]" 1
746 1 28 LEU MD2 1 37 TYR HB2 . . 4.630 3.948 3.774 4.216 . 0 0 "[ . 1]" 1
747 1 28 LEU MD2 1 37 TYR QD . . 4.440 4.286 4.136 4.403 . 0 0 "[ . 1]" 1
748 1 28 LEU MD2 1 49 TYR QD . . 4.190 3.480 2.912 3.984 . 0 0 "[ . 1]" 1
749 1 28 LEU MD2 1 49 TYR QE . . 4.580 3.490 2.805 4.014 . 0 0 "[ . 1]" 1
750 1 28 LEU HG 1 37 TYR HB2 . . 4.940 2.503 2.294 2.716 . 0 0 "[ . 1]" 1
751 1 28 LEU HG 1 37 TYR QD . . 4.670 2.993 2.708 3.160 . 0 0 "[ . 1]" 1
752 1 28 LEU HG 1 37 TYR QE . . 4.400 4.313 4.102 4.435 0.035 1 0 "[ . 1]" 1
753 1 28 LEU HG 1 49 TYR HB2 . . 5.500 5.452 5.016 5.549 0.049 2 0 "[ . 1]" 1
754 1 29 GLU HA 1 30 ALA H . . 3.540 2.167 2.113 2.242 . 0 0 "[ . 1]" 1
755 1 29 GLU HA 1 30 ALA MB . . 4.370 3.997 3.873 4.071 . 0 0 "[ . 1]" 1
756 1 29 GLU HA 1 34 THR HA . . 3.610 2.681 2.321 2.991 . 0 0 "[ . 1]" 1
757 1 29 GLU HA 1 34 THR MG . . 4.040 1.965 1.870 2.030 . 0 0 "[ . 1]" 1
758 1 29 GLU HA 1 35 GLY H . . 3.820 3.637 3.368 3.889 0.069 6 0 "[ . 1]" 1
759 1 29 GLU QB 1 30 ALA H . . 4.400 3.472 2.690 3.984 . 0 0 "[ . 1]" 1
760 1 29 GLU QB 1 34 THR MG . . 3.660 2.700 2.291 3.471 . 0 0 "[ . 1]" 1
761 1 29 GLU QG 1 34 THR HA . . 4.600 4.192 3.656 4.584 . 0 0 "[ . 1]" 1
762 1 29 GLU QG 1 34 THR MG . . 3.530 2.606 2.011 2.998 . 0 0 "[ . 1]" 1
763 1 29 GLU HG2 1 34 THR MG . . 4.100 2.909 2.374 3.960 . 0 0 "[ . 1]" 1
764 1 29 GLU HG3 1 34 THR MG . . 4.100 3.521 2.047 4.150 0.050 10 0 "[ . 1]" 1
765 1 30 ALA H 1 30 ALA MB . . 3.600 2.375 2.242 2.559 . 0 0 "[ . 1]" 1
766 1 30 ALA H 1 33 ILE H . . 4.110 4.158 4.110 4.203 0.093 4 0 "[ . 1]" 1
767 1 30 ALA H 1 34 THR H . . 5.020 4.593 4.418 4.750 . 0 0 "[ . 1]" 1
768 1 30 ALA H 1 34 THR HA . . 4.180 2.657 2.253 2.979 . 0 0 "[ . 1]" 1
769 1 30 ALA H 1 34 THR MG . . 4.910 2.012 1.751 2.249 . 0 0 "[ . 1]" 1
770 1 30 ALA H 1 35 GLY H . . 5.320 4.535 4.007 4.973 . 0 0 "[ . 1]" 1
771 1 30 ALA HA 1 31 GLY QA . . 4.800 3.928 3.906 3.962 . 0 0 "[ . 1]" 1
772 1 30 ALA HA 1 34 THR MG . . 4.530 4.253 4.085 4.428 . 0 0 "[ . 1]" 1
773 1 30 ALA MB 1 31 GLY QA . . 4.010 3.787 3.691 4.053 0.043 7 0 "[ . 1]" 1
774 1 30 ALA MB 1 33 ILE H . . 4.580 2.730 2.403 3.777 . 0 0 "[ . 1]" 1
775 1 30 ALA MB 1 33 ILE MD . . 4.650 4.215 2.995 4.707 0.057 5 0 "[ . 1]" 1
776 1 30 ALA MB 1 33 ILE MG . . 4.180 3.795 3.546 4.143 . 0 0 "[ . 1]" 1
777 1 30 ALA MB 1 34 THR HB . . 5.310 5.421 5.352 5.468 0.158 10 0 "[ . 1]" 1
778 1 30 ALA MB 1 34 THR MG . . 3.710 3.565 3.448 3.786 0.076 3 0 "[ . 1]" 1
779 1 30 ALA MB 1 37 TYR QE . . 5.440 4.784 4.164 5.327 . 0 0 "[ . 1]" 1
780 1 31 GLY QA 1 33 ILE H . . 4.310 4.077 3.292 4.342 0.032 8 0 "[ . 1]" 1
781 1 31 GLY QA 1 34 THR MG . . 4.750 4.390 4.182 4.710 . 0 0 "[ . 1]" 1
782 1 32 GLY H 1 34 THR MG . . 5.080 3.508 2.972 5.052 . 0 0 "[ . 1]" 1
783 1 32 GLY QA 1 33 ILE MG . . 5.340 5.098 5.045 5.221 . 0 0 "[ . 1]" 1
784 1 33 ILE H 1 33 ILE HB . . 2.940 2.683 2.585 2.786 . 0 0 "[ . 1]" 1
785 1 33 ILE H 1 33 ILE MD . . 4.670 3.342 1.985 4.146 . 0 0 "[ . 1]" 1
786 1 33 ILE H 1 33 ILE HG12 . . 4.120 3.767 2.533 4.184 0.064 7 0 "[ . 1]" 1
787 1 33 ILE H 1 33 ILE QG . . 3.330 2.899 2.505 3.347 0.017 7 0 "[ . 1]" 1
788 1 33 ILE H 1 33 ILE HG13 . . 4.120 3.258 2.755 4.131 0.011 5 0 "[ . 1]" 1
789 1 33 ILE H 1 33 ILE MG . . 3.950 3.867 3.817 3.910 . 0 0 "[ . 1]" 1
790 1 33 ILE HA 1 33 ILE MD . . 3.880 3.338 2.048 3.865 . 0 0 "[ . 1]" 1
791 1 33 ILE HA 1 33 ILE HG12 . . 4.040 3.000 2.481 3.653 . 0 0 "[ . 1]" 1
792 1 33 ILE HA 1 33 ILE QG . . 3.510 2.553 2.370 3.001 . 0 0 "[ . 1]" 1
793 1 33 ILE HA 1 33 ILE HG13 . . 4.040 3.028 2.453 3.770 . 0 0 "[ . 1]" 1
794 1 33 ILE HA 1 33 ILE MG . . 3.080 2.366 2.295 2.434 . 0 0 "[ . 1]" 1
795 1 33 ILE HA 1 34 THR H . . 3.340 2.151 2.135 2.169 . 0 0 "[ . 1]" 1
796 1 33 ILE HB 1 33 ILE MD . . 3.230 2.550 2.283 3.235 0.005 10 0 "[ . 1]" 1
797 1 33 ILE QG 1 33 ILE MG . . 2.730 2.245 2.075 2.351 . 0 0 "[ . 1]" 1
798 1 33 ILE HG12 1 33 ILE MG . . 3.380 2.489 2.172 3.203 . 0 0 "[ . 1]" 1
799 1 33 ILE HG13 1 33 ILE MG . . 3.380 2.855 2.348 3.206 . 0 0 "[ . 1]" 1
800 1 33 ILE MG 1 34 THR H . . 4.140 3.042 2.789 3.164 . 0 0 "[ . 1]" 1
801 1 33 ILE MG 1 34 THR HA . . 5.130 3.683 3.503 3.831 . 0 0 "[ . 1]" 1
802 1 34 THR H 1 34 THR HB . . 3.960 3.770 3.732 3.789 . 0 0 "[ . 1]" 1
803 1 34 THR H 1 34 THR MG . . 3.480 2.751 2.542 2.836 . 0 0 "[ . 1]" 1
804 1 34 THR HA 1 34 THR MG . . 3.040 2.377 2.336 2.422 . 0 0 "[ . 1]" 1
805 1 34 THR HA 1 35 GLY H . . 2.540 2.301 2.192 2.404 . 0 0 "[ . 1]" 1
806 1 34 THR HB 1 35 GLY H . . 3.440 2.905 2.600 3.304 . 0 0 "[ . 1]" 1
807 1 34 THR HB 1 35 GLY QA . . 4.760 4.057 3.812 4.379 . 0 0 "[ . 1]" 1
808 1 35 GLY H 1 36 GLU H . . 4.510 4.359 4.237 4.428 . 0 0 "[ . 1]" 1
809 1 35 GLY H 1 37 TYR QE . . 3.510 2.615 2.258 3.111 . 0 0 "[ . 1]" 1
810 1 35 GLY QA 1 36 GLU H . . 2.420 2.216 2.144 2.259 . 0 0 "[ . 1]" 1
811 1 35 GLY QA 1 36 GLU QB . . 4.740 4.132 4.100 4.188 . 0 0 "[ . 1]" 1
812 1 35 GLY QA 1 36 GLU QG . . 4.880 3.550 3.356 4.298 . 0 0 "[ . 1]" 1
813 1 35 GLY QA 1 37 TYR QE . . 3.800 3.200 2.509 3.640 . 0 0 "[ . 1]" 1
814 1 35 GLY QA 1 52 VAL MG2 . . 4.740 4.110 3.774 4.271 . 0 0 "[ . 1]" 1
815 1 35 GLY HA2 1 36 GLU H . . 2.770 2.627 2.302 2.836 0.066 6 0 "[ . 1]" 1
816 1 35 GLY HA2 1 37 TYR QE . . 4.670 4.326 4.060 4.541 . 0 0 "[ . 1]" 1
817 1 35 GLY HA3 1 36 GLU H . . 2.770 2.444 2.219 2.782 0.012 3 0 "[ . 1]" 1
818 1 35 GLY HA3 1 37 TYR QE . . 4.670 3.310 2.533 3.832 . 0 0 "[ . 1]" 1
819 1 36 GLU H 1 36 GLU QB . . 2.740 2.395 2.350 2.466 . 0 0 "[ . 1]" 1
820 1 36 GLU H 1 36 GLU HG2 . . 4.310 3.736 3.548 4.156 . 0 0 "[ . 1]" 1
821 1 36 GLU H 1 36 GLU QG . . 3.580 2.577 2.403 3.510 . 0 0 "[ . 1]" 1
822 1 36 GLU H 1 36 GLU HG3 . . 4.310 2.640 2.438 3.784 . 0 0 "[ . 1]" 1
823 1 36 GLU H 1 37 TYR H . . 4.810 4.530 4.497 4.553 . 0 0 "[ . 1]" 1
824 1 36 GLU H 1 52 VAL H . . 5.130 4.652 4.032 4.914 . 0 0 "[ . 1]" 1
825 1 36 GLU H 1 52 VAL MG1 . . 4.660 4.107 3.894 4.350 . 0 0 "[ . 1]" 1
826 1 36 GLU H 1 52 VAL MG2 . . 3.690 3.034 2.552 3.210 . 0 0 "[ . 1]" 1
827 1 36 GLU HA 1 36 GLU HG2 . . 4.190 2.682 2.488 3.677 . 0 0 "[ . 1]" 1
828 1 36 GLU HA 1 36 GLU HG3 . . 4.190 2.997 2.454 3.205 . 0 0 "[ . 1]" 1
