NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
384590 |
1kma   |
5276 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1kma
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 1107
_Distance_constraint_stats_list.Viol_count 1484
_Distance_constraint_stats_list.Viol_total 2214.443
_Distance_constraint_stats_list.Viol_max 0.356
_Distance_constraint_stats_list.Viol_rms 0.0238
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0050
_Distance_constraint_stats_list.Viol_average_violations_only 0.0746
_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 PHE 2.402 0.095 11 0 "[ . 1 . 2]"
1 2 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 GLY 1.945 0.089 16 0 "[ . 1 . 2]"
1 4 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 PRO 2.063 0.090 20 0 "[ . 1 . 2]"
1 6 CYS 2.771 0.122 11 0 "[ . 1 . 2]"
1 8 CYS 0.565 0.036 17 0 "[ . 1 . 2]"
1 9 PRO 1.758 0.077 7 0 "[ . 1 . 2]"
1 10 ARG 1.187 0.071 3 0 "[ . 1 . 2]"
1 11 ALA 5.454 0.105 10 0 "[ . 1 . 2]"
1 12 LEU 4.603 0.088 20 0 "[ . 1 . 2]"
1 13 HIS 0.879 0.073 19 0 "[ . 1 . 2]"
1 14 ARG 2.256 0.090 18 0 "[ . 1 . 2]"
1 15 VAL 5.372 0.246 15 0 "[ . 1 . 2]"
1 16 CYS 3.429 0.086 10 0 "[ . 1 . 2]"
1 17 GLY 6.555 0.263 9 0 "[ . 1 . 2]"
1 18 SER 3.310 0.102 5 0 "[ . 1 . 2]"
1 19 ASP 1.199 0.084 15 0 "[ . 1 . 2]"
1 20 GLY 1.332 0.086 9 0 "[ . 1 . 2]"
1 21 ASN 8.090 0.263 9 0 "[ . 1 . 2]"
1 22 THR 2.622 0.091 13 0 "[ . 1 . 2]"
1 23 TYR 7.240 0.246 15 0 "[ . 1 . 2]"
1 24 SER 0.963 0.077 16 0 "[ . 1 . 2]"
1 25 ASN 0.601 0.073 19 0 "[ . 1 . 2]"
1 26 PRO 0.964 0.089 2 0 "[ . 1 . 2]"
1 27 CYS 4.352 0.093 6 0 "[ . 1 . 2]"
1 28 MET 9.675 0.339 18 0 "[ . 1 . 2]"
1 29 LEU 4.718 0.160 6 0 "[ . 1 . 2]"
1 30 THR 12.360 0.348 5 0 "[ . 1 . 2]"
1 31 CYS 7.390 0.140 19 0 "[ . 1 . 2]"
1 32 ALA 7.665 0.339 18 0 "[ . 1 . 2]"
1 33 LYS 21.465 0.356 5 0 "[ . 1 . 2]"
1 34 HIS 9.874 0.348 5 0 "[ . 1 . 2]"
1 35 GLU 7.721 0.140 19 0 "[ . 1 . 2]"
1 36 GLY 1.452 0.139 20 0 "[ . 1 . 2]"
1 37 ASN 15.048 0.356 5 0 "[ . 1 . 2]"
1 38 PRO 0.897 0.073 10 0 "[ . 1 . 2]"
1 39 ASP 1.716 0.085 15 0 "[ . 1 . 2]"
1 40 LEU 9.099 0.102 6 0 "[ . 1 . 2]"
1 41 VAL 2.591 0.093 12 0 "[ . 1 . 2]"
1 42 GLN 1.052 0.085 17 0 "[ . 1 . 2]"
1 43 VAL 4.424 0.102 5 0 "[ . 1 . 2]"
1 44 HIS 1.925 0.074 15 0 "[ . 1 . 2]"
1 45 GLU 3.080 0.089 2 0 "[ . 1 . 2]"
1 46 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 PRO 0.781 0.081 6 0 "[ . 1 . 2]"
1 48 CYS 5.169 0.087 14 0 "[ . 1 . 2]"
1 49 ASP 2.331 0.099 13 0 "[ . 1 . 2]"
1 50 GLU 0.313 0.080 15 0 "[ . 1 . 2]"
1 51 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 ASP 1.706 0.093 12 0 "[ . 1 . 2]"
1 53 HIS 0.174 0.074 3 0 "[ . 1 . 2]"
1 54 ASP 0.174 0.074 3 0 "[ . 1 . 2]"
1 55 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 PHE HA 1 2 GLN H . . 3.600 2.212 2.095 2.480 . 0 0 "[ . 1 . 2]" 1
2 1 1 PHE HA 1 2 GLN HA . . 5.500 4.016 3.599 4.357 . 0 0 "[ . 1 . 2]" 1
3 1 1 PHE HA 1 2 GLN QG . . 6.500 5.214 3.865 5.723 . 0 0 "[ . 1 . 2]" 1
4 1 1 PHE HA 1 3 GLY H . . 5.500 5.241 4.448 5.589 0.089 16 0 "[ . 1 . 2]" 1
5 1 1 PHE HA 1 5 PRO QG . . 6.500 3.075 2.629 3.641 . 0 0 "[ . 1 . 2]" 1
6 1 1 PHE HA 1 35 GLU HA . . 3.600 3.319 3.025 3.665 0.065 7 0 "[ . 1 . 2]" 1
7 1 1 PHE HA 1 35 GLU HB2 . . 5.500 4.939 4.659 5.554 0.054 16 0 "[ . 1 . 2]" 1
8 1 1 PHE HA 1 35 GLU HB3 . . 5.500 5.584 5.571 5.595 0.095 11 0 "[ . 1 . 2]" 1
9 1 1 PHE HA 1 35 GLU HG2 . . 5.500 3.010 2.688 3.891 . 0 0 "[ . 1 . 2]" 1
10 1 1 PHE HA 1 35 GLU HG3 . . 5.500 4.170 2.960 4.562 . 0 0 "[ . 1 . 2]" 1
11 1 1 PHE QB 1 2 GLN HA . . 5.100 4.094 3.517 4.536 . 0 0 "[ . 1 . 2]" 1
12 1 1 PHE QB 1 2 GLN QB . . 5.980 4.511 4.195 4.715 . 0 0 "[ . 1 . 2]" 1
13 1 1 PHE QB 1 2 GLN QG . . 6.600 4.811 4.140 5.336 . 0 0 "[ . 1 . 2]" 1
14 1 1 PHE QB 1 4 ASN QB . . 7.380 5.448 4.795 5.964 . 0 0 "[ . 1 . 2]" 1
15 1 1 PHE QB 1 5 PRO QG . . 6.600 3.249 2.976 3.487 . 0 0 "[ . 1 . 2]" 1
16 1 1 PHE QB 1 35 GLU H . . 5.100 4.597 4.480 4.675 . 0 0 "[ . 1 . 2]" 1
17 1 1 PHE QB 1 35 GLU HB2 . . 5.100 3.946 3.776 4.168 . 0 0 "[ . 1 . 2]" 1
18 1 1 PHE QB 1 35 GLU HB3 . . 5.100 3.882 3.490 4.380 . 0 0 "[ . 1 . 2]" 1
19 1 2 GLN H 1 3 GLY H . . 5.500 3.379 2.340 4.076 . 0 0 "[ . 1 . 2]" 1
20 1 2 GLN H 1 4 ASN QB . . 6.380 3.807 3.245 4.488 . 0 0 "[ . 1 . 2]" 1
21 1 2 GLN H 1 5 PRO QB . . 6.380 5.004 4.397 5.784 . 0 0 "[ . 1 . 2]" 1
22 1 2 GLN HA 1 3 GLY H . . 3.600 3.053 2.180 3.574 . 0 0 "[ . 1 . 2]" 1
23 1 2 GLN HA 1 3 GLY QA . . 6.500 4.281 3.955 4.463 . 0 0 "[ . 1 . 2]" 1
24 1 2 GLN QB 1 5 PRO QG . . 5.980 4.730 4.439 4.883 . 0 0 "[ . 1 . 2]" 1
25 1 2 GLN QB 1 35 GLU QB . . 7.250 5.701 5.344 5.856 . 0 0 "[ . 1 . 2]" 1
26 1 2 GLN QB 1 35 GLU QG . . 5.350 3.921 3.630 4.087 . 0 0 "[ . 1 . 2]" 1
27 1 2 GLN QG 1 35 GLU QG . . 5.980 3.630 2.686 4.793 . 0 0 "[ . 1 . 2]" 1
28 1 3 GLY H 1 4 ASN QB . . 6.380 4.874 4.031 5.623 . 0 0 "[ . 1 . 2]" 1
29 1 3 GLY H 1 35 GLU HG2 . . 5.500 5.347 4.485 5.574 0.074 20 0 "[ . 1 . 2]" 1
30 1 3 GLY H 1 35 GLU HG3 . . 5.500 5.064 3.857 5.582 0.082 20 0 "[ . 1 . 2]" 1
31 1 3 GLY QA 1 5 PRO QD . . 7.380 3.858 3.412 4.152 . 0 0 "[ . 1 . 2]" 1
32 1 4 ASN QB 1 5 PRO QB . . 6.320 4.452 3.945 4.658 . 0 0 "[ . 1 . 2]" 1
33 1 4 ASN HB2 1 5 PRO HB2 . . 7.250 6.440 5.401 7.098 . 0 0 "[ . 1 . 2]" 1
34 1 4 ASN HB2 1 5 PRO HB3 . . 7.250 5.810 4.374 6.592 . 0 0 "[ . 1 . 2]" 1
35 1 4 ASN HB2 1 5 PRO HD2 . . 5.500 3.051 2.423 3.642 . 0 0 "[ . 1 . 2]" 1
36 1 4 ASN HB2 1 5 PRO HD3 . . 5.500 3.017 2.232 3.829 . 0 0 "[ . 1 . 2]" 1
37 1 4 ASN HB3 1 5 PRO HB2 . . 7.250 6.051 5.317 7.211 . 0 0 "[ . 1 . 2]" 1
38 1 4 ASN HB3 1 5 PRO HB3 . . 7.250 5.173 4.295 6.280 . 0 0 "[ . 1 . 2]" 1
39 1 4 ASN HB3 1 5 PRO HD2 . . 5.500 3.352 2.676 4.709 . 0 0 "[ . 1 . 2]" 1
40 1 4 ASN HB3 1 5 PRO HD3 . . 5.500 2.713 2.221 3.947 . 0 0 "[ . 1 . 2]" 1
41 1 5 PRO HA 1 31 CYS H . . 5.500 5.578 5.557 5.590 0.090 20 0 "[ . 1 . 2]" 1
42 1 5 PRO HA 1 31 CYS HA . . 5.500 3.193 2.988 3.363 . 0 0 "[ . 1 . 2]" 1
43 1 5 PRO HA 1 34 HIS QB . . 6.380 3.770 3.242 4.315 . 0 0 "[ . 1 . 2]" 1
44 1 5 PRO HA 1 35 GLU QG . . 6.380 5.606 5.468 5.758 . 0 0 "[ . 1 . 2]" 1
45 1 5 PRO QB 1 31 CYS HA . . 6.380 2.085 1.985 2.241 . 0 0 "[ . 1 . 2]" 1
46 1 5 PRO QB 1 31 CYS QB . . 7.250 2.875 2.337 3.101 . 0 0 "[ . 1 . 2]" 1
47 1 5 PRO QB 1 32 ALA HA . . 6.380 4.470 4.232 4.692 . 0 0 "[ . 1 . 2]" 1
48 1 5 PRO QB 1 35 GLU HA . . 6.380 3.699 3.393 3.915 . 0 0 "[ . 1 . 2]" 1
49 1 5 PRO QB 1 35 GLU QB . . 3.920 2.692 2.442 2.799 . 0 0 "[ . 1 . 2]" 1
50 1 5 PRO QB 1 35 GLU QG . . 4.390 3.457 3.282 3.618 . 0 0 "[ . 1 . 2]" 1
51 1 5 PRO HB2 1 31 CYS H . . 5.500 4.599 4.470 4.778 . 0 0 "[ . 1 . 2]" 1
52 1 5 PRO HB2 1 35 GLU HB2 . . 5.350 2.855 2.600 2.992 . 0 0 "[ . 1 . 2]" 1
53 1 5 PRO HB2 1 35 GLU HB3 . . 5.350 4.553 4.282 4.720 . 0 0 "[ . 1 . 2]" 1
54 1 5 PRO HB2 1 35 GLU HG2 . . 5.350 4.583 4.199 5.065 . 0 0 "[ . 1 . 2]" 1
55 1 5 PRO HB2 1 35 GLU HG3 . . 5.350 3.900 3.577 4.220 . 0 0 "[ . 1 . 2]" 1
56 1 5 PRO HB3 1 31 CYS H . . 5.500 5.404 5.107 5.560 0.060 10 0 "[ . 1 . 2]" 1
57 1 5 PRO HB3 1 35 GLU HB2 . . 5.350 3.441 3.052 3.584 . 0 0 "[ . 1 . 2]" 1
58 1 5 PRO HB3 1 35 GLU HB3 . . 5.350 5.100 4.775 5.260 . 0 0 "[ . 1 . 2]" 1
59 1 5 PRO HB3 1 35 GLU HG2 . . 5.350 4.850 4.417 5.431 0.081 16 0 "[ . 1 . 2]" 1
60 1 5 PRO HB3 1 35 GLU HG3 . . 5.350 4.692 4.017 5.143 . 0 0 "[ . 1 . 2]" 1
61 1 5 PRO QG 1 31 CYS HA . . 6.500 3.988 3.852 4.140 . 0 0 "[ . 1 . 2]" 1
62 1 5 PRO QG 1 32 ALA MB . . 7.500 5.649 5.300 5.702 . 0 0 "[ . 1 . 2]" 1
63 1 5 PRO QG 1 34 HIS HB2 . . 6.500 4.318 3.606 4.904 . 0 0 "[ . 1 . 2]" 1
64 1 5 PRO QG 1 34 HIS HB3 . . 6.500 3.855 3.172 4.426 . 0 0 "[ . 1 . 2]" 1
65 1 5 PRO QG 1 35 GLU HA . . 6.500 2.394 2.183 2.791 . 0 0 "[ . 1 . 2]" 1
66 1 5 PRO QG 1 35 GLU QB . . 5.980 2.344 2.171 2.658 . 0 0 "[ . 1 . 2]" 1
67 1 6 CYS CB 1 31 CYS SG . . 3.000 3.033 2.931 3.091 0.091 17 0 "[ . 1 . 2]" 1
68 1 6 CYS SG 1 31 CYS CB . . 3.000 3.072 3.027 3.122 0.122 11 0 "[ . 1 . 2]" 1