829 1 36 GLU HA 1 37 TYR H . . 2.570 2.190 2.145 2.240 . 0 0 "[ . 1]" 1
830 1 36 GLU HA 1 37 TYR QD . . 3.940 3.153 2.957 3.441 . 0 0 "[ . 1]" 1
831 1 36 GLU HA 1 52 VAL MG2 . . 4.540 4.447 4.059 4.584 0.044 2 0 "[ . 1]" 1
832 1 36 GLU QB 1 37 TYR H . . 3.290 2.955 2.754 3.160 . 0 0 "[ . 1]" 1
833 1 36 GLU QB 1 37 TYR QD . . 4.970 4.552 4.353 4.754 . 0 0 "[ . 1]" 1
834 1 36 GLU QB 1 37 TYR QE . . 5.500 5.605 5.561 5.632 0.132 10 0 "[ . 1]" 1
835 1 36 GLU QB 1 52 VAL MG1 . . 3.400 2.272 2.007 2.534 . 0 0 "[ . 1]" 1
836 1 36 GLU QB 1 52 VAL MG2 . . 2.860 2.304 1.915 2.686 . 0 0 "[ . 1]" 1
837 1 36 GLU QG 1 37 TYR H . . 4.160 4.031 3.879 4.158 . 0 0 "[ . 1]" 1
838 1 36 GLU QG 1 52 VAL MG1 . . 4.430 4.022 3.725 4.339 . 0 0 "[ . 1]" 1
839 1 36 GLU HG2 1 52 VAL MG1 . . 5.050 4.537 4.177 5.010 . 0 0 "[ . 1]" 1
840 1 36 GLU HG2 1 52 VAL MG2 . . 5.500 4.781 4.314 5.179 . 0 0 "[ . 1]" 1
841 1 36 GLU HG3 1 52 VAL MG1 . . 5.050 4.516 4.113 4.835 . 0 0 "[ . 1]" 1
842 1 36 GLU HG3 1 52 VAL MG2 . . 5.500 4.094 3.389 5.218 . 0 0 "[ . 1]" 1
843 1 37 TYR H 1 37 TYR HB2 . . 3.610 2.682 2.610 2.758 . 0 0 "[ . 1]" 1
844 1 37 TYR H 1 37 TYR HB3 . . 4.040 3.799 3.758 3.845 . 0 0 "[ . 1]" 1
845 1 37 TYR H 1 37 TYR QD . . 3.350 2.844 2.687 2.969 . 0 0 "[ . 1]" 1
846 1 37 TYR H 1 37 TYR QE . . 5.220 4.997 4.935 5.090 . 0 0 "[ . 1]" 1
847 1 37 TYR H 1 38 LEU H . . 4.540 4.350 4.308 4.418 . 0 0 "[ . 1]" 1
848 1 37 TYR H 1 51 PRO HA . . 5.500 5.201 4.558 5.443 . 0 0 "[ . 1]" 1
849 1 37 TYR H 1 52 VAL MG1 . . 4.520 3.847 3.764 3.942 . 0 0 "[ . 1]" 1
850 1 37 TYR H 1 52 VAL MG2 . . 5.010 4.871 4.671 4.984 . 0 0 "[ . 1]" 1
851 1 37 TYR HA 1 37 TYR QD . . 3.780 3.093 3.005 3.157 . 0 0 "[ . 1]" 1
852 1 37 TYR HA 1 38 LEU H . . 2.670 2.153 2.084 2.341 . 0 0 "[ . 1]" 1
853 1 37 TYR HA 1 38 LEU MD1 . . 5.500 5.637 5.290 5.744 0.244 8 0 "[ . 1]" 1
854 1 37 TYR HA 1 38 LEU MD2 . . 5.500 5.306 4.919 5.469 . 0 0 "[ . 1]" 1
855 1 37 TYR HA 1 51 PRO HA . . 3.480 2.620 2.100 2.837 . 0 0 "[ . 1]" 1
856 1 37 TYR HA 1 51 PRO HB2 . . 5.500 5.279 4.758 5.500 . 0 0 "[ . 1]" 1
857 1 37 TYR HA 1 51 PRO HB3 . . 5.270 4.791 4.257 5.030 . 0 0 "[ . 1]" 1
858 1 37 TYR HA 1 52 VAL H . . 3.470 3.081 2.846 3.242 . 0 0 "[ . 1]" 1
859 1 37 TYR HA 1 52 VAL HA . . 4.770 4.658 4.520 4.769 . 0 0 "[ . 1]" 1
860 1 37 TYR HA 1 52 VAL MG1 . . 3.760 2.805 2.608 3.138 . 0 0 "[ . 1]" 1
861 1 37 TYR HA 1 52 VAL MG2 . . 4.780 4.017 3.881 4.209 . 0 0 "[ . 1]" 1
862 1 37 TYR HB2 1 38 LEU H . . 3.950 3.904 3.771 3.974 0.024 2 0 "[ . 1]" 1
863 1 37 TYR HB2 1 49 TYR HB3 . . 4.330 3.729 3.570 4.026 . 0 0 "[ . 1]" 1
864 1 37 TYR HB2 1 50 VAL H . . 5.200 4.840 4.558 5.007 . 0 0 "[ . 1]" 1
865 1 37 TYR HB3 1 38 LEU H . . 3.690 2.754 2.546 2.880 . 0 0 "[ . 1]" 1
866 1 37 TYR HB3 1 49 TYR HB3 . . 4.630 2.805 2.633 3.036 . 0 0 "[ . 1]" 1
867 1 37 TYR HB3 1 50 VAL H . . 4.300 3.215 2.970 3.379 . 0 0 "[ . 1]" 1
868 1 37 TYR QD 1 38 LEU H . . 4.200 3.866 3.761 4.002 . 0 0 "[ . 1]" 1
869 1 37 TYR QD 1 49 TYR HA . . 5.260 4.613 4.049 4.869 . 0 0 "[ . 1]" 1
870 1 37 TYR QD 1 49 TYR HB2 . . 4.640 4.169 3.475 4.501 . 0 0 "[ . 1]" 1
871 1 37 TYR QD 1 49 TYR HB3 . . 3.940 3.311 2.618 3.586 . 0 0 "[ . 1]" 1
872 1 37 TYR QD 1 50 VAL H . . 4.230 3.868 3.545 4.186 . 0 0 "[ . 1]" 1
873 1 37 TYR QD 1 51 PRO HA . . 3.690 2.663 2.404 3.178 . 0 0 "[ . 1]" 1
874 1 37 TYR QD 1 51 PRO HB2 . . 4.780 4.636 4.360 4.814 0.034 3 0 "[ . 1]" 1
875 1 37 TYR QD 1 51 PRO HB3 . . 4.800 3.349 3.024 3.558 . 0 0 "[ . 1]" 1
876 1 37 TYR QD 1 51 PRO QG . . 4.610 4.195 4.023 4.301 . 0 0 "[ . 1]" 1
877 1 37 TYR QD 1 52 VAL H . . 4.380 4.413 4.328 4.470 0.090 3 0 "[ . 1]" 1
878 1 37 TYR QE 1 51 PRO HA . . 4.230 3.414 3.232 3.911 . 0 0 "[ . 1]" 1
879 1 37 TYR QE 1 51 PRO HB3 . . 4.290 2.404 2.117 2.915 . 0 0 "[ . 1]" 1
880 1 37 TYR QE 1 51 PRO QD . . 4.330 3.119 2.701 3.398 . 0 0 "[ . 1]" 1
881 1 37 TYR QE 1 51 PRO QG . . 3.840 3.427 3.213 3.604 . 0 0 "[ . 1]" 1
882 1 38 LEU H 1 38 LEU QB . . 2.930 2.172 2.004 2.776 . 0 0 "[ . 1]" 1
883 1 38 LEU H 1 38 LEU QD . . 3.340 3.332 3.053 3.452 0.112 7 0 "[ . 1]" 1
884 1 38 LEU H 1 38 LEU HG . . 4.630 3.993 2.155 4.455 . 0 0 "[ . 1]" 1
885 1 38 LEU H 1 39 MET H . . 4.580 4.548 4.521 4.571 . 0 0 "[ . 1]" 1
886 1 38 LEU H 1 49 TYR HB3 . . 5.230 4.908 4.760 5.134 . 0 0 "[ . 1]" 1
887 1 38 LEU H 1 49 TYR QD . . 5.500 5.483 5.217 5.571 0.071 4 0 "[ . 1]" 1
888 1 38 LEU H 1 50 VAL H . . 3.560 2.792 2.547 2.878 . 0 0 "[ . 1]" 1
889 1 38 LEU H 1 50 VAL HB . . 3.880 3.545 3.516 3.626 . 0 0 "[ . 1]" 1
890 1 38 LEU H 1 50 VAL MG1 . . 4.450 3.991 3.526 4.176 . 0 0 "[ . 1]" 1
891 1 38 LEU H 1 51 PRO HA . . 4.230 3.753 3.521 3.965 . 0 0 "[ . 1]" 1
892 1 38 LEU H 1 52 VAL H . . 5.140 4.391 4.119 4.822 . 0 0 "[ . 1]" 1
893 1 38 LEU H 1 52 VAL MG1 . . 4.520 3.619 3.293 4.283 . 0 0 "[ . 1]" 1
894 1 38 LEU HA 1 38 LEU HG . . 4.080 3.000 2.756 3.771 . 0 0 "[ . 1]" 1
895 1 38 LEU HA 1 39 MET H . . 2.670 2.235 2.199 2.304 . 0 0 "[ . 1]" 1
896 1 38 LEU QB 1 38 LEU MD1 . . 3.000 2.067 2.013 2.246 . 0 0 "[ . 1]" 1
897 1 38 LEU QB 1 38 LEU QD . . 2.620 1.876 1.820 1.908 . 0 0 "[ . 1]" 1
898 1 38 LEU QB 1 38 LEU MD2 . . 3.000 2.171 2.050 2.243 . 0 0 "[ . 1]" 1
899 1 38 LEU QB 1 39 MET H . . 4.520 3.485 2.714 3.735 . 0 0 "[ . 1]" 1
900 1 38 LEU QB 1 40 LEU H . . 5.500 5.413 4.966 5.618 0.118 4 0 "[ . 1]" 1
901 1 38 LEU QB 1 40 LEU QD . . 4.260 4.152 4.026 4.233 . 0 0 "[ . 1]" 1
902 1 38 LEU QB 1 50 VAL H . . 4.470 2.958 2.511 4.283 . 0 0 "[ . 1]" 1
903 1 38 LEU QB 1 50 VAL HB . . 4.120 2.352 1.865 3.929 . 0 0 "[ . 1]" 1
904 1 38 LEU QB 1 50 VAL MG1 . . 3.500 3.277 3.117 3.791 0.291 9 0 "[ . 1]" 1
905 1 38 LEU QB 1 52 VAL MG1 . . 4.400 3.554 3.169 3.987 . 0 0 "[ . 1]" 1
906 1 38 LEU QD 1 39 MET H . . 3.860 3.154 3.114 3.226 . 0 0 "[ . 1]" 1
907 1 38 LEU QD 1 40 LEU H . . 3.870 2.994 2.746 3.124 . 0 0 "[ . 1]" 1
908 1 38 LEU QD 1 40 LEU HA . . 5.360 3.539 3.450 3.768 . 0 0 "[ . 1]" 1
909 1 38 LEU QD 1 40 LEU HB2 . . 3.890 2.463 2.038 2.949 . 0 0 "[ . 1]" 1
910 1 38 LEU QD 1 40 LEU QD . . 2.540 1.729 1.632 1.775 . 0 0 "[ . 1]" 1
911 1 38 LEU QD 1 48 LEU HB2 . . 5.440 5.052 4.772 5.206 . 0 0 "[ . 1]" 1
912 1 38 LEU QD 1 48 LEU HB3 . . 4.420 3.901 3.556 4.054 . 0 0 "[ . 1]" 1
913 1 38 LEU QD 1 48 LEU QD . . 3.870 2.887 1.895 3.070 . 0 0 "[ . 1]" 1
914 1 38 LEU QD 1 48 LEU HG . . 4.070 3.248 2.780 4.188 0.118 10 0 "[ . 1]" 1
915 1 38 LEU QD 1 49 TYR HA . . 5.200 3.234 3.102 3.405 . 0 0 "[ . 1]" 1
916 1 38 LEU QD 1 49 TYR HB2 . . 5.440 5.536 5.472 5.648 0.208 10 0 "[ . 1]" 1
917 1 38 LEU QD 1 50 VAL H . . 4.510 2.467 2.138 2.669 . 0 0 "[ . 1]" 1
918 1 38 LEU QD 1 50 VAL HB . . 3.440 1.895 1.841 1.960 . 0 0 "[ . 1]" 1
919 1 38 LEU QD 1 50 VAL MG1 . . 3.270 2.659 2.064 2.826 . 0 0 "[ . 1]" 1
920 1 38 LEU QD 1 50 VAL MG2 . . 3.090 2.216 2.072 2.645 . 0 0 "[ . 1]" 1
921 1 38 LEU QD 1 51 PRO QD . . 5.280 4.712 4.553 4.787 . 0 0 "[ . 1]" 1
922 1 38 LEU QD 1 52 VAL HA . . 5.440 4.636 4.185 4.899 . 0 0 "[ . 1]" 1
923 1 38 LEU QD 1 55 LEU HA . . 5.440 4.027 3.658 4.339 . 0 0 "[ . 1]" 1
924 1 38 LEU QD 1 58 ILE MD . . 2.910 2.863 2.691 3.074 0.164 8 0 "[ . 1]" 1
925 1 38 LEU QD 1 58 ILE HG12 . . 5.440 3.964 3.546 4.201 . 0 0 "[ . 1]" 1
926 1 38 LEU QD 1 58 ILE HG13 . . 3.520 2.594 2.112 2.814 . 0 0 "[ . 1]" 1
927 1 38 LEU MD1 1 48 LEU QD . . 4.470 4.012 1.903 4.481 0.011 7 0 "[ . 1]" 1
928 1 38 LEU MD1 1 50 VAL H . . 5.350 4.036 2.582 4.423 . 0 0 "[ . 1]" 1
929 1 38 LEU MD1 1 50 VAL HB . . 3.940 2.475 1.968 2.693 . 0 0 "[ . 1]" 1
930 1 38 LEU MD1 1 50 VAL MG1 . . 3.930 3.081 2.869 3.227 . 0 0 "[ . 1]" 1
931 1 38 LEU MD1 1 58 ILE HG13 . . 4.540 2.975 2.489 4.068 . 0 0 "[ . 1]" 1
932 1 38 LEU MD2 1 48 LEU QD . . 4.470 3.221 2.945 4.364 . 0 0 "[ . 1]" 1
933 1 38 LEU MD2 1 50 VAL H . . 5.350 2.780 2.143 4.210 . 0 0 "[ . 1]" 1
934 1 38 LEU MD2 1 50 VAL HB . . 3.940 2.044 1.874 2.457 . 0 0 "[ . 1]" 1
935 1 38 LEU MD2 1 50 VAL MG1 . . 3.930 3.038 2.093 3.308 . 0 0 "[ . 1]" 1
936 1 38 LEU MD2 1 58 ILE HG13 . . 4.540 3.705 2.122 4.525 . 0 0 "[ . 1]" 1
937 1 38 LEU HG 1 39 MET H . . 5.040 3.112 2.608 4.712 . 0 0 "[ . 1]" 1
938 1 38 LEU HG 1 40 LEU H . . 5.170 4.964 4.750 5.309 0.139 10 0 "[ . 1]" 1
939 1 38 LEU HG 1 40 LEU QD . . 4.660 3.637 2.846 4.077 . 0 0 "[ . 1]" 1
940 1 38 LEU HG 1 50 VAL H . . 4.770 4.243 2.482 4.753 . 0 0 "[ . 1]" 1
941 1 38 LEU HG 1 50 VAL HB . . 4.860 3.703 1.827 4.224 . 0 0 "[ . 1]" 1
942 1 38 LEU HG 1 50 VAL MG1 . . 5.250 4.697 2.400 5.298 0.048 7 0 "[ . 1]" 1
943 1 39 MET H 1 39 MET HB2 . . 3.120 2.492 2.304 2.557 . 0 0 "[ . 1]" 1
944 1 39 MET H 1 39 MET HB3 . . 3.420 3.085 2.947 3.395 . 0 0 "[ . 1]" 1
945 1 39 MET H 1 39 MET HG2 . . 5.050 4.613 4.497 4.671 . 0 0 "[ . 1]" 1
946 1 39 MET H 1 39 MET HG3 . . 4.330 4.273 3.748 4.390 0.060 7 0 "[ . 1]" 1
947 1 39 MET HA 1 39 MET HG2 . . 3.970 2.538 2.305 2.675 . 0 0 "[ . 1]" 1
948 1 39 MET HA 1 39 MET HG3 . . 4.110 2.505 2.381 2.684 . 0 0 "[ . 1]" 1
949 1 39 MET HA 1 40 LEU H . . 2.740 2.130 2.121 2.141 . 0 0 "[ . 1]" 1
950 1 39 MET HA 1 40 LEU HA . . 4.500 4.385 4.377 4.404 . 0 0 "[ . 1]" 1
951 1 39 MET HA 1 40 LEU QD . . 4.960 4.780 4.149 4.974 0.014 8 0 "[ . 1]" 1
952 1 39 MET HA 1 49 TYR HA . . 3.960 3.042 2.899 3.243 . 0 0 "[ . 1]" 1
953 1 39 MET HA 1 50 VAL H . . 4.730 4.095 3.932 4.318 . 0 0 "[ . 1]" 1
954 1 39 MET HB3 1 40 LEU H . . 4.100 3.866 3.699 4.030 . 0 0 "[ . 1]" 1
955 1 39 MET HG2 1 40 LEU H . . 3.890 3.257 2.875 3.899 0.009 9 0 "[ . 1]" 1
956 1 39 MET HG2 1 48 LEU H . . 5.490 4.236 3.719 4.864 . 0 0 "[ . 1]" 1
957 1 39 MET HG2 1 49 TYR QE . . 4.530 3.456 2.904 4.180 . 0 0 "[ . 1]" 1
958 1 39 MET HG3 1 40 LEU H . . 4.690 4.119 3.886 4.673 . 0 0 "[ . 1]" 1
959 1 39 MET HG3 1 49 TYR QD . . 4.630 2.808 2.397 3.234 . 0 0 "[ . 1]" 1
960 1 39 MET HG3 1 49 TYR QE . . 4.450 2.612 2.085 2.994 . 0 0 "[ . 1]" 1
961 1 40 LEU H 1 40 LEU HB2 . . 3.490 2.405 2.298 2.461 . 0 0 "[ . 1]" 1
962 1 40 LEU H 1 40 LEU HB3 . . 3.600 3.367 3.288 3.441 . 0 0 "[ . 1]" 1
963 1 40 LEU H 1 40 LEU QD . . 3.910 3.698 3.297 3.827 . 0 0 "[ . 1]" 1
964 1 40 LEU H 1 40 LEU HG . . 5.500 4.092 3.856 4.569 . 0 0 "[ . 1]" 1
965 1 40 LEU H 1 41 THR H . . 4.660 4.471 4.431 4.516 . 0 0 "[ . 1]" 1
966 1 40 LEU H 1 48 LEU HB3 . . 4.030 2.967 2.377 3.160 . 0 0 "[ . 1]" 1
967 1 40 LEU H 1 48 LEU QD . . 4.580 3.816 1.939 4.306 . 0 0 "[ . 1]" 1
968 1 40 LEU H 1 48 LEU HG . . 4.600 3.984 3.322 4.438 . 0 0 "[ . 1]" 1
969 1 40 LEU H 1 49 TYR HA . . 4.610 3.739 3.556 3.988 . 0 0 "[ . 1]" 1
970 1 40 LEU H 1 50 VAL H . . 5.300 4.773 4.487 4.930 . 0 0 "[ . 1]" 1
971 1 40 LEU HA 1 40 LEU MD1 . . 3.870 3.524 2.242 3.693 . 0 0 "[ . 1]" 1
972 1 40 LEU HA 1 40 LEU QD . . 3.030 2.463 1.884 2.738 . 0 0 "[ . 1]" 1
973 1 40 LEU HA 1 40 LEU MD2 . . 3.870 2.522 2.026 2.837 . 0 0 "[ . 1]" 1
974 1 40 LEU HA 1 41 THR H . . 2.690 2.261 2.212 2.306 . 0 0 "[ . 1]" 1
975 1 40 LEU HA 1 41 THR MG . . 4.830 4.383 4.038 4.997 0.167 3 0 "[ . 1]" 1
976 1 40 LEU HA 1 48 LEU HB3 . . 4.450 4.188 3.727 4.294 . 0 0 "[ . 1]" 1
977 1 40 LEU HB2 1 40 LEU MD1 . . 3.230 2.195 2.050 3.183 . 0 0 "[ . 1]" 1
978 1 40 LEU HB2 1 40 LEU MD2 . . 3.230 3.041 2.423 3.126 . 0 0 "[ . 1]" 1
979 1 40 LEU HB2 1 41 THR H . . 4.180 4.170 4.014 4.211 0.031 3 0 "[ . 1]" 1
980 1 40 LEU HB2 1 48 LEU HA . . 4.870 4.739 4.530 4.837 . 0 0 "[ . 1]" 1
981 1 40 LEU HB2 1 48 LEU HB2 . . 3.860 3.712 3.148 3.872 0.012 8 0 "[ . 1]" 1
982 1 40 LEU HB2 1 48 LEU HB3 . . 3.310 2.075 1.808 2.197 . 0 0 "[ . 1]" 1
983 1 40 LEU HB2 1 48 LEU QD . . 2.880 2.230 1.625 2.716 . 0 0 "[ . 1]" 1
984 1 40 LEU HB2 1 48 LEU HG . . 3.220 2.959 2.377 3.487 0.267 10 0 "[ . 1]" 1
985 1 40 LEU HB2 1 50 VAL H . . 5.500 5.072 4.856 5.406 . 0 0 "[ . 1]" 1
986 1 40 LEU HB3 1 40 LEU QD . . 2.980 2.101 2.058 2.261 . 0 0 "[ . 1]" 1
987 1 40 LEU HB3 1 41 THR H . . 3.270 3.009 2.715 3.093 . 0 0 "[ . 1]" 1
988 1 40 LEU HB3 1 48 LEU H . . 4.120 3.660 3.384 4.102 . 0 0 "[ . 1]" 1
989 1 40 LEU HB3 1 48 LEU HB2 . . 3.720 3.442 3.112 3.581 . 0 0 "[ . 1]" 1
990 1 40 LEU HB3 1 48 LEU HB3 . . 4.310 2.131 1.986 2.266 . 0 0 "[ . 1]" 1
991 1 40 LEU HB3 1 48 LEU QD . . 2.910 2.507 2.131 2.711 . 0 0 "[ . 1]" 1
992 1 40 LEU HB3 1 48 LEU HG . . 4.330 4.024 3.813 4.442 0.112 10 0 "[ . 1]" 1
993 1 40 LEU HB3 1 74 LEU QD . . 5.440 4.172 3.836 4.633 . 0 0 "[ . 1]" 1
994 1 40 LEU QD 1 41 THR H . . 3.670 2.231 1.982 2.540 . 0 0 "[ . 1]" 1