69 1 6 CYS SG 1 31 CYS SG . . 2.000 2.030 2.021 2.044 0.044 19 0 "[ . 1 . 2]" 1
70 1 8 CYS CB 1 27 CYS SG . . 3.000 2.961 2.923 3.026 0.026 12 0 "[ . 1 . 2]" 1
71 1 8 CYS SG 1 27 CYS CB . . 3.000 2.995 2.922 3.036 0.036 17 0 "[ . 1 . 2]" 1
72 1 8 CYS SG 1 27 CYS SG . . 2.000 2.017 1.997 2.028 0.028 12 0 "[ . 1 . 2]" 1
73 1 9 PRO HA 1 10 ARG H . . 2.700 2.391 2.315 2.520 . 0 0 "[ . 1 . 2]" 1
74 1 9 PRO HA 1 10 ARG HA . . 5.500 4.485 4.425 4.533 . 0 0 "[ . 1 . 2]" 1
75 1 9 PRO HA 1 10 ARG QB . . 6.380 4.540 4.361 4.715 . 0 0 "[ . 1 . 2]" 1
76 1 9 PRO HA 1 11 ALA H . . 5.500 4.257 4.097 4.352 . 0 0 "[ . 1 . 2]" 1
77 1 9 PRO QB 1 25 ASN QD . . 6.320 4.806 4.523 5.029 . 0 0 "[ . 1 . 2]" 1
78 1 9 PRO HB2 1 11 ALA H . . 5.500 3.014 2.726 3.185 . 0 0 "[ . 1 . 2]" 1
79 1 9 PRO HB2 1 11 ALA MB . . 5.800 3.154 2.684 3.558 . 0 0 "[ . 1 . 2]" 1
80 1 9 PRO HB2 1 25 ASN HD21 . . 7.250 5.770 5.323 6.112 . 0 0 "[ . 1 . 2]" 1
81 1 9 PRO HB2 1 25 ASN HD22 . . 7.250 5.609 5.121 6.148 . 0 0 "[ . 1 . 2]" 1
82 1 9 PRO HB3 1 11 ALA H . . 5.500 4.530 4.315 4.684 . 0 0 "[ . 1 . 2]" 1
83 1 9 PRO HB3 1 11 ALA MB . . 5.800 4.386 3.986 4.684 . 0 0 "[ . 1 . 2]" 1
84 1 9 PRO HB3 1 25 ASN HD21 . . 7.250 7.054 6.561 7.314 0.064 11 0 "[ . 1 . 2]" 1
85 1 9 PRO HB3 1 25 ASN HD22 . . 7.250 6.580 6.113 7.115 . 0 0 "[ . 1 . 2]" 1
86 1 9 PRO HD2 1 11 ALA MB . . 5.800 3.808 3.386 4.092 . 0 0 "[ . 1 . 2]" 1
87 1 9 PRO HD2 1 27 CYS HB2 . . 5.500 4.198 4.021 4.521 . 0 0 "[ . 1 . 2]" 1
88 1 9 PRO HD2 1 27 CYS HB3 . . 5.500 4.038 3.819 4.248 . 0 0 "[ . 1 . 2]" 1
89 1 9 PRO HD3 1 11 ALA MB . . 5.800 4.749 4.619 4.782 . 0 0 "[ . 1 . 2]" 1
90 1 9 PRO HD3 1 27 CYS HB2 . . 5.500 5.556 5.463 5.577 0.077 7 0 "[ . 1 . 2]" 1
91 1 9 PRO HD3 1 27 CYS HB3 . . 5.500 5.479 5.262 5.563 0.063 8 0 "[ . 1 . 2]" 1
92 1 9 PRO QG 1 11 ALA H . . 6.500 2.776 2.492 3.361 . 0 0 "[ . 1 . 2]" 1
93 1 9 PRO QG 1 11 ALA MB . . 7.500 2.285 2.182 2.582 . 0 0 "[ . 1 . 2]" 1
94 1 9 PRO QG 1 27 CYS HB2 . . 6.500 5.379 5.018 5.822 . 0 0 "[ . 1 . 2]" 1
95 1 9 PRO QG 1 27 CYS HB3 . . 6.500 5.392 4.928 5.830 . 0 0 "[ . 1 . 2]" 1
96 1 10 ARG H 1 10 ARG QB . . 3.810 2.374 2.167 2.552 . 0 0 "[ . 1 . 2]" 1
97 1 10 ARG H 1 11 ALA H . . 3.600 3.299 3.215 3.442 . 0 0 "[ . 1 . 2]" 1
98 1 10 ARG H 1 11 ALA HA . . 5.500 4.946 4.812 5.164 . 0 0 "[ . 1 . 2]" 1
99 1 10 ARG H 1 11 ALA MB . . 5.800 4.586 4.455 4.774 . 0 0 "[ . 1 . 2]" 1
100 1 10 ARG HA 1 11 ALA H . . 2.700 2.759 2.728 2.771 0.071 3 0 "[ . 1 . 2]" 1
101 1 10 ARG HA 1 11 ALA HA . . 5.500 4.638 4.580 4.692 . 0 0 "[ . 1 . 2]" 1
102 1 10 ARG HA 1 11 ALA MB . . 5.800 4.407 4.351 4.468 . 0 0 "[ . 1 . 2]" 1
103 1 10 ARG HA 1 12 LEU QD . . 7.370 4.061 3.837 4.582 . 0 0 "[ . 1 . 2]" 1
104 1 10 ARG QB 1 11 ALA H . . 4.480 3.945 3.913 3.991 . 0 0 "[ . 1 . 2]" 1
105 1 10 ARG QB 1 11 ALA MB . . 6.680 4.958 4.923 5.015 . 0 0 "[ . 1 . 2]" 1
106 1 10 ARG HB2 1 11 ALA HA . . 5.500 5.068 4.834 5.352 . 0 0 "[ . 1 . 2]" 1
107 1 10 ARG HB3 1 11 ALA HA . . 5.500 5.121 4.929 5.304 . 0 0 "[ . 1 . 2]" 1
108 1 10 ARG QG 1 11 ALA H . . 6.500 4.657 4.483 4.933 . 0 0 "[ . 1 . 2]" 1
109 1 11 ALA H 1 11 ALA HA . . 2.700 2.798 2.793 2.805 0.105 10 0 "[ . 1 . 2]" 1
110 1 11 ALA H 1 11 ALA MB . . 3.000 2.176 2.086 2.222 . 0 0 "[ . 1 . 2]" 1
111 1 11 ALA H 1 12 LEU H . . 5.500 4.483 4.340 4.599 . 0 0 "[ . 1 . 2]" 1
112 1 11 ALA HA 1 12 LEU H . . 2.700 2.205 2.126 2.282 . 0 0 "[ . 1 . 2]" 1
113 1 11 ALA HA 1 12 LEU HA . . 5.500 4.488 4.457 4.540 . 0 0 "[ . 1 . 2]" 1
114 1 11 ALA HA 1 12 LEU HB2 . . 5.500 4.206 4.034 4.297 . 0 0 "[ . 1 . 2]" 1
115 1 11 ALA HA 1 12 LEU HB3 . . 5.500 5.567 5.459 5.588 0.088 20 0 "[ . 1 . 2]" 1
116 1 11 ALA HA 1 12 LEU QD . . 7.370 3.362 3.116 3.813 . 0 0 "[ . 1 . 2]" 1
117 1 11 ALA HA 1 12 LEU HG . . 5.500 5.541 5.443 5.577 0.077 5 0 "[ . 1 . 2]" 1
118 1 11 ALA HA 1 25 ASN QD . . 6.370 4.200 4.054 4.460 . 0 0 "[ . 1 . 2]" 1
119 1 11 ALA MB 1 12 LEU H . . 3.900 3.238 2.971 3.314 . 0 0 "[ . 1 . 2]" 1
120 1 11 ALA MB 1 12 LEU QB . . 6.680 4.584 4.343 4.736 . 0 0 "[ . 1 . 2]" 1
121 1 11 ALA MB 1 25 ASN HD21 . . 5.800 2.846 2.555 3.072 . 0 0 "[ . 1 . 2]" 1
122 1 11 ALA MB 1 25 ASN HD22 . . 5.800 3.708 3.331 4.321 . 0 0 "[ . 1 . 2]" 1
123 1 12 LEU H 1 12 LEU HB2 . . 3.600 2.057 1.949 2.209 . 0 0 "[ . 1 . 2]" 1
124 1 12 LEU H 1 12 LEU QB . . 3.060 2.040 1.935 2.185 . 0 0 "[ . 1 . 2]" 1
125 1 12 LEU H 1 12 LEU HB3 . . 3.600 3.376 3.301 3.474 . 0 0 "[ . 1 . 2]" 1
126 1 12 LEU H 1 12 LEU MD1 . . 5.800 4.078 3.935 4.377 . 0 0 "[ . 1 . 2]" 1
127 1 12 LEU H 1 12 LEU MD2 . . 5.800 2.419 2.258 2.704 . 0 0 "[ . 1 . 2]" 1
128 1 12 LEU H 1 12 LEU HG . . 3.600 3.680 3.666 3.688 0.088 6 0 "[ . 1 . 2]" 1
129 1 12 LEU H 1 13 HIS H . . 5.500 3.503 3.402 4.219 . 0 0 "[ . 1 . 2]" 1
130 1 12 LEU HA 1 13 HIS H . . 2.700 2.683 2.245 2.760 0.060 8 0 "[ . 1 . 2]" 1
131 1 12 LEU HA 1 13 HIS HA . . 5.500 4.639 4.304 4.706 . 0 0 "[ . 1 . 2]" 1
132 1 12 LEU HA 1 13 HIS QB . . 6.380 4.783 4.355 5.016 . 0 0 "[ . 1 . 2]" 1
133 1 12 LEU HA 1 14 ARG H . . 5.500 3.958 3.490 4.492 . 0 0 "[ . 1 . 2]" 1
134 1 12 LEU HA 1 14 ARG QG . . 6.380 3.445 3.024 4.351 . 0 0 "[ . 1 . 2]" 1
135 1 12 LEU HA 1 24 SER QB . . 6.500 3.647 2.654 4.779 . 0 0 "[ . 1 . 2]" 1
136 1 12 LEU HA 1 25 ASN QB . . 6.380 4.255 4.025 4.531 . 0 0 "[ . 1 . 2]" 1
137 1 12 LEU HA 1 25 ASN QD . . 6.370 4.144 3.906 4.865 . 0 0 "[ . 1 . 2]" 1
138 1 12 LEU QB 1 14 ARG H . . 6.380 3.979 3.678 4.370 . 0 0 "[ . 1 . 2]" 1
139 1 12 LEU QB 1 14 ARG QD . . 5.980 4.248 3.716 4.668 . 0 0 "[ . 1 . 2]" 1
140 1 12 LEU QB 1 14 ARG QG . . 7.250 3.544 3.115 4.185 . 0 0 "[ . 1 . 2]" 1
141 1 12 LEU HB2 1 13 HIS H . . 5.500 4.405 4.339 4.617 . 0 0 "[ . 1 . 2]" 1
142 1 12 LEU HB3 1 13 HIS H . . 5.500 4.395 3.983 4.441 . 0 0 "[ . 1 . 2]" 1
143 1 12 LEU QD 1 14 ARG H . . 7.370 4.341 4.142 4.504 . 0 0 "[ . 1 . 2]" 1
144 1 12 LEU QD 1 14 ARG HA . . 7.370 4.903 4.577 5.147 . 0 0 "[ . 1 . 2]" 1
145 1 12 LEU QD 1 14 ARG QG . . 6.020 2.966 2.665 3.294 . 0 0 "[ . 1 . 2]" 1
146 1 12 LEU QD 1 24 SER HA . . 7.370 3.675 2.898 4.109 . 0 0 "[ . 1 . 2]" 1
147 1 12 LEU QD 1 24 SER QB . . 6.470 3.165 2.319 4.031 . 0 0 "[ . 1 . 2]" 1
148 1 12 LEU MD1 1 13 HIS H . . 5.800 4.653 4.311 4.774 . 0 0 "[ . 1 . 2]" 1
149 1 12 LEU MD1 1 14 ARG QD . . 7.500 3.028 2.623 3.358 . 0 0 "[ . 1 . 2]" 1
150 1 12 LEU MD1 1 14 ARG HG2 . . 7.550 3.533 2.824 4.050 . 0 0 "[ . 1 . 2]" 1
151 1 12 LEU MD1 1 14 ARG HG3 . . 7.550 3.368 2.878 4.377 . 0 0 "[ . 1 . 2]" 1
152 1 12 LEU MD1 1 24 SER QB . . 7.500 3.517 2.371 4.787 . 0 0 "[ . 1 . 2]" 1
153 1 12 LEU MD2 1 13 HIS H . . 5.800 4.310 4.038 4.422 . 0 0 "[ . 1 . 2]" 1
154 1 12 LEU MD2 1 14 ARG QD . . 7.500 5.140 4.165 5.622 . 0 0 "[ . 1 . 2]" 1
155 1 12 LEU MD2 1 14 ARG HG2 . . 7.550 5.415 4.617 6.250 . 0 0 "[ . 1 . 2]" 1
156 1 12 LEU MD2 1 14 ARG HG3 . . 7.550 5.359 4.804 6.154 . 0 0 "[ . 1 . 2]" 1
157 1 12 LEU MD2 1 24 SER QB . . 7.500 3.703 2.657 4.650 . 0 0 "[ . 1 . 2]" 1
158 1 13 HIS H 1 13 HIS QB . . 3.810 2.402 2.251 2.823 . 0 0 "[ . 1 . 2]" 1
159 1 13 HIS H 1 14 ARG H . . 5.500 3.547 3.107 3.964 . 0 0 "[ . 1 . 2]" 1
160 1 13 HIS H 1 14 ARG HA . . 5.500 4.474 3.791 4.886 . 0 0 "[ . 1 . 2]" 1
161 1 13 HIS H 1 14 ARG QG . . 6.380 4.381 4.027 4.710 . 0 0 "[ . 1 . 2]" 1
162 1 13 HIS H 1 24 SER QB . . 6.500 4.714 4.203 5.437 . 0 0 "[ . 1 . 2]" 1
163 1 13 HIS H 1 25 ASN H . . 5.500 5.239 4.948 5.547 0.047 10 0 "[ . 1 . 2]" 1
164 1 13 HIS H 1 25 ASN HA . . 5.500 3.603 3.095 3.890 . 0 0 "[ . 1 . 2]" 1
165 1 13 HIS H 1 25 ASN HB2 . . 5.500 4.025 3.768 4.391 . 0 0 "[ . 1 . 2]" 1
166 1 13 HIS H 1 25 ASN HB3 . . 5.500 2.501 2.242 2.838 . 0 0 "[ . 1 . 2]" 1
167 1 13 HIS H 1 25 ASN HD21 . . 5.500 3.539 3.265 4.234 . 0 0 "[ . 1 . 2]" 1
168 1 13 HIS H 1 25 ASN HD22 . . 5.500 5.231 5.015 5.573 0.073 19 0 "[ . 1 . 2]" 1
169 1 13 HIS HA 1 14 ARG H . . 2.700 2.515 2.366 2.712 0.012 17 0 "[ . 1 . 2]" 1
170 1 13 HIS HA 1 14 ARG HA . . 5.500 4.644 4.558 4.740 . 0 0 "[ . 1 . 2]" 1
171 1 13 HIS HA 1 15 VAL QG . . 7.360 4.468 3.688 4.860 . 0 0 "[ . 1 . 2]" 1
172 1 13 HIS QB 1 14 ARG H . . 6.380 3.988 3.895 4.106 . 0 0 "[ . 1 . 2]" 1
173 1 13 HIS QB 1 15 VAL QG . . 8.240 3.308 2.151 4.006 . 0 0 "[ . 1 . 2]" 1
174 1 13 HIS QB 1 25 ASN HA . . 6.380 2.906 2.158 3.311 . 0 0 "[ . 1 . 2]" 1
175 1 13 HIS QB 1 25 ASN QB . . 3.920 2.466 2.128 2.930 . 0 0 "[ . 1 . 2]" 1
176 1 13 HIS QB 1 26 PRO QD . . 6.320 2.599 1.885 3.111 . 0 0 "[ . 1 . 2]" 1
177 1 13 HIS HB2 1 25 ASN HB2 . . 5.350 3.434 2.614 4.625 . 0 0 "[ . 1 . 2]" 1
178 1 13 HIS HB2 1 25 ASN HB3 . . 5.350 2.936 2.237 3.969 . 0 0 "[ . 1 . 2]" 1
179 1 13 HIS HB2 1 26 PRO HD2 . . 7.250 3.536 2.449 5.100 . 0 0 "[ . 1 . 2]" 1
180 1 13 HIS HB2 1 26 PRO HD3 . . 7.250 3.757 2.198 5.334 . 0 0 "[ . 1 . 2]" 1
181 1 13 HIS HB3 1 25 ASN HB2 . . 5.350 4.028 2.783 4.976 . 0 0 "[ . 1 . 2]" 1
182 1 13 HIS HB3 1 25 ASN HB3 . . 5.350 3.779 2.612 4.596 . 0 0 "[ . 1 . 2]" 1
183 1 13 HIS HB3 1 26 PRO HD2 . . 7.250 3.507 2.776 4.451 . 0 0 "[ . 1 . 2]" 1
184 1 13 HIS HB3 1 26 PRO HD3 . . 7.250 3.189 2.161 4.131 . 0 0 "[ . 1 . 2]" 1
185 1 14 ARG H 1 14 ARG HB2 . . 3.600 2.526 2.211 2.753 . 0 0 "[ . 1 . 2]" 1
186 1 14 ARG H 1 14 ARG HB3 . . 3.600 3.610 3.514 3.664 0.064 5 0 "[ . 1 . 2]" 1
187 1 14 ARG H 1 14 ARG QD . . 5.100 3.756 3.328 4.099 . 0 0 "[ . 1 . 2]" 1
188 1 14 ARG H 1 14 ARG HG2 . . 3.600 3.132 2.215 3.690 0.090 18 0 "[ . 1 . 2]" 1
189 1 14 ARG H 1 14 ARG QG . . 3.060 2.260 1.956 2.578 . 0 0 "[ . 1 . 2]" 1
190 1 14 ARG H 1 14 ARG HG3 . . 3.600 2.634 1.990 3.662 0.062 19 0 "[ . 1 . 2]" 1
191 1 14 ARG H 1 15 VAL H . . 5.500 4.626 4.192 4.766 . 0 0 "[ . 1 . 2]" 1
192 1 14 ARG H 1 15 VAL QG . . 7.360 4.329 4.012 4.498 . 0 0 "[ . 1 . 2]" 1
193 1 14 ARG H 1 24 SER HA . . 5.500 4.649 4.313 5.123 . 0 0 "[ . 1 . 2]" 1
194 1 14 ARG HA 1 14 ARG HE . . 5.500 3.895 3.136 4.326 . 0 0 "[ . 1 . 2]" 1
195 1 14 ARG HA 1 15 VAL H . . 2.700 2.218 2.160 2.299 . 0 0 "[ . 1 . 2]" 1
196 1 14 ARG HA 1 15 VAL HA . . 5.500 4.481 4.451 4.533 . 0 0 "[ . 1 . 2]" 1
197 1 14 ARG HA 1 15 VAL MG1 . . 5.800 3.571 3.328 4.061 . 0 0 "[ . 1 . 2]" 1
198 1 14 ARG HA 1 15 VAL QG . . 4.690 3.256 2.985 3.548 . 0 0 "[ . 1 . 2]" 1
199 1 14 ARG HA 1 15 VAL MG2 . . 5.800 3.804 3.253 4.199 . 0 0 "[ . 1 . 2]" 1
200 1 14 ARG HA 1 22 THR MG . . 5.800 3.557 2.905 3.861 . 0 0 "[ . 1 . 2]" 1
201 1 14 ARG HA 1 23 TYR H . . 5.500 4.392 3.787 4.624 . 0 0 "[ . 1 . 2]" 1
202 1 14 ARG HA 1 23 TYR HA . . 5.500 5.493 5.192 5.575 0.075 5 0 "[ . 1 . 2]" 1
203 1 14 ARG HA 1 24 SER H . . 5.500 4.791 4.650 4.920 . 0 0 "[ . 1 . 2]" 1
204 1 14 ARG HA 1 24 SER HA . . 5.500 2.993 2.677 3.287 . 0 0 "[ . 1 . 2]" 1
205 1 14 ARG HA 1 24 SER QB . . 6.500 4.653 4.291 4.975 . 0 0 "[ . 1 . 2]" 1
206 1 14 ARG HA 1 25 ASN H . . 5.500 4.137 3.689 4.703 . 0 0 "[ . 1 . 2]" 1
207 1 14 ARG HA 1 25 ASN HA . . 5.500 3.536 2.886 4.495 . 0 0 "[ . 1 . 2]" 1
208 1 14 ARG HA 1 25 ASN QB . . 6.380 4.719 4.308 5.521 . 0 0 "[ . 1 . 2]" 1
209 1 14 ARG QB 1 15 VAL H . . 4.480 3.053 2.680 3.849 . 0 0 "[ . 1 . 2]" 1
210 1 14 ARG HB2 1 22 THR MG . . 5.800 3.816 3.432 4.333 . 0 0 "[ . 1 . 2]" 1
211 1 14 ARG HB2 1 47 PRO HD2 . . 5.500 4.975 4.418 5.559 0.059 12 0 "[ . 1 . 2]" 1
212 1 14 ARG HB2 1 47 PRO HD3 . . 5.500 3.486 3.002 3.989 . 0 0 "[ . 1 . 2]" 1
213 1 14 ARG HB3 1 22 THR MG . . 5.800 2.484 2.196 2.955 . 0 0 "[ . 1 . 2]" 1
214 1 14 ARG HB3 1 47 PRO HD2 . . 5.500 5.473 5.209 5.581 0.081 6 0 "[ . 1 . 2]" 1
215 1 14 ARG HB3 1 47 PRO HD3 . . 5.500 4.083 3.639 4.603 . 0 0 "[ . 1 . 2]" 1
216 1 14 ARG QD 1 15 VAL H . . 6.500 4.909 3.471 5.823 . 0 0 "[ . 1 . 2]" 1
217 1 14 ARG QD 1 22 THR MG . . 5.700 3.569 2.573 4.240 . 0 0 "[ . 1 . 2]" 1
218 1 14 ARG QD 1 24 SER HA . . 6.500 3.528 1.925 5.191 . 0 0 "[ . 1 . 2]" 1
219 1 14 ARG HE 1 15 VAL QG . . 7.360 5.525 5.178 5.626 . 0 0 "[ . 1 . 2]" 1
220 1 14 ARG QG 1 24 SER H . . 6.380 4.946 4.303 5.818 . 0 0 "[ . 1 . 2]" 1
221 1 14 ARG QG 1 24 SER HA . . 4.480 2.650 2.059 3.995 . 0 0 "[ . 1 . 2]" 1
222 1 14 ARG QG 1 24 SER QB . . 7.380 4.162 3.431 5.390 . 0 0 "[ . 1 . 2]" 1
223 1 14 ARG HG2 1 22 THR MG . . 5.800 3.768 2.819 4.778 . 0 0 "[ . 1 . 2]" 1
224 1 14 ARG HG3 1 22 THR MG . . 5.800 4.412 3.870 4.854 . 0 0 "[ . 1 . 2]" 1
225 1 15 VAL H 1 15 VAL MG1 . . 3.900 2.917 2.617 3.096 . 0 0 "[ . 1 . 2]" 1
226 1 15 VAL H 1 15 VAL QG . . 3.110 2.293 1.996 2.446 . 0 0 "[ . 1 . 2]" 1
227 1 15 VAL H 1 15 VAL MG2 . . 3.900 2.410 2.058 2.641 . 0 0 "[ . 1 . 2]" 1
228 1 15 VAL H 1 16 CYS H . . 5.500 4.481 4.421 4.635 . 0 0 "[ . 1 . 2]" 1
229 1 15 VAL H 1 22 THR HA . . 5.500 4.404 4.114 4.950 . 0 0 "[ . 1 . 2]" 1
230 1 15 VAL H 1 22 THR MG . . 3.900 2.817 2.557 3.246 . 0 0 "[ . 1 . 2]" 1
231 1 15 VAL H 1 23 TYR H . . 3.600 2.737 2.561 3.144 . 0 0 "[ . 1 . 2]" 1
232 1 15 VAL H 1 23 TYR HA . . 5.500 4.792 4.714 5.037 . 0 0 "[ . 1 . 2]" 1
233 1 15 VAL H 1 23 TYR HB2 . . 5.500 3.712 3.412 3.914 . 0 0 "[ . 1 . 2]" 1
234 1 15 VAL H 1 23 TYR HB3 . . 5.500 4.603 3.896 4.842 . 0 0 "[ . 1 . 2]" 1
235 1 15 VAL H 1 23 TYR O . . 1.800 1.876 1.803 1.973 0.173 15 0 "[ . 1 . 2]" 1
236 1 15 VAL H 1 24 SER H . . 5.500 4.987 4.868 5.101 . 0 0 "[ . 1 . 2]" 1
237 1 15 VAL H 1 24 SER HA . . 5.500 4.304 4.023 4.679 . 0 0 "[ . 1 . 2]" 1
238 1 15 VAL H 1 25 ASN H . . 5.500 4.248 4.083 4.485 . 0 0 "[ . 1 . 2]" 1
239 1 15 VAL H 1 25 ASN HA . . 5.500 3.982 3.691 4.354 . 0 0 "[ . 1 . 2]" 1
240 1 15 VAL HA 1 16 CYS H . . 2.700 2.467 2.286 2.648 . 0 0 "[ . 1 . 2]" 1
241 1 15 VAL HA 1 46 GLY H . . 3.600 2.951 2.517 3.344 . 0 0 "[ . 1 . 2]" 1
242 1 15 VAL HA 1 47 PRO QG . . 6.380 4.748 4.393 4.915 . 0 0 "[ . 1 . 2]" 1
243 1 15 VAL HB 1 16 CYS H . . 2.700 2.410 2.050 2.744 0.044 2 0 "[ . 1 . 2]" 1
244 1 15 VAL HB 1 16 CYS QB . . 6.380 4.348 4.104 4.612 . 0 0 "[ . 1 . 2]" 1
245 1 15 VAL HB 1 23 TYR H . . 5.500 4.982 4.786 5.205 . 0 0 "[ . 1 . 2]" 1
246 1 15 VAL HB 1 26 PRO QB . . 4.480 3.604 3.530 3.631 . 0 0 "[ . 1 . 2]" 1
247 1 15 VAL HB 1 26 PRO QD . . 6.380 4.395 4.099 4.815 . 0 0 "[ . 1 . 2]" 1
248 1 15 VAL HB 1 26 PRO QG . . 6.380 4.785 4.540 4.930 . 0 0 "[ . 1 . 2]" 1
249 1 15 VAL HB 1 45 GLU HA . . 5.500 2.362 2.086 2.712 . 0 0 "[ . 1 . 2]" 1
250 1 15 VAL HB 1 46 GLY H . . 5.500 3.406 2.729 3.917 . 0 0 "[ . 1 . 2]" 1
251 1 15 VAL HB 1 47 PRO HA . . 5.500 4.747 4.492 4.912 . 0 0 "[ . 1 . 2]" 1
252 1 15 VAL HB 1 47 PRO QB . . 6.500 5.689 5.487 5.737 . 0 0 "[ . 1 . 2]" 1
253 1 15 VAL HB 1 47 PRO QD . . 6.380 5.495 5.262 5.687 . 0 0 "[ . 1 . 2]" 1
254 1 15 VAL QG 1 16 CYS H . . 4.690 3.098 2.817 3.370 . 0 0 "[ . 1 . 2]" 1
255 1 15 VAL QG 1 17 GLY H . . 7.360 4.278 4.039 4.614 . 0 0 "[ . 1 . 2]" 1
256 1 15 VAL QG 1 17 GLY QA . . 7.310 4.229 3.966 4.626 . 0 0 "[ . 1 . 2]" 1
257 1 15 VAL QG 1 23 TYR QB . . 5.010 2.211 1.892 2.509 . 0 0 "[ . 1 . 2]" 1
258 1 15 VAL QG 1 24 SER H . . 7.360 4.731 4.520 4.929 . 0 0 "[ . 1 . 2]" 1
259 1 15 VAL QG 1 24 SER HA . . 7.360 4.770 4.450 5.046 . 0 0 "[ . 1 . 2]" 1
260 1 15 VAL QG 1 24 SER QB . . 9.060 5.122 4.975 5.269 . 0 0 "[ . 1 . 2]" 1
261 1 15 VAL QG 1 25 ASN QB . . 7.310 3.738 3.596 3.874 . 0 0 "[ . 1 . 2]" 1
262 1 15 VAL QG 1 26 PRO HA . . 4.690 2.028 1.884 2.218 . 0 0 "[ . 1 . 2]" 1
263 1 15 VAL QG 1 26 PRO QB . . 6.020 2.084 1.989 2.219 . 0 0 "[ . 1 . 2]" 1
264 1 15 VAL QG 1 26 PRO QD . . 6.020 1.942 1.895 2.064 . 0 0 "[ . 1 . 2]" 1
265 1 15 VAL QG 1 26 PRO QG . . 4.610 2.585 2.270 2.683 . 0 0 "[ . 1 . 2]" 1
266 1 15 VAL QG 1 29 LEU H . . 7.360 3.913 3.666 4.140 . 0 0 "[ . 1 . 2]" 1
267 1 15 VAL QG 1 29 LEU QB . . 5.390 2.899 2.648 3.051 . 0 0 "[ . 1 . 2]" 1
268 1 15 VAL QG 1 29 LEU QD . . 8.030 2.373 2.131 2.856 . 0 0 "[ . 1 . 2]" 1
269 1 15 VAL QG 1 44 HIS H . . 7.360 5.011 4.872 5.295 . 0 0 "[ . 1 . 2]" 1
270 1 15 VAL QG 1 45 GLU QB . . 8.240 3.158 2.137 3.641 . 0 0 "[ . 1 . 2]" 1
271 1 15 VAL QG 1 45 GLU QG . . 8.240 2.475 1.895 3.979 . 0 0 "[ . 1 . 2]" 1
272 1 15 VAL QG 1 46 GLY H . . 4.690 2.410 1.821 3.440 . 0 0 "[ . 1 . 2]" 1
273 1 15 VAL QG 1 46 GLY QA . . 6.340 3.378 2.731 3.957 . 0 0 "[ . 1 . 2]" 1