995 1 40 LEU QD 1 48 LEU HB2 . . 5.440 4.104 3.795 4.622 . 0 0 "[ . 1]" 1
996 1 40 LEU QD 1 48 LEU HB3 . . 3.760 3.250 3.093 3.596 . 0 0 "[ . 1]" 1
997 1 40 LEU QD 1 48 LEU QD . . 4.480 1.921 1.567 2.697 . 0 0 "[ . 1]" 1
998 1 40 LEU QD 1 48 LEU HG . . 3.210 3.331 3.257 3.616 0.406 10 0 "[ . 1]" 1
999 1 40 LEU QD 1 49 TYR HA . . 5.440 5.175 4.963 5.376 . 0 0 "[ . 1]" 1
1000 1 40 LEU QD 1 50 VAL HB . . 4.110 3.861 3.364 4.145 0.035 4 0 "[ . 1]" 1
1001 1 40 LEU QD 1 58 ILE MG . . 3.960 3.114 2.869 3.613 . 0 0 "[ . 1]" 1
1002 1 40 LEU MD1 1 48 LEU HB3 . . 4.800 3.483 3.305 4.055 . 0 0 "[ . 1]" 1
1003 1 40 LEU MD2 1 48 LEU HB3 . . 4.800 3.908 3.724 4.032 . 0 0 "[ . 1]" 1
1004 1 40 LEU HG 1 41 THR H . . 4.620 3.851 3.594 4.488 . 0 0 "[ . 1]" 1
1005 1 40 LEU HG 1 48 LEU HB3 . . 4.760 4.477 3.666 4.636 . 0 0 "[ . 1]" 1
1006 1 41 THR H 1 41 THR HB . . 3.690 3.513 3.106 3.685 . 0 0 "[ . 1]" 1
1007 1 41 THR H 1 41 THR MG . . 3.830 3.478 3.253 3.830 0.000 7 0 "[ . 1]" 1
1008 1 41 THR H 1 42 TYR H . . 4.460 4.273 4.168 4.335 . 0 0 "[ . 1]" 1
1009 1 41 THR H 1 48 LEU HB3 . . 4.820 4.665 4.165 4.829 0.009 4 0 "[ . 1]" 1
1010 1 41 THR HA 1 41 THR MG . . 3.020 2.180 2.136 2.217 . 0 0 "[ . 1]" 1
1011 1 41 THR HA 1 42 TYR H . . 2.610 2.110 2.075 2.134 . 0 0 "[ . 1]" 1
1012 1 41 THR HA 1 42 TYR QB . . 4.680 4.211 4.165 4.309 . 0 0 "[ . 1]" 1
1013 1 41 THR HA 1 46 ALA H . . 5.040 4.518 4.291 4.735 . 0 0 "[ . 1]" 1
1014 1 41 THR HA 1 47 LYS HA . . 3.090 3.014 2.841 3.142 0.052 10 0 "[ . 1]" 1
1015 1 41 THR HA 1 48 LEU H . . 4.410 3.515 3.224 3.788 . 0 0 "[ . 1]" 1
1016 1 41 THR HB 1 42 TYR H . . 4.000 3.457 3.222 3.877 . 0 0 "[ . 1]" 1
1017 1 41 THR HB 1 42 TYR HA . . 4.610 4.398 4.318 4.542 . 0 0 "[ . 1]" 1
1018 1 41 THR HB 1 45 ASP H . . 5.500 5.085 4.648 5.553 0.053 3 0 "[ . 1]" 1
1019 1 41 THR HB 1 45 ASP HA . . 4.510 3.544 3.010 4.223 . 0 0 "[ . 1]" 1
1020 1 41 THR MG 1 42 TYR H . . 3.500 3.368 2.997 3.560 0.060 4 0 "[ . 1]" 1
1021 1 41 THR MG 1 42 TYR HA . . 5.330 5.143 4.562 5.380 0.050 5 0 "[ . 1]" 1
1022 1 41 THR MG 1 45 ASP H . . 5.070 4.746 3.737 5.120 0.050 6 0 "[ . 1]" 1
1023 1 41 THR MG 1 45 ASP HA . . 3.240 2.906 2.031 3.256 0.016 10 0 "[ . 1]" 1
1024 1 41 THR MG 1 45 ASP HB2 . . 5.130 4.797 4.146 5.184 0.054 10 0 "[ . 1]" 1
1025 1 41 THR MG 1 45 ASP HB3 . . 5.130 3.848 3.393 5.152 0.022 4 0 "[ . 1]" 1
1026 1 41 THR MG 1 46 ALA H . . 4.420 4.176 3.475 4.459 0.039 1 0 "[ . 1]" 1
1027 1 41 THR MG 1 47 LYS QD . . 4.110 2.407 2.078 3.239 . 0 0 "[ . 1]" 1
1028 1 41 THR MG 1 47 LYS QE . . 4.310 2.960 2.285 3.602 . 0 0 "[ . 1]" 1
1029 1 42 TYR H 1 42 TYR HB2 . . 3.830 2.409 2.319 2.454 . 0 0 "[ . 1]" 1
1030 1 42 TYR H 1 42 TYR QB . . 3.080 2.376 2.291 2.418 . 0 0 "[ . 1]" 1
1031 1 42 TYR H 1 42 TYR HB3 . . 3.830 3.625 3.575 3.658 . 0 0 "[ . 1]" 1
1032 1 42 TYR H 1 43 ALA H . . 4.500 4.338 4.292 4.367 . 0 0 "[ . 1]" 1
1033 1 42 TYR H 1 43 ALA HA . . 5.500 5.422 5.333 5.511 0.011 7 0 "[ . 1]" 1
1034 1 42 TYR H 1 43 ALA MB . . 5.500 5.546 5.499 5.600 0.100 7 0 "[ . 1]" 1
1035 1 42 TYR H 1 45 ASP HA . . 4.660 4.087 3.905 4.351 . 0 0 "[ . 1]" 1
1036 1 42 TYR H 1 46 ALA H . . 3.910 3.090 2.915 3.286 . 0 0 "[ . 1]" 1
1037 1 42 TYR H 1 46 ALA MB . . 3.620 2.859 2.613 2.981 . 0 0 "[ . 1]" 1
1038 1 42 TYR H 1 48 LEU H . . 5.500 4.543 4.269 4.785 . 0 0 "[ . 1]" 1
1039 1 42 TYR H 1 71 LEU QD . . 4.630 4.066 3.936 4.297 . 0 0 "[ . 1]" 1
1040 1 42 TYR HA 1 43 ALA H . . 3.460 2.768 2.716 2.833 . 0 0 "[ . 1]" 1
1041 1 42 TYR HA 1 46 ALA MB . . 4.540 4.380 4.210 4.495 . 0 0 "[ . 1]" 1
1042 1 42 TYR HA 1 71 LEU MD1 . . 4.370 2.087 1.748 2.953 . 0 0 "[ . 1]" 1
1043 1 42 TYR HA 1 71 LEU QD . . 3.030 1.954 1.746 2.188 . 0 0 "[ . 1]" 1
1044 1 42 TYR HA 1 71 LEU MD2 . . 4.370 3.457 1.759 4.506 0.136 5 0 "[ . 1]" 1
1045 1 42 TYR QB 1 43 ALA H . . 2.980 1.788 1.684 1.889 . 0 0 "[ . 1]" 1
1046 1 42 TYR QB 1 43 ALA MB . . 4.110 3.364 3.292 3.433 . 0 0 "[ . 1]" 1
1047 1 42 TYR QB 1 46 ALA H . . 4.280 3.518 3.399 3.709 . 0 0 "[ . 1]" 1
1048 1 42 TYR QB 1 46 ALA MB . . 3.170 1.967 1.840 2.182 . 0 0 "[ . 1]" 1
1049 1 42 TYR QB 1 71 LEU HG . . 5.270 4.274 3.586 5.423 0.153 8 0 "[ . 1]" 1
1050 1 42 TYR QB 1 72 HIS HA . . 5.340 4.984 4.878 5.241 . 0 0 "[ . 1]" 1
1051 1 42 TYR QB 1 74 LEU H . . 4.560 3.009 2.615 3.531 . 0 0 "[ . 1]" 1
1052 1 42 TYR QB 1 74 LEU QB . . 5.180 3.529 1.813 4.291 . 0 0 "[ . 1]" 1
1053 1 42 TYR QB 1 74 LEU HG . . 3.740 2.285 1.964 2.889 . 0 0 "[ . 1]" 1
1054 1 42 TYR HB2 1 43 ALA H . . 3.760 3.189 3.088 3.296 . 0 0 "[ . 1]" 1
1055 1 42 TYR HB2 1 43 ALA MB . . 4.980 4.551 4.456 4.641 . 0 0 "[ . 1]" 1
1056 1 42 TYR HB2 1 46 ALA MB . . 3.760 1.987 1.854 2.222 . 0 0 "[ . 1]" 1
1057 1 42 TYR HB2 1 74 LEU HG . . 4.290 2.340 2.021 2.933 . 0 0 "[ . 1]" 1
1058 1 42 TYR HB3 1 43 ALA H . . 3.760 1.797 1.691 1.901 . 0 0 "[ . 1]" 1
1059 1 42 TYR HB3 1 43 ALA MB . . 4.980 3.466 3.390 3.537 . 0 0 "[ . 1]" 1
1060 1 42 TYR HB3 1 46 ALA MB . . 3.760 3.181 3.051 3.335 . 0 0 "[ . 1]" 1
1061 1 42 TYR HB3 1 74 LEU HG . . 4.290 3.227 2.677 4.333 0.043 3 0 "[ . 1]" 1
1062 1 43 ALA H 1 43 ALA MB . . 2.900 2.227 2.214 2.238 . 0 0 "[ . 1]" 1
1063 1 43 ALA H 1 45 ASP H . . 5.370 4.983 4.890 5.151 . 0 0 "[ . 1]" 1
1064 1 43 ALA H 1 46 ALA MB . . 5.000 3.933 3.719 4.127 . 0 0 "[ . 1]" 1
1065 1 43 ALA H 1 71 LEU QD . . 4.010 2.825 1.996 3.084 . 0 0 "[ . 1]" 1
1066 1 43 ALA H 1 72 HIS H . . 5.160 4.270 3.747 4.528 . 0 0 "[ . 1]" 1
1067 1 43 ALA H 1 72 HIS HA . . 4.890 4.723 4.404 4.923 0.033 8 0 "[ . 1]" 1
1068 1 43 ALA H 1 74 LEU H . . 4.660 4.235 3.746 4.607 . 0 0 "[ . 1]" 1
1069 1 43 ALA HA 1 45 ASP H . . 3.740 3.272 3.120 3.472 . 0 0 "[ . 1]" 1
1070 1 43 ALA HA 1 46 ALA H . . 4.760 4.409 4.291 4.506 . 0 0 "[ . 1]" 1
1071 1 43 ALA HA 1 46 ALA MB . . 5.430 4.948 4.823 5.074 . 0 0 "[ . 1]" 1
1072 1 43 ALA HA 1 71 LEU QD . . 3.240 2.457 2.130 3.267 0.027 5 0 "[ . 1]" 1
1073 1 43 ALA MB 1 44 ASN HA . . 4.350 4.305 4.194 4.366 0.016 1 0 "[ . 1]" 1
1074 1 43 ALA MB 1 44 ASN HB2 . . 4.780 3.641 3.535 3.926 . 0 0 "[ . 1]" 1
1075 1 43 ALA MB 1 44 ASN QB . . 3.990 3.448 3.274 3.770 . 0 0 "[ . 1]" 1
1076 1 43 ALA MB 1 44 ASN HB3 . . 4.780 4.333 3.826 4.868 0.088 7 0 "[ . 1]" 1