274 1 15 VAL QG 1 47 PRO HA . . 7.360 4.247 4.121 4.402 . 0 0 "[ . 1 . 2]" 1
275 1 15 VAL QG 1 47 PRO QB . . 9.060 4.427 4.279 4.524 . 0 0 "[ . 1 . 2]" 1
276 1 15 VAL QG 1 47 PRO QG . . 8.240 5.209 4.823 5.399 . 0 0 "[ . 1 . 2]" 1
277 1 15 VAL MG1 1 16 CYS H . . 5.800 3.787 3.617 3.915 . 0 0 "[ . 1 . 2]" 1
278 1 15 VAL MG1 1 17 GLY HA2 . . 8.920 6.778 6.402 7.014 . 0 0 "[ . 1 . 2]" 1
279 1 15 VAL MG1 1 17 GLY HA3 . . 8.920 7.411 7.002 7.521 . 0 0 "[ . 1 . 2]" 1
280 1 15 VAL MG1 1 22 THR MG . . 6.800 4.658 4.559 4.692 . 0 0 "[ . 1 . 2]" 1
281 1 15 VAL MG1 1 23 TYR H . . 5.800 4.811 4.555 4.906 . 0 0 "[ . 1 . 2]" 1
282 1 15 VAL MG1 1 23 TYR HB2 . . 7.020 4.554 4.116 4.896 . 0 0 "[ . 1 . 2]" 1
283 1 15 VAL MG1 1 23 TYR HB3 . . 7.020 5.300 4.588 5.665 . 0 0 "[ . 1 . 2]" 1
284 1 15 VAL MG1 1 25 ASN H . . 5.800 4.462 3.989 4.746 . 0 0 "[ . 1 . 2]" 1
285 1 15 VAL MG1 1 25 ASN HA . . 5.800 2.734 2.341 3.131 . 0 0 "[ . 1 . 2]" 1
286 1 15 VAL MG1 1 25 ASN HB2 . . 8.920 4.468 4.183 4.784 . 0 0 "[ . 1 . 2]" 1
287 1 15 VAL MG1 1 25 ASN HB3 . . 8.920 4.680 4.365 4.915 . 0 0 "[ . 1 . 2]" 1
288 1 15 VAL MG1 1 26 PRO HA . . 5.800 3.438 3.063 3.852 . 0 0 "[ . 1 . 2]" 1
289 1 15 VAL MG1 1 26 PRO HB2 . . 7.550 3.884 3.657 4.160 . 0 0 "[ . 1 . 2]" 1
290 1 15 VAL MG1 1 26 PRO HB3 . . 7.550 2.382 2.148 2.683 . 0 0 "[ . 1 . 2]" 1
291 1 15 VAL MG1 1 26 PRO HD2 . . 7.550 3.434 3.372 3.541 . 0 0 "[ . 1 . 2]" 1
292 1 15 VAL MG1 1 26 PRO HD3 . . 7.550 1.982 1.942 2.100 . 0 0 "[ . 1 . 2]" 1
293 1 15 VAL MG1 1 26 PRO HG2 . . 5.800 3.908 3.597 4.073 . 0 0 "[ . 1 . 2]" 1
294 1 15 VAL MG1 1 26 PRO HG3 . . 5.800 2.686 2.317 2.818 . 0 0 "[ . 1 . 2]" 1
295 1 15 VAL MG1 1 29 LEU HB2 . . 7.020 5.556 5.190 5.873 . 0 0 "[ . 1 . 2]" 1
296 1 15 VAL MG1 1 29 LEU HB3 . . 7.020 5.229 5.018 5.544 . 0 0 "[ . 1 . 2]" 1
297 1 15 VAL MG1 1 46 GLY H . . 5.800 2.428 1.822 3.518 . 0 0 "[ . 1 . 2]" 1
298 1 15 VAL MG2 1 16 CYS H . . 5.800 3.308 2.935 3.815 . 0 0 "[ . 1 . 2]" 1
299 1 15 VAL MG2 1 17 GLY HA2 . . 8.920 4.689 4.308 5.255 . 0 0 "[ . 1 . 2]" 1
300 1 15 VAL MG2 1 17 GLY HA3 . . 8.920 5.009 4.614 5.413 . 0 0 "[ . 1 . 2]" 1
301 1 15 VAL MG2 1 22 THR MG . . 6.800 3.984 3.815 4.106 . 0 0 "[ . 1 . 2]" 1
302 1 15 VAL MG2 1 23 TYR H . . 5.800 2.974 2.618 3.124 . 0 0 "[ . 1 . 2]" 1
303 1 15 VAL MG2 1 23 TYR HB2 . . 7.020 2.255 1.939 2.566 . 0 0 "[ . 1 . 2]" 1
304 1 15 VAL MG2 1 23 TYR HB3 . . 7.020 3.315 2.499 3.733 . 0 0 "[ . 1 . 2]" 1
305 1 15 VAL MG2 1 25 ASN H . . 5.800 3.373 3.077 3.569 . 0 0 "[ . 1 . 2]" 1
306 1 15 VAL MG2 1 25 ASN HA . . 5.800 3.132 2.677 3.539 . 0 0 "[ . 1 . 2]" 1
307 1 15 VAL MG2 1 25 ASN HB2 . . 8.920 4.794 4.490 5.142 . 0 0 "[ . 1 . 2]" 1
308 1 15 VAL MG2 1 25 ASN HB3 . . 8.920 5.105 4.700 5.432 . 0 0 "[ . 1 . 2]" 1
309 1 15 VAL MG2 1 26 PRO HA . . 5.800 2.043 1.897 2.232 . 0 0 "[ . 1 . 2]" 1
310 1 15 VAL MG2 1 26 PRO HB2 . . 7.550 3.718 3.547 4.013 . 0 0 "[ . 1 . 2]" 1
311 1 15 VAL MG2 1 26 PRO HB3 . . 7.550 2.369 2.163 2.776 . 0 0 "[ . 1 . 2]" 1
312 1 15 VAL MG2 1 26 PRO HD2 . . 7.550 4.154 3.775 4.500 . 0 0 "[ . 1 . 2]" 1
313 1 15 VAL MG2 1 26 PRO HD3 . . 7.550 3.098 2.586 3.520 . 0 0 "[ . 1 . 2]" 1
314 1 15 VAL MG2 1 26 PRO HG2 . . 5.800 4.521 4.359 4.701 . 0 0 "[ . 1 . 2]" 1
315 1 15 VAL MG2 1 26 PRO HG3 . . 5.800 3.941 3.784 4.124 . 0 0 "[ . 1 . 2]" 1
316 1 15 VAL MG2 1 29 LEU HB2 . . 7.020 3.252 2.945 3.467 . 0 0 "[ . 1 . 2]" 1
317 1 15 VAL MG2 1 29 LEU HB3 . . 7.020 3.333 3.041 3.675 . 0 0 "[ . 1 . 2]" 1
318 1 15 VAL MG2 1 46 GLY H . . 5.800 4.668 4.279 4.962 . 0 0 "[ . 1 . 2]" 1
319 1 15 VAL N 1 23 TYR O . . 2.700 2.864 2.802 2.946 0.246 15 0 "[ . 1 . 2]" 1
320 1 15 VAL O 1 23 TYR H . . 1.800 1.735 1.693 1.892 0.092 6 0 "[ . 1 . 2]" 1
321 1 15 VAL O 1 23 TYR N . . 2.700 2.717 2.681 2.838 0.138 6 0 "[ . 1 . 2]" 1
322 1 16 CYS CB 1 48 CYS SG . . 3.000 2.989 2.930 3.050 0.050 20 0 "[ . 1 . 2]" 1
323 1 16 CYS H 1 16 CYS HB2 . . 3.600 2.888 2.528 3.484 . 0 0 "[ . 1 . 2]" 1
324 1 16 CYS H 1 16 CYS HB3 . . 3.600 2.379 2.219 2.518 . 0 0 "[ . 1 . 2]" 1
325 1 16 CYS H 1 17 GLY H . . 5.500 4.512 4.352 4.618 . 0 0 "[ . 1 . 2]" 1
326 1 16 CYS H 1 22 THR HA . . 5.500 4.527 4.450 4.615 . 0 0 "[ . 1 . 2]" 1
327 1 16 CYS H 1 22 THR MG . . 5.800 4.330 3.954 4.641 . 0 0 "[ . 1 . 2]" 1
328 1 16 CYS H 1 23 TYR H . . 5.500 4.798 4.585 4.904 . 0 0 "[ . 1 . 2]" 1
329 1 16 CYS H 1 43 VAL QG . . 7.360 4.145 3.865 4.363 . 0 0 "[ . 1 . 2]" 1
330 1 16 CYS H 1 44 HIS H . . 5.500 4.694 3.694 5.332 . 0 0 "[ . 1 . 2]" 1
331 1 16 CYS H 1 45 GLU H . . 5.500 5.491 5.149 5.575 0.075 3 0 "[ . 1 . 2]" 1
332 1 16 CYS H 1 45 GLU HA . . 5.500 3.796 3.245 4.366 . 0 0 "[ . 1 . 2]" 1
333 1 16 CYS H 1 46 GLY H . . 5.500 3.990 2.568 4.857 . 0 0 "[ . 1 . 2]" 1
334 1 16 CYS H 1 46 GLY QA . . 6.380 4.247 3.919 4.711 . 0 0 "[ . 1 . 2]" 1
335 1 16 CYS H 1 47 PRO HA . . 3.600 3.212 2.658 3.652 0.052 1 0 "[ . 1 . 2]" 1
336 1 16 CYS H 1 47 PRO QB . . 6.500 4.841 4.356 5.203 . 0 0 "[ . 1 . 2]" 1
337 1 16 CYS HA 1 17 GLY H . . 2.700 2.188 2.093 2.279 . 0 0 "[ . 1 . 2]" 1
338 1 16 CYS HA 1 17 GLY QA . . 6.380 3.972 3.874 4.055 . 0 0 "[ . 1 . 2]" 1
339 1 16 CYS HA 1 22 THR H . . 5.500 4.208 4.038 4.399 . 0 0 "[ . 1 . 2]" 1
340 1 16 CYS HA 1 22 THR MG . . 5.800 3.444 3.085 3.625 . 0 0 "[ . 1 . 2]" 1
341 1 16 CYS HA 1 23 TYR H . . 3.600 3.432 3.031 3.662 0.062 11 0 "[ . 1 . 2]" 1
342 1 16 CYS HA 1 48 CYS H . . 5.500 3.358 2.795 3.910 . 0 0 "[ . 1 . 2]" 1
343 1 16 CYS QB 1 22 THR MG . . 6.680 3.717 3.210 4.050 . 0 0 "[ . 1 . 2]" 1
344 1 16 CYS QB 1 43 VAL QG . . 8.240 3.246 2.606 3.824 . 0 0 "[ . 1 . 2]" 1
345 1 16 CYS QB 1 44 HIS H . . 6.380 4.564 3.556 5.318 . 0 0 "[ . 1 . 2]" 1
346 1 16 CYS QB 1 47 PRO HA . . 4.480 2.646 2.300 3.011 . 0 0 "[ . 1 . 2]" 1
347 1 16 CYS QB 1 47 PRO QG . . 7.250 5.222 4.981 5.466 . 0 0 "[ . 1 . 2]" 1
348 1 16 CYS QB 1 48 CYS QB . . 4.390 2.737 2.058 3.219 . 0 0 "[ . 1 . 2]" 1
349 1 16 CYS QB 1 49 ASP QB . . 7.380 5.594 5.254 5.853 . 0 0 "[ . 1 . 2]" 1
350 1 16 CYS HB2 1 17 GLY H . . 5.500 4.120 3.688 4.410 . 0 0 "[ . 1 . 2]" 1
351 1 16 CYS HB2 1 48 CYS H . . 3.600 1.983 1.871 2.122 . 0 0 "[ . 1 . 2]" 1
352 1 16 CYS HB2 1 48 CYS HA . . 5.500 3.669 3.133 4.082 . 0 0 "[ . 1 . 2]" 1
353 1 16 CYS HB2 1 48 CYS HB2 . . 5.350 2.844 2.087 3.426 . 0 0 "[ . 1 . 2]" 1
354 1 16 CYS HB2 1 48 CYS HB3 . . 5.350 4.136 3.677 4.457 . 0 0 "[ . 1 . 2]" 1
355 1 16 CYS HB3 1 17 GLY H . . 5.500 4.270 4.033 4.408 . 0 0 "[ . 1 . 2]" 1
356 1 16 CYS HB3 1 48 CYS H . . 3.600 3.557 2.674 3.686 0.086 10 0 "[ . 1 . 2]" 1
357 1 16 CYS HB3 1 48 CYS HA . . 5.500 4.537 3.840 5.005 . 0 0 "[ . 1 . 2]" 1
358 1 16 CYS HB3 1 48 CYS HB2 . . 5.350 4.124 3.466 4.563 . 0 0 "[ . 1 . 2]" 1
359 1 16 CYS HB3 1 48 CYS HB3 . . 5.350 5.137 4.567 5.423 0.073 12 0 "[ . 1 . 2]" 1
360 1 16 CYS SG 1 48 CYS CB . . 3.000 3.010 2.961 3.042 0.042 5 0 "[ . 1 . 2]" 1
361 1 16 CYS SG 1 48 CYS SG . . 2.000 2.028 2.015 2.036 0.036 8 0 "[ . 1 . 2]" 1
362 1 17 GLY H 1 19 ASP H . . 5.500 4.804 4.350 5.342 . 0 0 "[ . 1 . 2]" 1
363 1 17 GLY H 1 20 GLY H . . 5.500 4.339 3.769 5.320 . 0 0 "[ . 1 . 2]" 1
364 1 17 GLY H 1 21 ASN H . . 5.500 3.654 3.363 3.907 . 0 0 "[ . 1 . 2]" 1
365 1 17 GLY H 1 21 ASN HA . . 5.500 4.626 4.395 4.873 . 0 0 "[ . 1 . 2]" 1
366 1 17 GLY H 1 21 ASN O . . 1.800 1.885 1.811 1.988 0.188 7 0 "[ . 1 . 2]" 1
367 1 17 GLY H 1 22 THR HA . . 3.600 3.175 2.632 3.478 . 0 0 "[ . 1 . 2]" 1
368 1 17 GLY H 1 23 TYR H . . 5.500 4.377 3.884 4.710 . 0 0 "[ . 1 . 2]" 1
369 1 17 GLY H 1 40 LEU QD . . 7.370 4.314 3.822 4.949 . 0 0 "[ . 1 . 2]" 1
370 1 17 GLY QA 1 18 SER HA . . 4.480 3.940 3.783 4.066 . 0 0 "[ . 1 . 2]" 1
371 1 17 GLY QA 1 21 ASN QB . . 7.250 3.576 2.883 4.810 . 0 0 "[ . 1 . 2]" 1
372 1 17 GLY QA 1 22 THR HA . . 6.380 5.005 4.548 5.331 . 0 0 "[ . 1 . 2]" 1
373 1 17 GLY QA 1 23 TYR H . . 6.380 5.558 5.031 5.786 . 0 0 "[ . 1 . 2]" 1
374 1 17 GLY QA 1 29 LEU QD . . 7.320 2.308 2.037 2.691 . 0 0 "[ . 1 . 2]" 1
375 1 17 GLY QA 1 40 LEU HG . . 6.380 4.967 4.433 5.532 . 0 0 "[ . 1 . 2]" 1