1077 1 43 ALA MB 1 71 LEU HA . . 5.500 4.765 4.298 5.094 . 0 0 "[ . 1]" 1
1078 1 43 ALA MB 1 71 LEU QD . . 3.630 2.957 2.533 3.593 . 0 0 "[ . 1]" 1
1079 1 43 ALA MB 1 72 HIS H . . 5.350 4.507 3.984 4.868 . 0 0 "[ . 1]" 1
1080 1 43 ALA MB 1 72 HIS HA . . 4.210 3.955 3.256 4.239 0.029 8 0 "[ . 1]" 1
1081 1 43 ALA MB 1 72 HIS QB . . 5.330 4.726 4.361 5.071 . 0 0 "[ . 1]" 1
1082 1 43 ALA MB 1 73 LYS H . . 4.570 3.839 3.380 4.038 . 0 0 "[ . 1]" 1
1083 1 43 ALA MB 1 73 LYS HA . . 3.110 2.421 1.973 3.035 . 0 0 "[ . 1]" 1
1084 1 43 ALA MB 1 73 LYS QB . . 3.630 2.271 1.803 3.564 . 0 0 "[ . 1]" 1
1085 1 43 ALA MB 1 74 LEU H . . 4.910 4.015 3.291 4.708 . 0 0 "[ . 1]" 1
1086 1 44 ASN HA 1 45 ASP H . . 3.140 2.940 2.898 2.998 . 0 0 "[ . 1]" 1
1087 1 44 ASN QB 1 46 ALA H . . 3.990 3.672 3.462 3.912 . 0 0 "[ . 1]" 1
1088 1 44 ASN QB 1 46 ALA MB . . 3.920 3.219 3.038 3.405 . 0 0 "[ . 1]" 1
1089 1 45 ASP H 1 45 ASP HA . . 2.480 2.263 2.257 2.268 . 0 0 "[ . 1]" 1
1090 1 45 ASP H 1 45 ASP HB2 . . 4.040 3.376 3.019 3.563 . 0 0 "[ . 1]" 1
1091 1 45 ASP H 1 45 ASP QB . . 3.540 3.204 2.882 3.347 . 0 0 "[ . 1]" 1
1092 1 45 ASP H 1 45 ASP HB3 . . 4.040 3.995 3.604 4.090 0.050 3 0 "[ . 1]" 1
1093 1 45 ASP H 1 46 ALA H . . 2.950 2.733 2.697 2.796 . 0 0 "[ . 1]" 1
1094 1 45 ASP H 1 46 ALA MB . . 4.360 4.362 4.335 4.399 0.039 10 0 "[ . 1]" 1
1095 1 45 ASP H 1 71 LEU QD . . 5.020 4.180 3.718 4.794 . 0 0 "[ . 1]" 1
1096 1 46 ALA H 1 46 ALA HA . . 2.890 2.851 2.829 2.886 . 0 0 "[ . 1]" 1
1097 1 46 ALA H 1 46 ALA MB . . 2.520 2.250 2.238 2.274 . 0 0 "[ . 1]" 1
1098 1 46 ALA H 1 47 LYS H . . 4.730 4.582 4.549 4.618 . 0 0 "[ . 1]" 1
1099 1 46 ALA HA 1 47 LYS H . . 2.670 2.204 2.153 2.282 . 0 0 "[ . 1]" 1
1100 1 46 ALA HA 1 47 LYS QB . . 4.780 4.387 4.266 4.453 . 0 0 "[ . 1]" 1
1101 1 46 ALA MB 1 47 LYS H . . 2.930 2.884 2.725 2.993 0.063 10 0 "[ . 1]" 1
1102 1 46 ALA MB 1 47 LYS HA . . 4.570 4.301 4.253 4.349 . 0 0 "[ . 1]" 1
1103 1 46 ALA MB 1 48 LEU HB2 . . 5.150 4.852 4.610 5.034 . 0 0 "[ . 1]" 1
1104 1 46 ALA MB 1 74 LEU HA . . 5.500 4.455 4.205 5.029 . 0 0 "[ . 1]" 1
1105 1 46 ALA MB 1 74 LEU MD1 . . 3.780 2.070 1.935 2.846 . 0 0 "[ . 1]" 1
1106 1 46 ALA MB 1 74 LEU QD . . 3.100 2.054 1.929 2.768 . 0 0 "[ . 1]" 1
1107 1 46 ALA MB 1 74 LEU MD2 . . 3.780 3.701 3.160 3.830 0.050 2 0 "[ . 1]" 1
1108 1 46 ALA MB 1 74 LEU HG . . 3.990 2.637 2.182 2.890 . 0 0 "[ . 1]" 1
1109 1 47 LYS H 1 47 LYS QB . . 2.970 2.473 2.340 2.530 . 0 0 "[ . 1]" 1
1110 1 47 LYS H 1 47 LYS QD . . 5.200 3.539 2.373 3.920 . 0 0 "[ . 1]" 1
1111 1 47 LYS H 1 47 LYS HG2 . . 4.600 2.698 2.336 4.282 . 0 0 "[ . 1]" 1
1112 1 47 LYS H 1 47 LYS QG . . 3.850 2.606 2.313 3.646 . 0 0 "[ . 1]" 1
1113 1 47 LYS H 1 47 LYS HG3 . . 4.600 3.856 3.706 3.993 . 0 0 "[ . 1]" 1
1114 1 47 LYS H 1 48 LEU H . . 4.640 4.400 4.342 4.496 . 0 0 "[ . 1]" 1
1115 1 47 LYS H 1 48 LEU HA . . 5.160 5.151 5.084 5.197 0.037 7 0 "[ . 1]" 1
1116 1 47 LYS HA 1 47 LYS HD2 . . 5.040 2.907 2.124 3.199 . 0 0 "[ . 1]" 1
1117 1 47 LYS HA 1 47 LYS QD . . 4.390 2.193 2.018 2.876 . 0 0 "[ . 1]" 1
1118 1 47 LYS HA 1 47 LYS HD3 . . 5.040 2.512 2.046 4.075 . 0 0 "[ . 1]" 1
1119 1 47 LYS HA 1 47 LYS QE . . 4.640 3.963 3.266 4.172 . 0 0 "[ . 1]" 1
1120 1 47 LYS HA 1 48 LEU H . . 2.640 2.120 2.081 2.153 . 0 0 "[ . 1]" 1
1121 1 47 LYS HA 1 48 LEU QD . . 5.290 5.237 5.138 5.290 0.000 3 0 "[ . 1]" 1
1122 1 47 LYS QB 1 47 LYS QD . . 3.300 2.354 2.286 2.618 . 0 0 "[ . 1]" 1
1123 1 47 LYS QB 1 48 LEU H . . 3.870 3.239 3.010 3.379 . 0 0 "[ . 1]" 1
1124 1 47 LYS QB 1 49 TYR QE . . 4.290 2.965 2.573 3.311 . 0 0 "[ . 1]" 1
1125 1 47 LYS HB2 1 48 LEU H . . 4.470 4.213 4.050 4.337 . 0 0 "[ . 1]" 1
1126 1 47 LYS HB3 1 48 LEU H . . 4.470 3.368 3.096 3.541 . 0 0 "[ . 1]" 1
1127 1 47 LYS QD 1 49 TYR QE . . 4.600 4.458 3.863 4.642 0.042 6 0 "[ . 1]" 1
1128 1 47 LYS QE 1 47 LYS HG2 . . 3.540 2.662 2.411 3.532 . 0 0 "[ . 1]" 1
1129 1 47 LYS QE 1 47 LYS QG . . 2.970 2.299 2.117 2.758 . 0 0 "[ . 1]" 1
1130 1 47 LYS QE 1 47 LYS HG3 . . 3.540 2.604 2.322 2.964 . 0 0 "[ . 1]" 1
1131 1 47 LYS QG 1 74 LEU QD . . 5.280 5.041 4.764 5.397 0.117 3 0 "[ . 1]" 1
1132 1 48 LEU H 1 48 LEU HB2 . . 3.700 3.072 2.894 3.233 . 0 0 "[ . 1]" 1
1133 1 48 LEU H 1 48 LEU QD . . 4.900 3.852 3.604 3.968 . 0 0 "[ . 1]" 1
1134 1 48 LEU H 1 48 LEU HG . . 4.540 4.318 4.043 4.578 0.038 10 0 "[ . 1]" 1
1135 1 48 LEU H 1 49 TYR H . . 4.640 4.433 4.315 4.484 . 0 0 "[ . 1]" 1
1136 1 48 LEU H 1 74 LEU QD . . 4.730 3.593 3.079 4.099 . 0 0 "[ . 1]" 1
1137 1 48 LEU HA 1 48 LEU QD . . 2.990 2.311 2.150 3.107 0.117 10 0 "[ . 1]" 1
1138 1 48 LEU HA 1 48 LEU HG . . 4.160 3.189 2.628 3.496 . 0 0 "[ . 1]" 1
1139 1 48 LEU HA 1 49 TYR H . . 2.730 2.190 2.158 2.222 . 0 0 "[ . 1]" 1
1140 1 48 LEU HB2 1 49 TYR H . . 4.270 4.076 3.921 4.238 . 0 0 "[ . 1]" 1
1141 1 48 LEU HB2 1 74 LEU QD . . 4.330 2.009 1.869 2.223 . 0 0 "[ . 1]" 1
1142 1 48 LEU HB2 1 74 LEU HG . . 4.450 4.153 2.748 4.475 0.025 2 0 "[ . 1]" 1
1143 1 48 LEU QD 1 49 TYR H . . 3.230 2.119 1.840 2.891 . 0 0 "[ . 1]" 1
1144 1 48 LEU QD 1 49 TYR QD . . 5.380 4.339 4.059 4.635 . 0 0 "[ . 1]" 1
1145 1 48 LEU QD 1 50 VAL H . . 5.230 4.085 2.823 4.413 . 0 0 "[ . 1]" 1
1146 1 48 LEU QD 1 58 ILE MD . . 3.610 3.351 3.063 3.773 0.163 8 0 "[ . 1]" 1
1147 1 48 LEU QD 1 58 ILE MG . . 5.150 4.590 4.147 4.777 . 0 0 "[ . 1]" 1
1148 1 48 LEU QD 1 74 LEU MD1 . . 3.420 3.042 2.674 3.534 0.114 10 0 "[ . 1]" 1
1149 1 48 LEU QD 1 74 LEU QD . . 2.970 2.313 1.954 2.614 . 0 0 "[ . 1]" 1
1150 1 48 LEU QD 1 74 LEU MD2 . . 3.420 2.496 1.963 3.045 . 0 0 "[ . 1]" 1
1151 1 48 LEU HG 1 49 TYR H . . 4.620 3.017 2.773 3.437 . 0 0 "[ . 1]" 1
1152 1 48 LEU HG 1 50 VAL HB . . 4.900 4.409 3.895 4.923 0.023 10 0 "[ . 1]" 1
1153 1 48 LEU HG 1 50 VAL MG2 . . 3.050 2.215 1.886 2.969 . 0 0 "[ . 1]" 1
1154 1 48 LEU HG 1 58 ILE MD . . 5.130 4.989 4.734 5.244 0.114 8 0 "[ . 1]" 1
1155 1 48 LEU HG 1 74 LEU QD . . 4.650 4.126 3.110 4.432 . 0 0 "[ . 1]" 1
1156 1 49 TYR H 1 49 TYR HB2 . . 3.190 2.702 2.638 2.757 . 0 0 "[ . 1]" 1
1157 1 49 TYR H 1 49 TYR HB3 . . 3.820 3.784 3.750 3.828 0.008 5 0 "[ . 1]" 1
1158 1 49 TYR H 1 49 TYR QD . . 3.420 3.010 2.668 3.444 0.024 7 0 "[ . 1]" 1