376 1 17 GLY QA 1 43 VAL HB . . 6.380 5.090 4.877 5.229 . 0 0 "[ . 1 . 2]" 1
377 1 17 GLY QA 1 43 VAL QG . . 6.340 2.188 2.060 2.376 . 0 0 "[ . 1 . 2]" 1
378 1 17 GLY HA2 1 18 SER H . . 2.700 2.282 2.175 2.347 . 0 0 "[ . 1 . 2]" 1
379 1 17 GLY HA2 1 19 ASP H . . 5.500 4.605 4.038 5.181 . 0 0 "[ . 1 . 2]" 1
380 1 17 GLY HA2 1 21 ASN H . . 5.500 5.428 5.064 5.580 0.080 9 0 "[ . 1 . 2]" 1
381 1 17 GLY HA2 1 29 LEU MD1 . . 8.940 2.452 2.169 2.833 . 0 0 "[ . 1 . 2]" 1
382 1 17 GLY HA2 1 29 LEU MD2 . . 8.940 4.323 4.008 4.559 . 0 0 "[ . 1 . 2]" 1
383 1 17 GLY HA2 1 43 VAL H . . 5.500 3.131 2.637 3.697 . 0 0 "[ . 1 . 2]" 1
384 1 17 GLY HA3 1 18 SER H . . 2.700 2.772 2.762 2.784 0.084 9 0 "[ . 1 . 2]" 1
385 1 17 GLY HA3 1 19 ASP H . . 5.500 3.781 3.061 4.556 . 0 0 "[ . 1 . 2]" 1
386 1 17 GLY HA3 1 21 ASN H . . 5.500 4.353 3.696 4.597 . 0 0 "[ . 1 . 2]" 1
387 1 17 GLY HA3 1 29 LEU MD1 . . 8.940 2.898 2.444 3.523 . 0 0 "[ . 1 . 2]" 1
388 1 17 GLY HA3 1 29 LEU MD2 . . 8.940 4.774 4.115 5.203 . 0 0 "[ . 1 . 2]" 1
389 1 17 GLY HA3 1 43 VAL H . . 5.500 4.766 4.341 5.241 . 0 0 "[ . 1 . 2]" 1
390 1 17 GLY N 1 21 ASN O . . 2.700 2.842 2.774 2.963 0.263 9 0 "[ . 1 . 2]" 1
391 1 18 SER H 1 18 SER HA . . 2.700 2.573 2.394 2.703 0.003 20 0 "[ . 1 . 2]" 1
392 1 18 SER H 1 18 SER QB . . 3.420 2.138 2.023 2.292 . 0 0 "[ . 1 . 2]" 1
393 1 18 SER H 1 19 ASP H . . 5.500 3.271 2.988 3.657 . 0 0 "[ . 1 . 2]" 1
394 1 18 SER H 1 20 GLY H . . 5.500 4.525 4.177 5.183 . 0 0 "[ . 1 . 2]" 1
395 1 18 SER H 1 23 TYR QE . . 7.630 5.331 4.840 5.775 . 0 0 "[ . 1 . 2]" 1
396 1 18 SER H 1 29 LEU QD . . 7.370 3.850 3.326 4.196 . 0 0 "[ . 1 . 2]" 1
397 1 18 SER H 1 40 LEU HA . . 5.500 4.415 3.845 4.672 . 0 0 "[ . 1 . 2]" 1
398 1 18 SER H 1 41 VAL H . . 5.500 3.157 2.621 3.377 . 0 0 "[ . 1 . 2]" 1
399 1 18 SER H 1 41 VAL QG . . 7.360 2.964 2.609 3.299 . 0 0 "[ . 1 . 2]" 1
400 1 18 SER H 1 42 GLN HA . . 5.500 4.770 3.962 5.095 . 0 0 "[ . 1 . 2]" 1
401 1 18 SER H 1 43 VAL MG1 . . 3.900 2.680 2.335 2.854 . 0 0 "[ . 1 . 2]" 1
402 1 18 SER H 1 43 VAL QG . . 3.110 2.153 2.048 2.195 . 0 0 "[ . 1 . 2]" 1
403 1 18 SER H 1 43 VAL MG2 . . 3.900 2.285 2.102 2.523 . 0 0 "[ . 1 . 2]" 1
404 1 18 SER H 1 44 HIS H . . 5.500 5.443 5.167 5.572 0.072 5 0 "[ . 1 . 2]" 1
405 1 18 SER HA 1 19 ASP H . . 3.600 3.456 3.346 3.554 . 0 0 "[ . 1 . 2]" 1
406 1 18 SER HA 1 20 GLY H . . 5.500 3.526 3.300 3.782 . 0 0 "[ . 1 . 2]" 1
407 1 18 SER HA 1 20 GLY QA . . 6.380 5.023 4.587 5.354 . 0 0 "[ . 1 . 2]" 1
408 1 18 SER HA 1 43 VAL HB . . 5.500 3.917 3.749 4.146 . 0 0 "[ . 1 . 2]" 1
409 1 18 SER HA 1 43 VAL MG1 . . 3.900 1.911 1.840 2.004 . 0 0 "[ . 1 . 2]" 1
410 1 18 SER HA 1 43 VAL MG2 . . 3.900 2.389 2.105 2.788 . 0 0 "[ . 1 . 2]" 1
411 1 18 SER QB 1 43 VAL QG . . 5.040 2.013 1.869 2.320 . 0 0 "[ . 1 . 2]" 1
412 1 18 SER HB2 1 19 ASP H . . 5.500 3.999 3.510 4.357 . 0 0 "[ . 1 . 2]" 1
413 1 18 SER HB2 1 41 VAL H . . 5.500 4.831 3.909 5.420 . 0 0 "[ . 1 . 2]" 1
414 1 18 SER HB2 1 43 VAL HA . . 5.500 5.499 4.920 5.591 0.091 4 0 "[ . 1 . 2]" 1
415 1 18 SER HB2 1 43 VAL MG1 . . 5.800 2.573 2.126 2.824 . 0 0 "[ . 1 . 2]" 1
416 1 18 SER HB2 1 43 VAL MG2 . . 5.800 4.047 3.687 4.352 . 0 0 "[ . 1 . 2]" 1
417 1 18 SER HB3 1 19 ASP H . . 5.500 3.864 3.414 4.326 . 0 0 "[ . 1 . 2]" 1
418 1 18 SER HB3 1 41 VAL H . . 5.500 3.251 2.582 3.845 . 0 0 "[ . 1 . 2]" 1
419 1 18 SER HB3 1 43 VAL HA . . 5.500 4.896 4.484 5.602 0.102 5 0 "[ . 1 . 2]" 1
420 1 18 SER HB3 1 43 VAL MG1 . . 5.800 2.193 1.926 2.737 . 0 0 "[ . 1 . 2]" 1
421 1 18 SER HB3 1 43 VAL MG2 . . 5.800 3.383 3.082 3.791 . 0 0 "[ . 1 . 2]" 1
422 1 19 ASP H 1 19 ASP HB2 . . 3.600 2.306 2.044 3.017 . 0 0 "[ . 1 . 2]" 1
423 1 19 ASP H 1 19 ASP HB3 . . 3.600 3.188 2.086 3.517 . 0 0 "[ . 1 . 2]" 1
424 1 19 ASP H 1 20 GLY H . . 3.600 2.870 2.459 3.396 . 0 0 "[ . 1 . 2]" 1
425 1 19 ASP H 1 20 GLY QA . . 6.380 4.688 4.418 4.939 . 0 0 "[ . 1 . 2]" 1
426 1 19 ASP H 1 21 ASN QB . . 6.380 3.582 2.708 4.784 . 0 0 "[ . 1 . 2]" 1
427 1 19 ASP H 1 23 TYR QE . . 7.630 5.253 4.289 5.667 . 0 0 "[ . 1 . 2]" 1
428 1 19 ASP H 1 40 LEU HA . . 5.500 5.054 4.030 5.491 . 0 0 "[ . 1 . 2]" 1
429 1 19 ASP H 1 41 VAL H . . 5.500 5.275 4.446 5.571 0.071 14 0 "[ . 1 . 2]" 1
430 1 19 ASP H 1 41 VAL QG . . 7.360 4.858 4.711 5.120 . 0 0 "[ . 1 . 2]" 1
431 1 19 ASP H 1 43 VAL MG1 . . 5.800 4.663 4.398 4.768 . 0 0 "[ . 1 . 2]" 1
432 1 19 ASP H 1 43 VAL MG2 . . 5.800 4.462 4.193 4.753 . 0 0 "[ . 1 . 2]" 1
433 1 19 ASP HA 1 21 ASN H . . 5.500 4.091 3.890 4.384 . 0 0 "[ . 1 . 2]" 1
434 1 19 ASP HA 1 43 VAL QG . . 7.360 5.275 4.828 5.392 . 0 0 "[ . 1 . 2]" 1
435 1 19 ASP QB 1 21 ASN QB . . 7.250 2.189 1.877 3.611 . 0 0 "[ . 1 . 2]" 1
436 1 19 ASP QB 1 40 LEU QD . . 8.250 4.718 3.921 5.087 . 0 0 "[ . 1 . 2]" 1
437 1 19 ASP QB 1 43 VAL QG . . 8.240 5.204 4.890 5.347 . 0 0 "[ . 1 . 2]" 1
438 1 19 ASP HB2 1 20 GLY H . . 5.500 3.915 3.234 4.578 . 0 0 "[ . 1 . 2]" 1
439 1 19 ASP HB2 1 21 ASN H . . 5.500 3.053 1.903 4.590 . 0 0 "[ . 1 . 2]" 1
440 1 19 ASP HB2 1 21 ASN HD21 . . 5.500 4.060 3.256 5.274 . 0 0 "[ . 1 . 2]" 1
441 1 19 ASP HB2 1 21 ASN HD22 . . 5.500 5.153 3.566 5.563 0.063 16 0 "[ . 1 . 2]" 1
442 1 19 ASP HB3 1 20 GLY H . . 5.500 4.131 3.525 4.523 . 0 0 "[ . 1 . 2]" 1
443 1 19 ASP HB3 1 21 ASN H . . 5.500 3.199 2.359 4.541 . 0 0 "[ . 1 . 2]" 1
444 1 19 ASP HB3 1 21 ASN HD21 . . 5.500 3.817 3.056 5.257 . 0 0 "[ . 1 . 2]" 1
445 1 19 ASP HB3 1 21 ASN HD22 . . 5.500 5.008 2.213 5.584 0.084 15 0 "[ . 1 . 2]" 1
446 1 20 GLY H 1 21 ASN H . . 3.600 2.421 2.145 2.637 . 0 0 "[ . 1 . 2]" 1
447 1 20 GLY H 1 21 ASN HB2 . . 5.500 4.547 3.814 5.581 0.081 14 0 "[ . 1 . 2]" 1
448 1 20 GLY H 1 21 ASN HB3 . . 5.500 4.792 4.001 5.581 0.081 20 0 "[ . 1 . 2]" 1
449 1 20 GLY H 1 43 VAL MG1 . . 5.800 4.732 4.693 4.763 . 0 0 "[ . 1 . 2]" 1
450 1 20 GLY H 1 43 VAL MG2 . . 5.800 3.991 3.619 4.296 . 0 0 "[ . 1 . 2]" 1
451 1 20 GLY H 1 48 CYS HB2 . . 5.500 5.056 4.746 5.327 . 0 0 "[ . 1 . 2]" 1
452 1 20 GLY H 1 48 CYS HB3 . . 5.500 5.517 5.187 5.586 0.086 9 0 "[ . 1 . 2]" 1
453 1 20 GLY QA 1 48 CYS QB . . 7.250 2.679 2.364 3.105 . 0 0 "[ . 1 . 2]" 1
454 1 20 GLY QA 1 49 ASP H . . 6.380 4.916 4.236 5.708 . 0 0 "[ . 1 . 2]" 1
455 1 20 GLY HA2 1 21 ASN H . . 3.600 3.302 3.154 3.389 . 0 0 "[ . 1 . 2]" 1
456 1 20 GLY HA3 1 21 ASN H . . 3.600 3.266 3.155 3.367 . 0 0 "[ . 1 . 2]" 1
457 1 21 ASN H 1 21 ASN HA . . 2.700 2.783 2.769 2.797 0.097 9 0 "[ . 1 . 2]" 1
458 1 21 ASN H 1 21 ASN HB2 . . 3.600 2.345 2.015 3.496 . 0 0 "[ . 1 . 2]" 1
459 1 21 ASN H 1 21 ASN QB . . 3.060 2.146 1.988 2.738 . 0 0 "[ . 1 . 2]" 1
460 1 21 ASN H 1 21 ASN HB3 . . 3.600 2.690 2.154 3.231 . 0 0 "[ . 1 . 2]" 1
461 1 21 ASN H 1 22 THR H . . 5.500 4.275 3.914 4.444 . 0 0 "[ . 1 . 2]" 1
462 1 21 ASN H 1 43 VAL QG . . 7.360 5.018 4.456 5.270 . 0 0 "[ . 1 . 2]" 1
463 1 21 ASN H 1 48 CYS QB . . 6.380 4.748 4.512 4.925 . 0 0 "[ . 1 . 2]" 1
464 1 21 ASN HA 1 22 THR H . . 2.700 2.303 2.160 2.427 . 0 0 "[ . 1 . 2]" 1
465 1 21 ASN HA 1 22 THR HB . . 5.500 4.776 4.565 4.975 . 0 0 "[ . 1 . 2]" 1
466 1 21 ASN QB 1 22 THR H . . 4.480 3.986 3.479 4.113 . 0 0 "[ . 1 . 2]" 1
467 1 22 THR H 1 22 THR HA . . 2.700 2.782 2.769 2.791 0.091 13 0 "[ . 1 . 2]" 1
468 1 22 THR H 1 22 THR HB . . 2.700 2.559 2.380 2.763 0.063 5 0 "[ . 1 . 2]" 1
469 1 22 THR H 1 23 TYR H . . 5.500 4.646 4.614 4.704 . 0 0 "[ . 1 . 2]" 1
470 1 22 THR HA 1 23 TYR H . . 2.700 2.310 2.256 2.381 . 0 0 "[ . 1 . 2]" 1
471 1 22 THR HA 1 48 CYS H . . 3.600 3.608 3.287 3.687 0.087 14 0 "[ . 1 . 2]" 1
472 1 22 THR HA 1 49 ASP H . . 5.500 4.525 4.256 4.921 . 0 0 "[ . 1 . 2]" 1
473 1 22 THR HB 1 23 TYR H . . 5.500 3.970 3.809 4.057 . 0 0 "[ . 1 . 2]" 1
474 1 22 THR HB 1 48 CYS H . . 5.500 4.502 4.118 4.989 . 0 0 "[ . 1 . 2]" 1
475 1 22 THR MG 1 23 TYR H . . 3.000 2.343 2.139 2.402 . 0 0 "[ . 1 . 2]" 1
476 1 22 THR MG 1 23 TYR HA . . 5.800 3.819 3.720 4.057 . 0 0 "[ . 1 . 2]" 1
477 1 22 THR MG 1 24 SER H . . 5.800 4.599 4.391 4.655 . 0 0 "[ . 1 . 2]" 1
478 1 22 THR MG 1 24 SER HA . . 5.800 4.216 3.890 4.729 . 0 0 "[ . 1 . 2]" 1
479 1 22 THR MG 1 47 PRO QB . . 7.500 2.085 1.931 2.285 . 0 0 "[ . 1 . 2]" 1
480 1 22 THR MG 1 48 CYS H . . 3.900 2.998 2.498 3.151 . 0 0 "[ . 1 . 2]" 1
481 1 23 TYR H 1 23 TYR HB2 . . 3.600 2.521 2.410 2.554 . 0 0 "[ . 1 . 2]" 1
482 1 23 TYR H 1 23 TYR HB3 . . 3.600 3.649 3.487 3.677 0.077 13 0 "[ . 1 . 2]" 1
483 1 23 TYR H 1 24 SER H . . 5.500 4.391 4.295 4.443 . 0 0 "[ . 1 . 2]" 1
484 1 23 TYR H 1 29 LEU QD . . 7.370 4.640 4.287 4.918 . 0 0 "[ . 1 . 2]" 1
485 1 23 TYR H 1 47 PRO QB . . 6.500 4.717 4.503 4.949 . 0 0 "[ . 1 . 2]" 1
486 1 23 TYR HA 1 24 SER H . . 2.700 2.304 2.230 2.364 . 0 0 "[ . 1 . 2]" 1
487 1 23 TYR HA 1 24 SER HA . . 5.500 4.371 4.273 4.569 . 0 0 "[ . 1 . 2]" 1
488 1 23 TYR HA 1 24 SER QB . . 6.500 4.501 4.105 4.733 . 0 0 "[ . 1 . 2]" 1
489 1 23 TYR HA 1 25 ASN H . . 5.500 4.194 3.934 4.391 . 0 0 "[ . 1 . 2]" 1
490 1 23 TYR QB 1 24 SER H . . 4.480 2.858 2.677 3.361 . 0 0 "[ . 1 . 2]" 1
491 1 23 TYR QB 1 25 ASN H . . 4.480 2.555 2.366 2.807 . 0 0 "[ . 1 . 2]" 1
492 1 23 TYR QB 1 28 MET QG . . 7.380 4.449 2.863 5.343 . 0 0 "[ . 1 . 2]" 1
493 1 23 TYR QB 1 29 LEU H . . 6.380 3.242 2.838 3.714 . 0 0 "[ . 1 . 2]" 1
494 1 23 TYR QB 1 29 LEU HA . . 6.380 3.943 3.458 4.338 . 0 0 "[ . 1 . 2]" 1
495 1 23 TYR QB 1 29 LEU QB . . 6.320 2.742 2.421 3.049 . 0 0 "[ . 1 . 2]" 1
496 1 23 TYR QB 1 29 LEU QD . . 7.320 3.292 3.014 3.682 . 0 0 "[ . 1 . 2]" 1
497 1 23 TYR HB2 1 29 LEU HB2 . . 7.250 2.985 2.531 3.405 . 0 0 "[ . 1 . 2]" 1
498 1 23 TYR HB2 1 29 LEU HB3 . . 7.250 4.142 3.750 4.926 . 0 0 "[ . 1 . 2]" 1
499 1 23 TYR HB2 1 29 LEU MD1 . . 8.940 3.437 3.109 3.868 . 0 0 "[ . 1 . 2]" 1
500 1 23 TYR HB2 1 29 LEU MD2 . . 8.940 5.466 5.082 5.837 . 0 0 "[ . 1 . 2]" 1
501 1 23 TYR HB3 1 29 LEU HB2 . . 7.250 3.490 3.160 3.922 . 0 0 "[ . 1 . 2]" 1
502 1 23 TYR HB3 1 29 LEU HB3 . . 7.250 4.514 4.095 5.084 . 0 0 "[ . 1 . 2]" 1
503 1 23 TYR HB3 1 29 LEU MD1 . . 8.940 4.545 4.071 5.014 . 0 0 "[ . 1 . 2]" 1
504 1 23 TYR HB3 1 29 LEU MD2 . . 8.940 5.991 5.656 6.426 . 0 0 "[ . 1 . 2]" 1
505 1 23 TYR QE 1 40 LEU HA . . 7.630 5.808 5.502 6.162 . 0 0 "[ . 1 . 2]" 1
506 1 23 TYR QE 1 40 LEU HG . . 7.630 5.344 5.024 5.601 . 0 0 "[ . 1 . 2]" 1
507 1 23 TYR QE 1 41 VAL H . . 7.630 5.801 5.504 6.263 . 0 0 "[ . 1 . 2]" 1
508 1 23 TYR QE 1 41 VAL QG . . 10.520 6.402 6.172 6.776 . 0 0 "[ . 1 . 2]" 1
509 1 24 SER H 1 24 SER HA . . 2.700 2.739 2.542 2.777 0.077 16 0 "[ . 1 . 2]" 1
510 1 24 SER H 1 25 ASN H . . 3.600 2.947 2.763 3.270 . 0 0 "[ . 1 . 2]" 1
511 1 24 SER H 1 28 MET QG . . 6.500 4.675 3.617 5.656 . 0 0 "[ . 1 . 2]" 1
512 1 24 SER HA 1 25 ASN H . . 3.600 3.549 3.490 3.622 0.022 19 0 "[ . 1 . 2]" 1
513 1 24 SER HA 1 25 ASN HA . . 5.500 4.636 4.498 4.732 . 0 0 "[ . 1 . 2]" 1
514 1 24 SER HA 1 25 ASN QB . . 6.380 4.882 4.775 4.986 . 0 0 "[ . 1 . 2]" 1
515 1 24 SER QB 1 25 ASN HA . . 6.500 4.683 4.490 5.037 . 0 0 "[ . 1 . 2]" 1
516 1 24 SER QB 1 25 ASN HB2 . . 6.500 5.249 4.869 5.751 . 0 0 "[ . 1 . 2]" 1
517 1 24 SER QB 1 25 ASN HB3 . . 6.500 4.231 3.930 4.476 . 0 0 "[ . 1 . 2]" 1
518 1 24 SER QB 1 25 ASN HD21 . . 6.500 3.583 2.779 4.749 . 0 0 "[ . 1 . 2]" 1
519 1 24 SER QB 1 25 ASN HD22 . . 6.500 3.898 3.132 4.842 . 0 0 "[ . 1 . 2]" 1
520 1 24 SER QB 1 28 MET HB2 . . 6.500 3.836 3.303 4.954 . 0 0 "[ . 1 . 2]" 1
521 1 24 SER QB 1 28 MET HB3 . . 6.500 4.531 3.875 5.803 . 0 0 "[ . 1 . 2]" 1
522 1 24 SER QB 1 28 MET ME . . 7.500 2.737 2.035 3.859 . 0 0 "[ . 1 . 2]" 1
523 1 24 SER QB 1 28 MET QG . . 7.500 3.494 2.038 5.021 . 0 0 "[ . 1 . 2]" 1
524 1 25 ASN H 1 26 PRO HD2 . . 5.500 4.941 4.843 5.018 . 0 0 "[ . 1 . 2]" 1
525 1 25 ASN H 1 26 PRO HD3 . . 5.500 4.772 4.641 4.879 . 0 0 "[ . 1 . 2]" 1
526 1 25 ASN H 1 28 MET H . . 5.500 3.792 3.408 4.116 . 0 0 "[ . 1 . 2]" 1
527 1 25 ASN H 1 28 MET HB2 . . 5.500 2.894 2.290 4.109 . 0 0 "[ . 1 . 2]" 1
528 1 25 ASN H 1 28 MET HB3 . . 5.500 4.171 2.898 4.671 . 0 0 "[ . 1 . 2]" 1
529 1 25 ASN H 1 28 MET QG . . 5.100 3.904 2.964 4.486 . 0 0 "[ . 1 . 2]" 1
530 1 25 ASN H 1 29 LEU QB . . 6.380 4.814 4.546 5.212 . 0 0 "[ . 1 . 2]" 1
531 1 25 ASN HA 1 26 PRO HD2 . . 3.600 2.811 2.578 2.985 . 0 0 "[ . 1 . 2]" 1
532 1 25 ASN HA 1 26 PRO HD3 . . 3.600 2.384 2.111 2.517 . 0 0 "[ . 1 . 2]" 1
533 1 25 ASN HA 1 26 PRO HG2 . . 5.500 4.805 4.640 4.926 . 0 0 "[ . 1 . 2]" 1
534 1 25 ASN HA 1 26 PRO HG3 . . 5.500 4.646 4.265 4.795 . 0 0 "[ . 1 . 2]" 1
535 1 25 ASN HA 1 27 CYS H . . 5.500 4.093 3.967 4.185 . 0 0 "[ . 1 . 2]" 1
536 1 25 ASN QB 1 26 PRO QD . . 4.390 1.996 1.956 2.067 . 0 0 "[ . 1 . 2]" 1
537 1 25 ASN QB 1 26 PRO QG . . 6.320 3.723 3.605 3.852 . 0 0 "[ . 1 . 2]" 1
538 1 25 ASN QB 1 27 CYS QB . . 4.390 3.298 2.894 3.401 . 0 0 "[ . 1 . 2]" 1
539 1 25 ASN QB 1 28 MET H . . 6.380 3.658 3.092 3.869 . 0 0 "[ . 1 . 2]" 1
540 1 25 ASN HB2 1 26 PRO HD2 . . 5.350 2.038 1.993 2.123 . 0 0 "[ . 1 . 2]" 1
541 1 25 ASN HB2 1 26 PRO HD3 . . 5.350 3.264 3.136 3.457 . 0 0 "[ . 1 . 2]" 1
542 1 25 ASN HB2 1 26 PRO HG2 . . 7.250 4.041 3.877 4.267 . 0 0 "[ . 1 . 2]" 1
543 1 25 ASN HB2 1 26 PRO HG3 . . 7.250 4.755 4.684 4.872 . 0 0 "[ . 1 . 2]" 1
544 1 25 ASN HB2 1 27 CYS H . . 5.500 2.677 2.322 2.836 . 0 0 "[ . 1 . 2]" 1
545 1 25 ASN HB2 1 27 CYS HB2 . . 5.350 3.689 3.173 3.854 . 0 0 "[ . 1 . 2]" 1
546 1 25 ASN HB2 1 27 CYS HB3 . . 5.350 3.931 3.475 4.163 . 0 0 "[ . 1 . 2]" 1
547 1 25 ASN HB3 1 26 PRO HD2 . . 5.350 3.339 2.991 3.522 . 0 0 "[ . 1 . 2]" 1
548 1 25 ASN HB3 1 26 PRO HD3 . . 5.350 3.986 3.425 4.170 . 0 0 "[ . 1 . 2]" 1
549 1 25 ASN HB3 1 26 PRO HG2 . . 7.250 5.549 5.206 5.746 . 0 0 "[ . 1 . 2]" 1
550 1 25 ASN HB3 1 26 PRO HG3 . . 7.250 5.912 5.440 6.085 . 0 0 "[ . 1 . 2]" 1
551 1 25 ASN HB3 1 27 CYS H . . 5.500 4.291 3.997 4.501 . 0 0 "[ . 1 . 2]" 1
552 1 25 ASN HB3 1 27 CYS HB2 . . 5.350 5.241 4.735 5.402 0.052 8 0 "[ . 1 . 2]" 1
553 1 25 ASN HB3 1 27 CYS HB3 . . 5.350 5.171 4.888 5.345 . 0 0 "[ . 1 . 2]" 1
554 1 25 ASN QD 1 28 MET QB . . 7.240 4.089 3.351 4.392 . 0 0 "[ . 1 . 2]" 1
555 1 26 PRO HA 1 27 CYS HA . . 5.500 4.790 4.726 4.907 . 0 0 "[ . 1 . 2]" 1
556 1 26 PRO HA 1 28 MET H . . 5.500 4.337 3.917 4.667 . 0 0 "[ . 1 . 2]" 1
557 1 26 PRO HA 1 29 LEU H . . 5.500 3.121 2.920 3.453 . 0 0 "[ . 1 . 2]" 1
558 1 26 PRO HA 1 29 LEU HB2 . . 5.500 3.384 2.965 3.596 . 0 0 "[ . 1 . 2]" 1
559 1 26 PRO HA 1 29 LEU HB3 . . 5.500 2.347 2.131 2.653 . 0 0 "[ . 1 . 2]" 1
560 1 26 PRO HA 1 29 LEU MD1 . . 5.800 3.035 2.628 3.652 . 0 0 "[ . 1 . 2]" 1
561 1 26 PRO HA 1 29 LEU QD . . 4.690 2.865 2.519 3.337 . 0 0 "[ . 1 . 2]" 1
562 1 26 PRO HA 1 29 LEU MD2 . . 5.800 3.704 2.629 4.141 . 0 0 "[ . 1 . 2]" 1
563 1 26 PRO HA 1 30 THR H . . 5.500 3.797 3.548 4.136 . 0 0 "[ . 1 . 2]" 1
564 1 26 PRO HA 1 45 GLU HA . . 5.500 5.498 5.251 5.589 0.089 2 0 "[ . 1 . 2]" 1
565 1 26 PRO QB 1 29 LEU QB . . 6.320 3.638 3.518 3.863 . 0 0 "[ . 1 . 2]" 1
566 1 26 PRO QB 1 29 LEU QD . . 6.490 3.165 2.571 3.768 . 0 0 "[ . 1 . 2]" 1
567 1 26 PRO QB 1 30 THR MG . . 6.680 4.673 4.482 4.722 . 0 0 "[ . 1 . 2]" 1
568 1 26 PRO HB2 1 29 LEU HB2 . . 7.250 5.715 5.347 5.956 . 0 0 "[ . 1 . 2]" 1
569 1 26 PRO HB2 1 29 LEU HB3 . . 7.250 4.203 3.997 4.540 . 0 0 "[ . 1 . 2]" 1
570 1 26 PRO HB2 1 29 LEU MD1 . . 7.550 4.266 3.751 5.352 . 0 0 "[ . 1 . 2]" 1
571 1 26 PRO HB2 1 29 LEU MD2 . . 7.550 4.095 2.842 4.705 . 0 0 "[ . 1 . 2]" 1
572 1 26 PRO HB3 1 29 LEU HB2 . . 7.250 5.317 4.937 5.623 . 0 0 "[ . 1 . 2]" 1
573 1 26 PRO HB3 1 29 LEU HB3 . . 7.250 4.226 4.087 4.479 . 0 0 "[ . 1 . 2]" 1
574 1 26 PRO HB3 1 29 LEU MD1 . . 7.550 3.692 3.266 4.602 . 0 0 "[ . 1 . 2]" 1
575 1 26 PRO HB3 1 29 LEU MD2 . . 7.550 4.452 3.092 4.867 . 0 0 "[ . 1 . 2]" 1
576 1 26 PRO QD 1 27 CYS H . . 4.480 2.546 2.059 2.771 . 0 0 "[ . 1 . 2]" 1
577 1 26 PRO QD 1 27 CYS QB . . 5.350 3.752 3.252 4.058 . 0 0 "[ . 1 . 2]" 1
578 1 26 PRO HG2 1 27 CYS H . . 5.500 2.942 2.695 3.083 . 0 0 "[ . 1 . 2]" 1