1159 1 49 TYR H 1 50 VAL H . . 4.660 4.256 4.196 4.325 . 0 0 "[ . 1]" 1
1160 1 49 TYR H 1 50 VAL MG2 . . 4.790 3.882 3.610 4.061 . 0 0 "[ . 1]" 1
1161 1 49 TYR HA 1 49 TYR QD . . 4.000 2.723 2.374 3.002 . 0 0 "[ . 1]" 1
1162 1 49 TYR HA 1 50 VAL H . . 2.820 2.133 2.099 2.153 . 0 0 "[ . 1]" 1
1163 1 49 TYR HA 1 50 VAL MG1 . . 5.500 5.446 5.335 5.508 0.008 4 0 "[ . 1]" 1
1164 1 49 TYR HA 1 50 VAL MG2 . . 4.040 3.779 3.475 4.119 0.079 10 0 "[ . 1]" 1
1165 1 49 TYR HB2 1 50 VAL H . . 4.210 4.185 4.064 4.275 0.065 6 0 "[ . 1]" 1
1166 1 49 TYR HB2 1 50 VAL MG2 . . 5.260 4.957 4.783 5.043 . 0 0 "[ . 1]" 1
1167 1 49 TYR HB3 1 50 VAL H . . 3.890 3.445 3.267 3.547 . 0 0 "[ . 1]" 1
1168 1 49 TYR QD 1 50 VAL H . . 4.480 4.340 4.128 4.491 0.011 6 0 "[ . 1]" 1
1169 1 50 VAL H 1 50 VAL HB . . 3.150 2.620 2.477 2.693 . 0 0 "[ . 1]" 1
1170 1 50 VAL H 1 50 VAL MG1 . . 4.510 3.813 3.650 3.874 . 0 0 "[ . 1]" 1
1171 1 50 VAL H 1 50 VAL MG2 . . 3.120 2.865 2.707 3.226 0.106 10 0 "[ . 1]" 1
1172 1 50 VAL HB 1 58 ILE MD . . 4.140 3.568 3.339 3.980 . 0 0 "[ . 1]" 1
1173 1 50 VAL MG1 1 51 PRO HB2 . . 4.860 4.551 4.450 4.711 . 0 0 "[ . 1]" 1
1174 1 50 VAL MG1 1 51 PRO HD2 . . 3.470 2.144 2.072 2.195 . 0 0 "[ . 1]" 1
1175 1 50 VAL MG1 1 51 PRO QD . . 3.010 2.127 2.059 2.176 . 0 0 "[ . 1]" 1
1176 1 50 VAL MG1 1 51 PRO HD3 . . 3.470 3.538 3.522 3.569 0.099 3 0 "[ . 1]" 1
1177 1 50 VAL MG1 1 51 PRO QG . . 4.150 3.261 3.148 3.432 . 0 0 "[ . 1]" 1
1178 1 50 VAL MG1 1 54 SER H . . 4.240 3.692 3.562 3.837 . 0 0 "[ . 1]" 1
1179 1 50 VAL MG1 1 54 SER HB2 . . 4.110 2.558 2.382 2.798 . 0 0 "[ . 1]" 1
1180 1 50 VAL MG1 1 54 SER HB3 . . 4.110 3.538 3.288 3.979 . 0 0 "[ . 1]" 1
1181 1 50 VAL MG1 1 55 LEU HA . . 4.140 3.345 3.154 3.581 . 0 0 "[ . 1]" 1
1182 1 50 VAL MG1 1 55 LEU HB2 . . 5.500 5.452 5.303 5.674 0.174 8 0 "[ . 1]" 1
1183 1 50 VAL MG1 1 55 LEU MD2 . . 4.120 2.743 2.476 2.865 . 0 0 "[ . 1]" 1
1184 1 50 VAL MG1 1 57 LEU H . . 5.460 4.770 4.502 5.233 . 0 0 "[ . 1]" 1
1185 1 50 VAL MG1 1 57 LEU QD . . 4.510 4.133 3.908 4.424 . 0 0 "[ . 1]" 1
1186 1 50 VAL MG1 1 58 ILE HB . . 5.230 4.588 4.280 5.067 . 0 0 "[ . 1]" 1
1187 1 50 VAL MG1 1 58 ILE MD . . 2.780 2.148 1.952 2.344 . 0 0 "[ . 1]" 1
1188 1 50 VAL MG1 1 58 ILE HG12 . . 4.080 2.895 2.610 3.586 . 0 0 "[ . 1]" 1
1189 1 50 VAL MG1 1 58 ILE HG13 . . 3.670 2.607 2.303 3.023 . 0 0 "[ . 1]" 1
1190 1 50 VAL MG1 1 58 ILE MG . . 4.510 4.181 4.003 4.322 . 0 0 "[ . 1]" 1
1191 1 50 VAL MG2 1 51 PRO QD . . 3.660 3.247 2.830 3.402 . 0 0 "[ . 1]" 1
1192 1 50 VAL MG2 1 58 ILE MD . . 2.900 2.131 1.904 2.939 0.039 8 0 "[ . 1]" 1
1193 1 51 PRO HA 1 52 VAL H . . 2.660 2.200 2.185 2.213 . 0 0 "[ . 1]" 1
1194 1 51 PRO HA 1 52 VAL HA . . 4.540 4.316 4.300 4.338 . 0 0 "[ . 1]" 1
1195 1 51 PRO HA 1 52 VAL MG1 . . 4.200 3.762 3.697 3.792 . 0 0 "[ . 1]" 1
1196 1 51 PRO HA 1 52 VAL MG2 . . 3.760 3.763 3.719 3.803 0.043 3 0 "[ . 1]" 1
1197 1 51 PRO HB2 1 52 VAL H . . 3.520 3.257 3.070 3.398 . 0 0 "[ . 1]" 1
1198 1 51 PRO HB2 1 52 VAL HA . . 5.500 4.843 4.778 4.907 . 0 0 "[ . 1]" 1
1199 1 51 PRO HB2 1 53 SER H . . 4.390 2.371 2.195 2.610 . 0 0 "[ . 1]" 1
1200 1 51 PRO HB2 1 54 SER H . . 3.560 3.251 3.164 3.411 . 0 0 "[ . 1]" 1
1201 1 51 PRO HB2 1 54 SER QB . . 5.340 3.907 3.714 4.163 . 0 0 "[ . 1]" 1
1202 1 51 PRO HB3 1 52 VAL H . . 4.000 3.774 3.703 3.867 . 0 0 "[ . 1]" 1
1203 1 51 PRO HB3 1 53 SER H . . 4.490 3.933 3.823 4.121 . 0 0 "[ . 1]" 1
1204 1 51 PRO HB3 1 54 SER H . . 4.870 4.841 4.754 4.909 0.039 9 0 "[ . 1]" 1
1205 1 51 PRO QD 1 54 SER QB . . 4.390 2.777 2.409 3.045 . 0 0 "[ . 1]" 1
1206 1 51 PRO QG 1 52 VAL H . . 4.920 4.576 4.445 4.650 . 0 0 "[ . 1]" 1
1207 1 51 PRO QG 1 54 SER H . . 3.480 3.108 2.921 3.245 . 0 0 "[ . 1]" 1
1208 1 51 PRO QG 1 54 SER QB . . 3.830 2.160 2.028 2.328 . 0 0 "[ . 1]" 1
1209 1 51 PRO QG 1 55 LEU MD2 . . 5.500 5.458 5.235 5.565 0.065 4 0 "[ . 1]" 1
1210 1 52 VAL H 1 52 VAL MG1 . . 3.130 2.340 2.282 2.399 . 0 0 "[ . 1]" 1
1211 1 52 VAL H 1 52 VAL MG2 . . 2.690 1.931 1.876 1.978 . 0 0 "[ . 1]" 1
1212 1 52 VAL H 1 53 SER H . . 4.000 2.645 2.617 2.698 . 0 0 "[ . 1]" 1
1213 1 52 VAL H 1 54 SER H . . 4.500 4.173 4.112 4.236 . 0 0 "[ . 1]" 1
1214 1 52 VAL H 1 55 LEU MD2 . . 5.180 4.604 4.214 4.969 . 0 0 "[ . 1]" 1
1215 1 52 VAL HA 1 52 VAL MG1 . . 2.910 2.288 2.268 2.315 . 0 0 "[ . 1]" 1
1216 1 52 VAL HA 1 52 VAL MG2 . . 3.310 3.203 3.197 3.206 . 0 0 "[ . 1]" 1
1217 1 52 VAL HA 1 55 LEU HB2 . . 4.570 4.311 4.140 4.469 . 0 0 "[ . 1]" 1
1218 1 52 VAL HA 1 55 LEU MD1 . . 2.870 2.646 2.410 2.876 0.006 3 0 "[ . 1]" 1
1219 1 52 VAL HA 1 55 LEU MD2 . . 3.210 2.487 2.134 2.871 . 0 0 "[ . 1]" 1
1220 1 52 VAL HA 1 55 LEU HG . . 3.170 1.921 1.821 2.042 . 0 0 "[ . 1]" 1
1221 1 52 VAL HB 1 53 SER H . . 4.900 4.131 4.000 4.175 . 0 0 "[ . 1]" 1
1222 1 52 VAL HB 1 55 LEU MD1 . . 4.620 2.616 2.360 2.821 . 0 0 "[ . 1]" 1
1223 1 52 VAL MG1 1 55 LEU HG . . 3.560 3.553 3.484 3.581 0.021 8 0 "[ . 1]" 1
1224 1 52 VAL MG2 1 53 SER H . . 4.240 2.795 2.585 2.885 . 0 0 "[ . 1]" 1
1225 1 52 VAL MG2 1 53 SER HA . . 4.820 3.688 3.625 3.802 . 0 0 "[ . 1]" 1
1226 1 52 VAL MG2 1 53 SER QB . . 5.200 3.708 3.276 4.291 . 0 0 "[ . 1]" 1
1227 1 53 SER H 1 53 SER QB . . 3.700 2.524 2.277 2.823 . 0 0 "[ . 1]" 1
1228 1 53 SER H 1 54 SER H . . 3.660 2.390 2.306 2.496 . 0 0 "[ . 1]" 1
1229 1 53 SER H 1 55 LEU H . . 4.480 4.286 4.185 4.416 . 0 0 "[ . 1]" 1
1230 1 53 SER HA 1 53 SER HB2 . . 2.990 2.727 2.462 3.024 0.034 3 0 "[ . 1]" 1
1231 1 53 SER HA 1 53 SER HB3 . . 2.990 2.587 2.342 3.026 0.036 8 0 "[ . 1]" 1
1232 1 53 SER HA 1 55 LEU H . . 4.070 3.743 3.579 3.865 . 0 0 "[ . 1]" 1
1233 1 53 SER QB 1 54 SER H . . 3.960 3.395 3.018 3.798 . 0 0 "[ . 1]" 1
1234 1 54 SER H 1 54 SER QB . . 2.830 2.577 2.485 2.656 . 0 0 "[ . 1]" 1
1235 1 54 SER H 1 55 LEU H . . 2.890 2.476 2.373 2.646 . 0 0 "[ . 1]" 1
1236 1 54 SER H 1 55 LEU HB2 . . 5.070 4.671 4.557 4.956 . 0 0 "[ . 1]" 1
1237 1 54 SER H 1 55 LEU MD2 . . 4.890 4.102 3.929 4.378 . 0 0 "[ . 1]" 1
1238 1 54 SER HA 1 55 LEU H . . 3.280 2.987 2.953 3.072 . 0 0 "[ . 1]" 1
1239 1 54 SER HA 1 57 LEU H . . 4.410 4.027 3.716 4.412 0.002 3 0 "[ . 1]" 1