579 1 26 PRO HG3 1 27 CYS H . . 5.500 4.287 4.061 4.453 . 0 0 "[ . 1 . 2]" 1
580 1 27 CYS H 1 27 CYS HB2 . . 3.600 2.295 2.124 2.448 . 0 0 "[ . 1 . 2]" 1
581 1 27 CYS H 1 27 CYS HB3 . . 3.600 2.823 2.720 2.993 . 0 0 "[ . 1 . 2]" 1
582 1 27 CYS H 1 28 MET H . . 3.600 2.671 2.513 2.889 . 0 0 "[ . 1 . 2]" 1
583 1 27 CYS H 1 28 MET QB . . 6.380 4.546 4.100 4.846 . 0 0 "[ . 1 . 2]" 1
584 1 27 CYS H 1 28 MET QG . . 6.500 4.910 4.403 5.887 . 0 0 "[ . 1 . 2]" 1
585 1 27 CYS H 1 29 LEU H . . 5.500 4.036 3.887 4.222 . 0 0 "[ . 1 . 2]" 1
586 1 27 CYS HA 1 28 MET H . . 3.600 3.620 3.507 3.654 0.054 5 0 "[ . 1 . 2]" 1
587 1 27 CYS HA 1 28 MET HA . . 5.500 4.817 4.730 4.909 . 0 0 "[ . 1 . 2]" 1
588 1 27 CYS HA 1 29 LEU H . . 5.500 4.431 4.236 4.621 . 0 0 "[ . 1 . 2]" 1
589 1 27 CYS HA 1 30 THR H . . 5.500 3.729 3.530 4.244 . 0 0 "[ . 1 . 2]" 1
590 1 27 CYS HA 1 30 THR HB . . 5.500 3.833 3.400 4.555 . 0 0 "[ . 1 . 2]" 1
591 1 27 CYS HA 1 30 THR MG . . 3.900 2.346 2.193 2.613 . 0 0 "[ . 1 . 2]" 1
592 1 27 CYS HA 1 31 CYS H . . 5.500 3.755 3.546 4.276 . 0 0 "[ . 1 . 2]" 1
593 1 27 CYS HB2 1 28 MET H . . 3.600 3.669 3.649 3.693 0.093 6 0 "[ . 1 . 2]" 1
594 1 27 CYS HB3 1 28 MET H . . 3.600 2.632 2.317 2.992 . 0 0 "[ . 1 . 2]" 1
595 1 28 MET H 1 28 MET HB2 . . 3.600 2.407 2.181 2.528 . 0 0 "[ . 1 . 2]" 1
596 1 28 MET H 1 28 MET HB3 . . 3.600 3.463 2.274 3.639 0.039 9 0 "[ . 1 . 2]" 1
597 1 28 MET H 1 28 MET ME . . 5.800 4.658 4.216 4.846 . 0 0 "[ . 1 . 2]" 1
598 1 28 MET H 1 28 MET QG . . 4.100 2.729 2.276 3.814 . 0 0 "[ . 1 . 2]" 1
599 1 28 MET H 1 29 LEU H . . 3.600 2.769 2.495 2.933 . 0 0 "[ . 1 . 2]" 1
600 1 28 MET H 1 29 LEU HB2 . . 5.500 5.356 4.799 5.546 0.046 18 0 "[ . 1 . 2]" 1
601 1 28 MET H 1 29 LEU HB3 . . 5.500 4.732 4.480 4.906 . 0 0 "[ . 1 . 2]" 1
602 1 28 MET H 1 31 CYS H . . 5.500 4.669 4.519 4.861 . 0 0 "[ . 1 . 2]" 1
603 1 28 MET HA 1 29 LEU H . . 3.600 3.563 3.488 3.608 0.008 6 0 "[ . 1 . 2]" 1
604 1 28 MET HA 1 30 THR H . . 5.500 5.020 4.784 5.124 . 0 0 "[ . 1 . 2]" 1
605 1 28 MET HA 1 31 CYS H . . 5.500 3.534 3.251 3.739 . 0 0 "[ . 1 . 2]" 1
606 1 28 MET HA 1 31 CYS HB2 . . 3.600 3.390 3.033 3.689 0.089 19 0 "[ . 1 . 2]" 1
607 1 28 MET HA 1 31 CYS HB3 . . 3.600 2.203 1.993 2.367 . 0 0 "[ . 1 . 2]" 1
608 1 28 MET HA 1 32 ALA H . . 5.500 3.688 3.502 3.856 . 0 0 "[ . 1 . 2]" 1
609 1 28 MET QB 1 29 LEU QB . . 6.320 4.082 3.803 4.276 . 0 0 "[ . 1 . 2]" 1
610 1 28 MET QB 1 31 CYS QB . . 7.250 4.009 3.819 4.348 . 0 0 "[ . 1 . 2]" 1
611 1 28 MET HB2 1 28 MET ME . . 3.900 2.954 2.515 3.194 . 0 0 "[ . 1 . 2]" 1
612 1 28 MET HB2 1 29 LEU H . . 3.600 2.976 2.509 3.688 0.088 7 0 "[ . 1 . 2]" 1
613 1 28 MET HB2 1 29 LEU HA . . 5.500 4.850 4.497 5.589 0.089 15 0 "[ . 1 . 2]" 1
614 1 28 MET HB2 1 29 LEU HB2 . . 7.250 4.994 4.579 6.060 . 0 0 "[ . 1 . 2]" 1
615 1 28 MET HB2 1 29 LEU HB3 . . 7.250 5.185 4.390 6.015 . 0 0 "[ . 1 . 2]" 1
616 1 28 MET HB3 1 28 MET ME . . 3.900 2.238 2.043 2.557 . 0 0 "[ . 1 . 2]" 1
617 1 28 MET HB3 1 29 LEU H . . 3.600 3.441 2.333 3.675 0.075 5 0 "[ . 1 . 2]" 1
618 1 28 MET HB3 1 29 LEU HA . . 5.500 4.423 3.945 4.685 . 0 0 "[ . 1 . 2]" 1
619 1 28 MET HB3 1 29 LEU HB2 . . 7.250 5.190 4.413 5.540 . 0 0 "[ . 1 . 2]" 1
620 1 28 MET HB3 1 29 LEU HB3 . . 7.250 5.608 4.527 5.887 . 0 0 "[ . 1 . 2]" 1
621 1 28 MET QG 1 29 LEU H . . 5.100 4.211 3.039 4.536 . 0 0 "[ . 1 . 2]" 1
622 1 28 MET O 1 32 ALA H . . 1.800 1.905 1.791 2.025 0.225 18 0 "[ . 1 . 2]" 1
623 1 28 MET O 1 32 ALA N . . 2.700 2.916 2.799 3.039 0.339 18 0 "[ . 1 . 2]" 1
624 1 29 LEU H 1 29 LEU HB2 . . 2.700 2.682 2.475 2.763 0.063 5 0 "[ . 1 . 2]" 1
625 1 29 LEU H 1 29 LEU HB3 . . 2.700 2.316 2.089 2.535 . 0 0 "[ . 1 . 2]" 1
626 1 29 LEU H 1 29 LEU MD1 . . 5.800 4.132 4.049 4.265 . 0 0 "[ . 1 . 2]" 1
627 1 29 LEU H 1 29 LEU MD2 . . 5.800 4.111 3.845 4.222 . 0 0 "[ . 1 . 2]" 1
628 1 29 LEU H 1 30 THR H . . 3.600 2.939 2.776 3.122 . 0 0 "[ . 1 . 2]" 1
629 1 29 LEU H 1 31 CYS H . . 5.500 4.084 3.782 4.254 . 0 0 "[ . 1 . 2]" 1
630 1 29 LEU HA 1 29 LEU HG . . 3.600 2.812 2.455 3.029 . 0 0 "[ . 1 . 2]" 1
631 1 29 LEU HA 1 31 CYS H . . 5.500 4.560 4.324 4.717 . 0 0 "[ . 1 . 2]" 1
632 1 29 LEU HA 1 32 ALA H . . 5.500 3.790 3.657 3.931 . 0 0 "[ . 1 . 2]" 1
633 1 29 LEU HA 1 32 ALA MB . . 5.800 2.734 2.564 2.966 . 0 0 "[ . 1 . 2]" 1
634 1 29 LEU HA 1 33 LYS H . . 5.500 3.995 3.897 4.081 . 0 0 "[ . 1 . 2]" 1
635 1 29 LEU HA 1 40 LEU QD . . 7.370 2.309 2.184 2.500 . 0 0 "[ . 1 . 2]" 1
636 1 29 LEU QB 1 40 LEU QD . . 4.510 2.914 2.803 3.032 . 0 0 "[ . 1 . 2]" 1
637 1 29 LEU HB2 1 30 THR H . . 3.600 3.686 3.631 3.699 0.099 3 0 "[ . 1 . 2]" 1
638 1 29 LEU HB2 1 40 LEU MD1 . . 5.650 3.556 3.268 3.773 . 0 0 "[ . 1 . 2]" 1
639 1 29 LEU HB2 1 40 LEU MD2 . . 5.650 3.381 3.230 3.687 . 0 0 "[ . 1 . 2]" 1
640 1 29 LEU HB3 1 30 THR H . . 3.600 2.266 2.144 2.484 . 0 0 "[ . 1 . 2]" 1
641 1 29 LEU HB3 1 40 LEU MD1 . . 5.650 4.217 4.123 4.265 . 0 0 "[ . 1 . 2]" 1
642 1 29 LEU HB3 1 40 LEU MD2 . . 5.650 3.926 3.787 4.110 . 0 0 "[ . 1 . 2]" 1
643 1 29 LEU QD 1 30 THR H . . 4.690 2.353 2.144 2.498 . 0 0 "[ . 1 . 2]" 1
644 1 29 LEU QD 1 30 THR HA . . 7.370 2.428 2.302 2.846 . 0 0 "[ . 1 . 2]" 1
645 1 29 LEU QD 1 30 THR HB . . 7.370 2.783 2.452 3.213 . 0 0 "[ . 1 . 2]" 1
646 1 29 LEU QD 1 30 THR MG . . 8.370 3.846 3.689 3.994 . 0 0 "[ . 1 . 2]" 1
647 1 29 LEU QD 1 32 ALA H . . 7.370 5.174 4.997 5.419 . 0 0 "[ . 1 . 2]" 1
648 1 29 LEU QD 1 32 ALA MB . . 8.370 4.252 4.096 4.508 . 0 0 "[ . 1 . 2]" 1
649 1 29 LEU QD 1 33 LYS H . . 7.370 4.044 3.813 4.691 . 0 0 "[ . 1 . 2]" 1
650 1 29 LEU QD 1 33 LYS QB . . 7.320 2.808 2.554 3.660 . 0 0 "[ . 1 . 2]" 1
651 1 29 LEU QD 1 33 LYS QD . . 6.350 2.883 2.589 3.525 . 0 0 "[ . 1 . 2]" 1
652 1 29 LEU QD 1 33 LYS QG . . 8.250 4.140 3.704 4.845 . 0 0 "[ . 1 . 2]" 1
653 1 29 LEU QD 1 40 LEU HA . . 7.370 4.782 4.479 4.976 . 0 0 "[ . 1 . 2]" 1
654 1 29 LEU QD 1 40 LEU QB . . 7.320 4.015 3.781 4.345 . 0 0 "[ . 1 . 2]" 1
655 1 29 LEU QD 1 40 LEU QD . . 4.960 1.907 1.708 1.977 . 0 0 "[ . 1 . 2]" 1
656 1 29 LEU QD 1 41 VAL H . . 7.370 3.547 3.385 3.643 . 0 0 "[ . 1 . 2]" 1
657 1 29 LEU QD 1 41 VAL HA . . 7.370 3.430 3.082 3.744 . 0 0 "[ . 1 . 2]" 1
658 1 29 LEU QD 1 41 VAL HB . . 7.370 4.730 4.453 4.861 . 0 0 "[ . 1 . 2]" 1
659 1 29 LEU QD 1 42 GLN H . . 4.690 3.032 2.726 3.154 . 0 0 "[ . 1 . 2]" 1
660 1 29 LEU QD 1 42 GLN QB . . 5.590 2.482 2.018 2.807 . 0 0 "[ . 1 . 2]" 1
661 1 29 LEU QD 1 42 GLN QE . . 7.320 2.667 1.991 4.548 . 0 0 "[ . 1 . 2]" 1
662 1 29 LEU QD 1 43 VAL H . . 7.370 3.333 3.142 3.548 . 0 0 "[ . 1 . 2]" 1
663 1 29 LEU MD1 1 30 THR H . . 5.800 3.996 3.804 4.384 . 0 0 "[ . 1 . 2]" 1
664 1 29 LEU MD1 1 33 LYS HB2 . . 8.940 5.273 4.993 5.439 . 0 0 "[ . 1 . 2]" 1
665 1 29 LEU MD1 1 33 LYS HB3 . . 8.940 6.370 6.116 6.772 . 0 0 "[ . 1 . 2]" 1
666 1 29 LEU MD1 1 40 LEU HB2 . . 8.940 5.455 4.743 5.810 . 0 0 "[ . 1 . 2]" 1
667 1 29 LEU MD1 1 40 LEU HB3 . . 8.940 5.809 5.407 6.032 . 0 0 "[ . 1 . 2]" 1
668 1 29 LEU MD1 1 40 LEU MD1 . . 6.800 2.284 1.933 2.503 . 0 0 "[ . 1 . 2]" 1
669 1 29 LEU MD1 1 40 LEU MD2 . . 6.800 3.493 3.155 3.642 . 0 0 "[ . 1 . 2]" 1
670 1 29 LEU MD1 1 40 LEU HG . . 5.800 4.151 3.849 4.313 . 0 0 "[ . 1 . 2]" 1
671 1 29 LEU MD1 1 42 GLN H . . 5.800 4.230 3.798 4.613 . 0 0 "[ . 1 . 2]" 1
672 1 29 LEU MD1 1 42 GLN HA . . 3.900 2.362 2.048 2.770 . 0 0 "[ . 1 . 2]" 1
673 1 29 LEU MD1 1 42 GLN HB2 . . 7.550 3.584 2.408 4.258 . 0 0 "[ . 1 . 2]" 1
674 1 29 LEU MD1 1 42 GLN HB3 . . 7.550 4.661 3.783 5.240 . 0 0 "[ . 1 . 2]" 1
675 1 29 LEU MD1 1 42 GLN HE21 . . 8.940 3.537 2.657 5.674 . 0 0 "[ . 1 . 2]" 1
676 1 29 LEU MD1 1 42 GLN HE22 . . 8.940 3.071 2.029 6.819 . 0 0 "[ . 1 . 2]" 1
677 1 29 LEU MD2 1 30 THR H . . 5.800 2.371 2.151 2.526 . 0 0 "[ . 1 . 2]" 1
678 1 29 LEU MD2 1 33 LYS HB2 . . 8.940 2.920 2.620 4.017 . 0 0 "[ . 1 . 2]" 1
679 1 29 LEU MD2 1 33 LYS HB3 . . 8.940 3.828 3.527 4.611 . 0 0 "[ . 1 . 2]" 1
680 1 29 LEU MD2 1 40 LEU HB2 . . 8.940 5.044 4.676 5.978 . 0 0 "[ . 1 . 2]" 1