1240 1 54 SER HA 1 57 LEU HG . . 3.930 3.334 2.995 3.668 . 0 0 "[ . 1]" 1
1241 1 54 SER QB 1 57 LEU H . . 4.380 4.053 3.879 4.238 . 0 0 "[ . 1]" 1
1242 1 54 SER QB 1 57 LEU QD . . 4.210 2.097 1.978 2.357 . 0 0 "[ . 1]" 1
1243 1 54 SER QB 1 57 LEU HG . . 3.380 3.161 2.881 3.389 0.009 6 0 "[ . 1]" 1
1244 1 54 SER QB 1 58 ILE MD . . 5.050 4.527 3.852 4.850 . 0 0 "[ . 1]" 1
1245 1 55 LEU H 1 55 LEU HA . . 2.850 2.830 2.808 2.856 0.006 8 0 "[ . 1]" 1
1246 1 55 LEU H 1 55 LEU HB2 . . 3.050 2.395 2.335 2.461 . 0 0 "[ . 1]" 1
1247 1 55 LEU H 1 55 LEU HB3 . . 3.710 3.576 3.561 3.599 . 0 0 "[ . 1]" 1
1248 1 55 LEU H 1 55 LEU MD1 . . 4.020 3.690 3.603 3.757 . 0 0 "[ . 1]" 1
1249 1 55 LEU H 1 55 LEU MD2 . . 3.640 3.411 3.272 3.538 . 0 0 "[ . 1]" 1
1250 1 55 LEU H 1 55 LEU HG . . 2.670 2.444 2.310 2.558 . 0 0 "[ . 1]" 1
1251 1 55 LEU H 1 56 HIS H . . 4.340 2.594 2.494 2.672 . 0 0 "[ . 1]" 1
1252 1 55 LEU H 1 57 LEU H . . 4.360 4.207 4.104 4.371 0.011 3 0 "[ . 1]" 1
1253 1 55 LEU HA 1 55 LEU MD2 . . 3.340 1.972 1.935 2.011 . 0 0 "[ . 1]" 1
1254 1 55 LEU HA 1 57 LEU H . . 4.080 3.439 3.274 3.644 . 0 0 "[ . 1]" 1
1255 1 55 LEU HA 1 57 LEU HG . . 5.500 5.436 5.169 5.525 0.025 1 0 "[ . 1]" 1
1256 1 55 LEU HA 1 58 ILE H . . 3.710 3.420 3.098 3.636 . 0 0 "[ . 1]" 1
1257 1 55 LEU HA 1 58 ILE HB . . 4.890 3.432 3.039 3.790 . 0 0 "[ . 1]" 1
1258 1 55 LEU HA 1 58 ILE MD . . 4.550 4.157 3.718 4.554 0.004 9 0 "[ . 1]" 1
1259 1 55 LEU HA 1 58 ILE HG12 . . 3.870 2.834 2.363 3.316 . 0 0 "[ . 1]" 1
1260 1 55 LEU HA 1 58 ILE HG13 . . 4.220 2.960 2.599 3.290 . 0 0 "[ . 1]" 1
1261 1 55 LEU HA 1 58 ILE MG . . 4.970 4.544 4.199 4.784 . 0 0 "[ . 1]" 1
1262 1 55 LEU HB2 1 55 LEU MD1 . . 3.410 2.350 2.323 2.380 . 0 0 "[ . 1]" 1
1263 1 55 LEU HB2 1 55 LEU MD2 . . 3.390 3.195 3.190 3.201 . 0 0 "[ . 1]" 1
1264 1 55 LEU HB3 1 55 LEU MD2 . . 3.120 2.367 2.338 2.406 . 0 0 "[ . 1]" 1
1265 1 55 LEU MD1 1 56 HIS H . . 5.500 4.909 4.746 5.025 . 0 0 "[ . 1]" 1
1266 1 55 LEU MD2 1 58 ILE HB . . 4.010 3.679 3.138 4.101 0.091 9 0 "[ . 1]" 1
1267 1 55 LEU MD2 1 58 ILE HG13 . . 3.580 2.926 2.316 3.504 . 0 0 "[ . 1]" 1
1268 1 55 LEU HG 1 56 HIS H . . 4.910 4.606 4.449 4.763 . 0 0 "[ . 1]" 1
1269 1 56 HIS H 1 57 LEU H . . 3.970 2.638 2.503 2.787 . 0 0 "[ . 1]" 1
1270 1 56 HIS H 1 58 ILE H . . 5.040 4.165 4.060 4.321 . 0 0 "[ . 1]" 1
1271 1 56 HIS HA 1 58 ILE H . . 4.700 3.689 3.551 3.911 . 0 0 "[ . 1]" 1
1272 1 56 HIS QB 1 57 LEU H . . 4.250 3.409 3.026 3.882 . 0 0 "[ . 1]" 1
1273 1 56 HIS HB2 1 57 LEU H . . 5.030 3.989 3.400 4.362 . 0 0 "[ . 1]" 1
1274 1 56 HIS HB3 1 57 LEU H . . 5.030 3.865 3.113 4.419 . 0 0 "[ . 1]" 1
1275 1 56 HIS HD2 1 57 LEU H . . 5.330 4.908 3.421 5.407 0.077 4 0 "[ . 1]" 1
1276 1 57 LEU H 1 57 LEU HB2 . . 2.960 2.540 2.484 2.601 . 0 0 "[ . 1]" 1
1277 1 57 LEU H 1 57 LEU QD . . 3.450 3.208 3.039 3.382 . 0 0 "[ . 1]" 1
1278 1 57 LEU H 1 57 LEU HG . . 3.190 2.576 2.278 2.899 . 0 0 "[ . 1]" 1
1279 1 57 LEU H 1 58 ILE H . . 2.900 2.188 1.986 2.333 . 0 0 "[ . 1]" 1
1280 1 57 LEU H 1 58 ILE HA . . 5.360 4.820 4.620 4.917 . 0 0 "[ . 1]" 1
1281 1 57 LEU H 1 58 ILE HB . . 5.030 4.472 4.168 4.829 . 0 0 "[ . 1]" 1
1282 1 57 LEU H 1 58 ILE HG12 . . 4.290 3.285 2.943 3.558 . 0 0 "[ . 1]" 1
1283 1 57 LEU HA 1 57 LEU QD . . 2.700 2.071 2.011 2.140 . 0 0 "[ . 1]" 1
1284 1 57 LEU HA 1 57 LEU HG . . 3.410 3.207 3.132 3.269 . 0 0 "[ . 1]" 1
1285 1 57 LEU HB2 1 57 LEU QD . . 3.180 2.281 2.259 2.305 . 0 0 "[ . 1]" 1
1286 1 58 ILE H 1 58 ILE HB . . 3.020 2.576 2.505 2.740 . 0 0 "[ . 1]" 1
1287 1 58 ILE H 1 58 ILE MD . . 4.160 3.515 3.193 3.690 . 0 0 "[ . 1]" 1
1288 1 58 ILE H 1 58 ILE HG12 . . 3.240 2.246 1.946 2.377 . 0 0 "[ . 1]" 1
1289 1 58 ILE H 1 58 ILE HG13 . . 3.470 3.606 3.476 3.666 0.196 10 0 "[ . 1]" 1
1290 1 58 ILE H 1 58 ILE MG . . 3.850 3.805 3.775 3.844 . 0 0 "[ . 1]" 1
1291 1 58 ILE H 1 59 SER H . . 4.750 4.534 4.494 4.576 . 0 0 "[ . 1]" 1
1292 1 58 ILE HA 1 58 ILE MD . . 3.600 2.199 2.125 2.304 . 0 0 "[ . 1]" 1
1293 1 58 ILE HA 1 58 ILE MG . . 2.980 2.349 2.262 2.395 . 0 0 "[ . 1]" 1
1294 1 58 ILE HA 1 59 SER H . . 2.610 2.259 2.188 2.386 . 0 0 "[ . 1]" 1
1295 1 58 ILE HB 1 58 ILE MD . . 3.290 3.230 3.220 3.242 . 0 0 "[ . 1]" 1
1296 1 58 ILE HB 1 59 SER H . . 3.980 3.836 3.587 4.030 0.050 3 0 "[ . 1]" 1
1297 1 58 ILE MD 1 59 SER H . . 4.090 3.797 3.658 4.048 . 0 0 "[ . 1]" 1
1298 1 58 ILE HG12 1 58 ILE MG . . 3.380 3.199 3.194 3.204 . 0 0 "[ . 1]" 1
1299 1 58 ILE HG12 1 59 SER H . . 5.090 4.973 4.920 5.086 . 0 0 "[ . 1]" 1
1300 1 58 ILE HG13 1 58 ILE MG . . 3.060 2.463 2.426 2.498 . 0 0 "[ . 1]" 1
1301 1 58 ILE MG 1 59 SER H . . 3.140 2.269 1.974 2.501 . 0 0 "[ . 1]" 1
1302 1 58 ILE MG 1 59 SER HA . . 3.920 3.535 3.284 3.806 . 0 0 "[ . 1]" 1
1303 1 58 ILE MG 1 59 SER QB . . 4.510 4.185 4.041 4.294 . 0 0 "[ . 1]" 1
1304 1 58 ILE MG 1 60 ARG H . . 5.500 4.599 4.230 5.091 . 0 0 "[ . 1]" 1
1305 1 59 SER H 1 59 SER HB2 . . 3.950 2.742 2.573 3.174 . 0 0 "[ . 1]" 1
1306 1 59 SER H 1 59 SER QB . . 3.260 2.627 2.530 2.823 . 0 0 "[ . 1]" 1
1307 1 59 SER H 1 59 SER HB3 . . 3.950 3.608 3.062 3.794 . 0 0 "[ . 1]" 1
1308 1 59 SER H 1 60 ARG H . . 4.640 4.369 4.259 4.427 . 0 0 "[ . 1]" 1
1309 1 59 SER H 1 60 ARG HA . . 5.040 4.730 4.522 4.875 . 0 0 "[ . 1]" 1
1310 1 59 SER HA 1 60 ARG QB . . 4.550 3.963 3.892 4.050 . 0 0 "[ . 1]" 1
1311 1 59 SER HA 1 60 ARG QG . . 5.340 5.554 5.336 5.671 0.331 5 0 "[ . 1]" 1
1312 1 59 SER HB2 1 60 ARG H . . 5.500 3.953 3.590 4.249 . 0 0 "[ . 1]" 1
1313 1 59 SER HB3 1 60 ARG H . . 5.500 2.907 2.330 3.501 . 0 0 "[ . 1]" 1
1314 1 60 ARG HA 1 60 ARG QD . . 4.170 3.968 3.692 4.051 . 0 0 "[ . 1]" 1
1315 1 60 ARG HA 1 60 ARG QG . . 3.630 2.451 2.265 3.396 . 0 0 "[ . 1]" 1
1316 1 60 ARG HA 1 61 TYR H . . 2.740 2.215 2.138 2.331 . 0 0 "[ . 1]" 1
1317 1 60 ARG HA 1 61 TYR HB2 . . 4.810 4.317 4.166 4.437 . 0 0 "[ . 1]" 1
1318 1 60 ARG QB 1 60 ARG QD . . 3.160 2.267 2.101 2.369 . 0 0 "[ . 1]" 1
1319 1 60 ARG QB 1 61 TYR H . . 3.590 3.490 2.666 3.727 0.137 9 0 "[ . 1]" 1
1320 1 60 ARG HB2 1 60 ARG QD . . 3.810 2.538 2.371 3.315 . 0 0 "[ . 1]" 1
1321 1 60 ARG HB3 1 60 ARG QD . . 3.810 2.664 2.338 3.022 . 0 0 "[ . 1]" 1
1322 1 60 ARG QD 1 61 TYR H . . 5.210 4.529 4.342 4.812 . 0 0 "[ . 1]" 1
1323 1 60 ARG QG 1 61 TYR H . . 4.060 2.555 2.298 3.035 . 0 0 "[ . 1]" 1
1324 1 60 ARG QG 1 61 TYR QD . . 5.340 5.329 5.147 5.438 0.098 3 0 "[ . 1]" 1
1325 1 60 ARG HG2 1 61 TYR H . . 4.640 2.717 2.348 3.192 . 0 0 "[ . 1]" 1
1326 1 60 ARG HG3 1 61 TYR H . . 4.640 3.269 2.945 4.271 . 0 0 "[ . 1]" 1
1327 1 61 TYR H 1 61 TYR HB2 . . 3.120 2.314 2.139 2.405 . 0 0 "[ . 1]" 1
1328 1 61 TYR H 1 61 TYR HB3 . . 3.610 2.792 2.619 3.444 . 0 0 "[ . 1]" 1
1329 1 61 TYR H 1 61 TYR QD . . 3.980 3.963 2.799 4.154 0.174 9 0 "[ . 1]" 1
1330 1 61 TYR HA 1 61 TYR QD . . 3.760 2.948 2.622 3.083 . 0 0 "[ . 1]" 1
1331 1 61 TYR QD 1 66 GLU HA . . 5.210 3.409 2.430 5.187 . 0 0 "[ . 1]" 1
1332 1 61 TYR QD 1 69 ALA MB . . 4.000 3.092 2.840 3.358 . 0 0 "[ . 1]" 1
1333 1 61 TYR QE 1 69 ALA HA . . 4.340 3.539 3.052 4.064 . 0 0 "[ . 1]" 1
1334 1 61 TYR QE 1 69 ALA MB . . 4.200 3.323 2.867 3.767 . 0 0 "[ . 1]" 1
1335 1 61 TYR QE 1 70 PRO HD2 . . 4.250 2.972 2.550 3.336 . 0 0 "[ . 1]" 1
1336 1 61 TYR QE 1 70 PRO HD3 . . 4.540 3.841 3.604 4.056 . 0 0 "[ . 1]" 1
1337 1 62 ALA MB 1 63 GLY QA . . 4.390 3.687 3.358 3.994 . 0 0 "[ . 1]" 1
1338 1 66 GLU HA 1 66 GLU HG2 . . 3.980 3.341 2.606 3.755 . 0 0 "[ . 1]" 1
1339 1 66 GLU HA 1 66 GLU HG3 . . 3.980 3.428 2.444 3.797 . 0 0 "[ . 1]" 1
1340 1 66 GLU HA 1 69 ALA H . . 4.750 3.782 3.336 4.351 . 0 0 "[ . 1]" 1
1341 1 66 GLU HA 1 69 ALA MB . . 4.300 2.949 2.301 3.848 . 0 0 "[ . 1]" 1
1342 1 66 GLU QB 1 67 GLU HA . . 4.370 4.144 3.837 4.427 0.057 3 0 "[ . 1]" 1
1343 1 67 GLU HA 1 67 GLU QB . . 2.720 2.352 2.180 2.452 . 0 0 "[ . 1]" 1
1344 1 67 GLU HA 1 67 GLU QG . . 3.630 2.628 2.327 3.343 . 0 0 "[ . 1]" 1
1345 1 68 ASN H 1 69 ALA H . . 4.990 2.493 2.384 2.671 . 0 0 "[ . 1]" 1
1346 1 69 ALA H 1 69 ALA MB . . 3.470 2.235 2.218 2.251 . 0 0 "[ . 1]" 1
1347 1 69 ALA HA 1 70 PRO HB3 . . 5.150 4.801 4.709 4.921 . 0 0 "[ . 1]" 1
1348 1 69 ALA HA 1 70 PRO HD2 . . 3.300 2.261 2.137 2.370 . 0 0 "[ . 1]" 1
1349 1 69 ALA HA 1 70 PRO HD3 . . 3.130 2.189 2.074 2.328 . 0 0 "[ . 1]" 1
1350 1 69 ALA HA 1 70 PRO QG . . 4.560 3.884 3.852 3.943 . 0 0 "[ . 1]" 1
1351 1 69 ALA MB 1 70 PRO HD2 . . 3.590 2.657 2.314 3.079 . 0 0 "[ . 1]" 1
1352 1 69 ALA MB 1 70 PRO HD3 . . 4.020 3.594 3.399 3.755 . 0 0 "[ . 1]" 1
1353 1 70 PRO HA 1 71 LEU H . . 2.670 2.399 2.163 2.483 . 0 0 "[ . 1]" 1
1354 1 70 PRO HA 1 71 LEU QB . . 4.300 3.940 3.865 4.187 . 0 0 "[ . 1]" 1
1355 1 70 PRO HB2 1 71 LEU H . . 3.580 2.649 2.505 3.321 . 0 0 "[ . 1]" 1
1356 1 70 PRO HB2 1 72 HIS H . . 5.500 4.923 4.529 5.194 . 0 0 "[ . 1]" 1
1357 1 70 PRO HB3 1 71 LEU H . . 3.810 3.539 3.432 3.905 0.095 9 0 "[ . 1]" 1
1358 1 71 LEU H 1 71 LEU HB2 . . 3.470 2.828 2.173 3.105 . 0 0 "[ . 1]" 1
1359 1 71 LEU H 1 71 LEU QB . . 3.020 2.476 2.150 2.565 . 0 0 "[ . 1]" 1
1360 1 71 LEU H 1 71 LEU HB3 . . 3.470 2.926 2.702 3.530 0.060 5 0 "[ . 1]" 1
1361 1 71 LEU H 1 71 LEU QD . . 4.350 3.695 2.748 3.954 . 0 0 "[ . 1]" 1
1362 1 71 LEU H 1 72 HIS H . . 4.590 4.205 4.029 4.406 . 0 0 "[ . 1]" 1
1363 1 71 LEU HA 1 71 LEU MD1 . . 4.040 2.190 1.905 3.780 . 0 0 "[ . 1]" 1
1364 1 71 LEU HA 1 71 LEU QD . . 2.960 1.995 1.836 2.074 . 0 0 "[ . 1]" 1
1365 1 71 LEU HA 1 71 LEU MD2 . . 4.040 3.383 2.029 3.860 . 0 0 "[ . 1]" 1
1366 1 71 LEU HA 1 71 LEU HG . . 4.260 3.137 2.568 3.703 . 0 0 "[ . 1]" 1
1367 1 71 LEU HA 1 72 HIS H . . 3.110 2.135 2.107 2.161 . 0 0 "[ . 1]" 1
1368 1 71 LEU QB 1 71 LEU QD . . 2.590 1.966 1.929 2.064 . 0 0 "[ . 1]" 1
1369 1 71 LEU QB 1 72 HIS H . . 3.910 3.737 3.253 3.908 . 0 0 "[ . 1]" 1
1370 1 71 LEU HB2 1 71 LEU MD1 . . 3.330 2.524 2.321 3.195 . 0 0 "[ . 1]" 1
1371 1 71 LEU HB2 1 71 LEU MD2 . . 3.330 2.457 2.332 3.197 . 0 0 "[ . 1]" 1
1372 1 71 LEU HB2 1 72 HIS H . . 4.480 4.417 4.350 4.526 0.046 9 0 "[ . 1]" 1
1373 1 71 LEU HB3 1 71 LEU MD1 . . 3.330 2.942 2.322 3.199 . 0 0 "[ . 1]" 1
1374 1 71 LEU HB3 1 71 LEU MD2 . . 3.330 2.514 2.297 3.205 . 0 0 "[ . 1]" 1
1375 1 71 LEU HB3 1 72 HIS H . . 4.480 4.067 3.355 4.365 . 0 0 "[ . 1]" 1
1376 1 71 LEU QD 1 72 HIS H . . 3.880 2.690 1.930 2.986 . 0 0 "[ . 1]" 1
1377 1 71 LEU QD 1 72 HIS HD2 . . 5.440 5.141 4.796 5.494 0.054 8 0 "[ . 1]" 1
1378 1 71 LEU HG 1 72 HIS H . . 5.500 3.874 3.206 5.280 . 0 0 "[ . 1]" 1
1379 1 72 HIS H 1 72 HIS HB2 . . 3.780 2.323 2.194 2.529 . 0 0 "[ . 1]" 1
1380 1 72 HIS H 1 72 HIS QB . . 3.250 2.283 2.171 2.487 . 0 0 "[ . 1]" 1
1381 1 72 HIS H 1 72 HIS HB3 . . 3.780 3.480 2.737 3.683 . 0 0 "[ . 1]" 1
1382 1 72 HIS H 1 73 LYS H . . 5.500 4.580 4.549 4.618 . 0 0 "[ . 1]" 1
1383 1 72 HIS HA 1 72 HIS HD2 . . 3.390 2.709 2.472 3.494 0.104 8 0 "[ . 1]" 1
1384 1 72 HIS HA 1 73 LYS H . . 3.130 2.431 2.306 2.481 . 0 0 "[ . 1]" 1
1385 1 72 HIS QB 1 73 LYS H . . 3.420 2.486 2.321 3.216 . 0 0 "[ . 1]" 1
1386 1 72 HIS HB2 1 73 LYS H . . 4.100 3.789 3.540 4.093 . 0 0 "[ . 1]" 1
1387 1 72 HIS HB3 1 73 LYS H . . 4.100 2.527 2.344 3.363 . 0 0 "[ . 1]" 1
1388 1 72 HIS HD2 1 73 LYS H . . 4.820 4.524 1.863 4.902 0.082 9 0 "[ . 1]" 1
1389 1 73 LYS H 1 73 LYS QB . . 3.400 2.630 2.295 2.924 . 0 0 "[ . 1]" 1
1390 1 73 LYS H 1 73 LYS HG2 . . 4.930 3.434 2.009 4.477 . 0 0 "[ . 1]" 1
1391 1 73 LYS H 1 73 LYS QG . . 4.130 3.072 1.989 4.068 . 0 0 "[ . 1]" 1
1392 1 73 LYS H 1 73 LYS HG3 . . 4.930 3.760 2.395 4.717 . 0 0 "[ . 1]" 1
1393 1 73 LYS H 1 74 LEU H . . 4.990 4.488 4.410 4.557 . 0 0 "[ . 1]" 1
1394 1 73 LYS HA 1 74 LEU H . . 3.230 2.274 2.153 2.425 . 0 0 "[ . 1]" 1
1395 1 73 LYS QE 1 73 LYS QG . . 3.240 2.307 2.132 2.669 . 0 0 "[ . 1]" 1
1396 1 74 LEU H 1 74 LEU HB2 . . 3.880 2.871 2.430 3.873 . 0 0 "[ . 1]" 1
1397 1 74 LEU H 1 74 LEU QB . . 3.180 2.648 2.300 3.202 0.022 10 0 "[ . 1]" 1
1398 1 74 LEU H 1 74 LEU HB3 . . 3.880 3.495 2.810 3.711 . 0 0 "[ . 1]" 1
1399 1 74 LEU HA 1 74 LEU MD1 . . 3.960 3.703 2.975 3.875 . 0 0 "[ . 1]" 1
1400 1 74 LEU HA 1 74 LEU QD . . 3.310 2.410 1.826 3.399 0.089 10 0 "[ . 1]" 1
1401 1 74 LEU HA 1 74 LEU MD2 . . 3.960 2.602 1.842 4.040 0.080 8 0 "[ . 1]" 1
1402 1 74 LEU QB 1 74 LEU QD . . 2.810 1.945 1.887 2.052 . 0 0 "[ . 1]" 1
stop_
save_
Contact the webmaster for help, if required. Tuesday, May 21, 2024 5:09:38 AM GMT (wattos1)