681 1 29 LEU MD2 1 40 LEU HB3 . . 8.940 4.643 4.138 5.682 . 0 0 "[ . 1 . 2]" 1
682 1 29 LEU MD2 1 40 LEU MD1 . . 6.800 2.282 2.047 2.882 . 0 0 "[ . 1 . 2]" 1
683 1 29 LEU MD2 1 40 LEU MD2 . . 6.800 2.614 2.143 3.585 . 0 0 "[ . 1 . 2]" 1
684 1 29 LEU MD2 1 40 LEU HG . . 5.800 2.730 2.287 3.773 . 0 0 "[ . 1 . 2]" 1
685 1 29 LEU MD2 1 42 GLN H . . 5.800 3.111 2.791 3.243 . 0 0 "[ . 1 . 2]" 1
686 1 29 LEU MD2 1 42 GLN HA . . 3.900 2.690 2.118 3.032 . 0 0 "[ . 1 . 2]" 1
687 1 29 LEU MD2 1 42 GLN HB2 . . 7.550 2.599 2.089 3.084 . 0 0 "[ . 1 . 2]" 1
688 1 29 LEU MD2 1 42 GLN HB3 . . 7.550 3.939 3.439 4.375 . 0 0 "[ . 1 . 2]" 1
689 1 29 LEU MD2 1 42 GLN HE21 . . 8.940 4.582 3.244 5.546 . 0 0 "[ . 1 . 2]" 1
690 1 29 LEU MD2 1 42 GLN HE22 . . 8.940 4.197 2.849 6.458 . 0 0 "[ . 1 . 2]" 1
691 1 29 LEU HG 1 30 THR H . . 5.500 3.962 3.437 4.169 . 0 0 "[ . 1 . 2]" 1
692 1 29 LEU HG 1 32 ALA MB . . 5.800 4.434 4.177 4.667 . 0 0 "[ . 1 . 2]" 1
693 1 29 LEU HG 1 40 LEU QB . . 6.380 4.368 4.191 4.479 . 0 0 "[ . 1 . 2]" 1
694 1 29 LEU HG 1 40 LEU MD1 . . 5.800 1.887 1.851 2.031 . 0 0 "[ . 1 . 2]" 1
695 1 29 LEU HG 1 40 LEU MD2 . . 5.800 2.065 1.956 2.149 . 0 0 "[ . 1 . 2]" 1
696 1 29 LEU HG 1 40 LEU HG . . 3.600 3.187 2.764 3.359 . 0 0 "[ . 1 . 2]" 1
697 1 29 LEU O 1 33 LYS H . . 1.800 1.793 1.751 1.856 0.056 6 0 "[ . 1 . 2]" 1
698 1 29 LEU O 1 33 LYS N . . 2.700 2.777 2.739 2.860 0.160 6 0 "[ . 1 . 2]" 1
699 1 30 THR H 1 30 THR HB . . 3.600 2.270 2.106 2.443 . 0 0 "[ . 1 . 2]" 1
700 1 30 THR H 1 30 THR MG . . 3.900 2.771 2.387 3.035 . 0 0 "[ . 1 . 2]" 1
701 1 30 THR H 1 31 CYS H . . 3.600 2.962 2.838 3.114 . 0 0 "[ . 1 . 2]" 1
702 1 30 THR H 1 31 CYS QB . . 6.380 4.558 4.453 4.780 . 0 0 "[ . 1 . 2]" 1
703 1 30 THR H 1 33 LYS H . . 5.500 4.669 4.623 4.733 . 0 0 "[ . 1 . 2]" 1
704 1 30 THR H 1 40 LEU HG . . 5.500 5.552 5.368 5.596 0.096 6 0 "[ . 1 . 2]" 1
705 1 30 THR HA 1 32 ALA H . . 5.500 4.822 4.685 4.950 . 0 0 "[ . 1 . 2]" 1
706 1 30 THR HA 1 33 LYS H . . 3.600 3.261 3.141 3.505 . 0 0 "[ . 1 . 2]" 1
707 1 30 THR HA 1 33 LYS HB2 . . 5.500 2.576 2.370 2.778 . 0 0 "[ . 1 . 2]" 1
708 1 30 THR HA 1 33 LYS HB3 . . 5.500 2.391 2.198 2.875 . 0 0 "[ . 1 . 2]" 1
709 1 30 THR HA 1 33 LYS QD . . 6.380 2.992 2.576 3.201 . 0 0 "[ . 1 . 2]" 1
710 1 30 THR HA 1 33 LYS QG . . 6.380 4.158 3.961 4.324 . 0 0 "[ . 1 . 2]" 1
711 1 30 THR HA 1 34 HIS H . . 5.500 3.801 3.584 3.985 . 0 0 "[ . 1 . 2]" 1
712 1 30 THR HB 1 31 CYS H . . 5.500 3.788 3.653 4.083 . 0 0 "[ . 1 . 2]" 1
713 1 30 THR HB 1 31 CYS HA . . 5.500 5.587 5.581 5.594 0.094 10 0 "[ . 1 . 2]" 1
714 1 30 THR HB 1 33 LYS QB . . 6.380 4.423 4.332 4.550 . 0 0 "[ . 1 . 2]" 1
715 1 30 THR MG 1 31 CYS H . . 5.800 2.172 1.932 2.377 . 0 0 "[ . 1 . 2]" 1
716 1 30 THR MG 1 31 CYS HA . . 5.800 3.128 3.006 3.215 . 0 0 "[ . 1 . 2]" 1
717 1 30 THR MG 1 32 ALA H . . 5.800 4.698 4.432 4.755 . 0 0 "[ . 1 . 2]" 1
718 1 30 THR MG 1 33 LYS H . . 5.800 4.841 4.830 4.856 . 0 0 "[ . 1 . 2]" 1
719 1 30 THR MG 1 33 LYS QB . . 6.680 4.224 4.050 4.464 . 0 0 "[ . 1 . 2]" 1
720 1 30 THR MG 1 34 HIS H . . 5.800 4.494 4.265 4.757 . 0 0 "[ . 1 . 2]" 1
721 1 30 THR MG 1 40 LEU QD . . 8.370 5.039 4.738 5.138 . 0 0 "[ . 1 . 2]" 1
722 1 30 THR O 1 34 HIS H . . 1.800 1.935 1.805 2.029 0.229 5 0 "[ . 1 . 2]" 1
723 1 30 THR O 1 34 HIS N . . 2.700 2.951 2.822 3.048 0.348 5 0 "[ . 1 . 2]" 1
724 1 31 CYS H 1 31 CYS HB2 . . 3.600 2.847 2.583 3.358 . 0 0 "[ . 1 . 2]" 1
725 1 31 CYS H 1 31 CYS HB3 . . 3.600 2.267 2.024 2.411 . 0 0 "[ . 1 . 2]" 1
726 1 31 CYS H 1 32 ALA H . . 3.600 3.005 2.831 3.178 . 0 0 "[ . 1 . 2]" 1
727 1 31 CYS H 1 32 ALA MB . . 5.800 4.405 4.251 4.566 . 0 0 "[ . 1 . 2]" 1
728 1 31 CYS H 1 33 LYS H . . 5.500 4.064 3.925 4.175 . 0 0 "[ . 1 . 2]" 1
729 1 31 CYS HA 1 32 ALA HA . . 5.500 5.014 4.940 5.060 . 0 0 "[ . 1 . 2]" 1
730 1 31 CYS HA 1 33 LYS H . . 5.500 4.440 4.347 4.548 . 0 0 "[ . 1 . 2]" 1
731 1 31 CYS HA 1 34 HIS H . . 5.500 3.851 3.775 3.978 . 0 0 "[ . 1 . 2]" 1
732 1 31 CYS HA 1 34 HIS HB2 . . 5.500 3.439 3.111 3.735 . 0 0 "[ . 1 . 2]" 1
733 1 31 CYS HA 1 34 HIS HB3 . . 5.500 4.582 4.234 5.003 . 0 0 "[ . 1 . 2]" 1
734 1 31 CYS HA 1 35 GLU H . . 5.500 4.214 4.098 4.353 . 0 0 "[ . 1 . 2]" 1
735 1 31 CYS HA 1 35 GLU QB . . 6.380 4.128 4.005 4.276 . 0 0 "[ . 1 . 2]" 1
736 1 31 CYS QB 1 32 ALA H . . 4.480 2.388 2.104 3.120 . 0 0 "[ . 1 . 2]" 1
737 1 31 CYS QB 1 32 ALA MB . . 6.680 3.910 3.651 4.487 . 0 0 "[ . 1 . 2]" 1
738 1 31 CYS O 1 35 GLU H . . 1.800 1.835 1.774 1.940 0.140 19 0 "[ . 1 . 2]" 1
739 1 31 CYS O 1 35 GLU N . . 2.700 2.688 2.668 2.722 0.022 19 0 "[ . 1 . 2]" 1
740 1 32 ALA H 1 32 ALA MB . . 3.000 2.175 2.072 2.213 . 0 0 "[ . 1 . 2]" 1
741 1 32 ALA H 1 33 LYS H . . 3.600 2.848 2.742 2.918 . 0 0 "[ . 1 . 2]" 1
742 1 32 ALA H 1 33 LYS QB . . 6.380 4.582 4.451 4.672 . 0 0 "[ . 1 . 2]" 1
743 1 32 ALA H 1 40 LEU QD . . 7.370 4.010 3.911 4.128 . 0 0 "[ . 1 . 2]" 1
744 1 32 ALA HA 1 33 LYS HA . . 5.500 4.879 4.817 4.917 . 0 0 "[ . 1 . 2]" 1
745 1 32 ALA HA 1 34 HIS H . . 5.500 4.922 4.802 5.012 . 0 0 "[ . 1 . 2]" 1
746 1 32 ALA HA 1 35 GLU H . . 5.500 3.415 3.207 3.611 . 0 0 "[ . 1 . 2]" 1
747 1 32 ALA HA 1 35 GLU QB . . 4.480 2.304 2.093 2.448 . 0 0 "[ . 1 . 2]" 1
748 1 32 ALA HA 1 35 GLU HG2 . . 5.500 5.025 4.622 5.275 . 0 0 "[ . 1 . 2]" 1
749 1 32 ALA HA 1 35 GLU HG3 . . 5.500 4.236 3.623 4.987 . 0 0 "[ . 1 . 2]" 1
750 1 32 ALA HA 1 37 ASN QD . . 6.370 5.340 4.938 5.418 . 0 0 "[ . 1 . 2]" 1
751 1 32 ALA MB 1 33 LYS H . . 3.000 2.341 2.308 2.495 . 0 0 "[ . 1 . 2]" 1
752 1 32 ALA MB 1 33 LYS HA . . 5.800 3.749 3.645 3.822 . 0 0 "[ . 1 . 2]" 1
753 1 32 ALA MB 1 34 HIS H . . 5.800 4.735 4.669 4.856 . 0 0 "[ . 1 . 2]" 1
754 1 32 ALA MB 1 35 GLU H . . 5.800 4.368 4.242 4.489 . 0 0 "[ . 1 . 2]" 1
755 1 32 ALA MB 1 37 ASN HD21 . . 5.800 3.091 2.654 3.265 . 0 0 "[ . 1 . 2]" 1
756 1 32 ALA MB 1 37 ASN HD22 . . 5.800 4.568 4.102 4.745 . 0 0 "[ . 1 . 2]" 1
757 1 32 ALA MB 1 40 LEU QB . . 6.680 4.029 3.858 4.250 . 0 0 "[ . 1 . 2]" 1
758 1 32 ALA MB 1 40 LEU MD1 . . 6.800 4.244 4.089 4.400 . 0 0 "[ . 1 . 2]" 1
759 1 32 ALA MB 1 40 LEU QD . . 5.710 2.228 2.087 2.391 . 0 0 "[ . 1 . 2]" 1
760 1 32 ALA MB 1 40 LEU MD2 . . 6.800 2.235 2.094 2.401 . 0 0 "[ . 1 . 2]" 1
761 1 32 ALA O 1 36 GLY H . . 1.800 1.764 1.721 1.843 0.043 20 0 "[ . 1 . 2]" 1
762 1 32 ALA O 1 36 GLY N . . 2.700 2.759 2.717 2.839 0.139 20 0 "[ . 1 . 2]" 1
763 1 33 LYS H 1 33 LYS HB2 . . 3.600 2.376 2.237 2.432 . 0 0 "[ . 1 . 2]" 1
764 1 33 LYS H 1 33 LYS QB . . 3.060 2.244 2.172 2.293 . 0 0 "[ . 1 . 2]" 1
765 1 33 LYS H 1 33 LYS HB3 . . 3.600 2.778 2.562 3.125 . 0 0 "[ . 1 . 2]" 1
766 1 33 LYS H 1 33 LYS HD2 . . 5.500 5.010 4.913 5.180 . 0 0 "[ . 1 . 2]" 1
767 1 33 LYS H 1 33 LYS HD3 . . 5.500 4.813 4.554 4.925 . 0 0 "[ . 1 . 2]" 1
768 1 33 LYS H 1 33 LYS QG . . 4.480 3.929 3.767 3.987 . 0 0 "[ . 1 . 2]" 1
769 1 33 LYS H 1 34 HIS H . . 3.600 2.947 2.878 3.069 . 0 0 "[ . 1 . 2]" 1
770 1 33 LYS H 1 35 GLU H . . 3.600 3.703 3.689 3.713 0.113 12 0 "[ . 1 . 2]" 1
771 1 33 LYS H 1 37 ASN QB . . 6.380 3.633 3.557 3.730 . 0 0 "[ . 1 . 2]" 1
772 1 33 LYS H 1 40 LEU MD1 . . 5.800 4.916 4.898 4.930 . 0 0 "[ . 1 . 2]" 1
773 1 33 LYS H 1 40 LEU QD . . 4.690 2.447 2.371 2.528 . 0 0 "[ . 1 . 2]" 1
774 1 33 LYS H 1 40 LEU MD2 . . 5.800 2.453 2.376 2.536 . 0 0 "[ . 1 . 2]" 1
775 1 33 LYS H 1 40 LEU HG . . 5.500 4.236 4.172 4.384 . 0 0 "[ . 1 . 2]" 1
776 1 33 LYS HA 1 33 LYS HD2 . . 5.500 4.206 4.146 4.378 . 0 0 "[ . 1 . 2]" 1
777 1 33 LYS HA 1 33 LYS HD3 . . 5.500 4.469 4.342 4.526 . 0 0 "[ . 1 . 2]" 1
778 1 33 LYS HA 1 34 HIS HA . . 5.500 4.746 4.680 4.830 . 0 0 "[ . 1 . 2]" 1
779 1 33 LYS HA 1 35 GLU H . . 5.500 4.178 4.040 4.309 . 0 0 "[ . 1 . 2]" 1
780 1 33 LYS HA 1 37 ASN H . . 3.600 2.798 2.712 2.907 . 0 0 "[ . 1 . 2]" 1
781 1 33 LYS HA 1 37 ASN HB2 . . 3.600 3.238 3.049 3.348 . 0 0 "[ . 1 . 2]" 1
782 1 33 LYS HA 1 37 ASN HB3 . . 3.600 1.979 1.929 2.033 . 0 0 "[ . 1 . 2]" 1
783 1 33 LYS HA 1 37 ASN HD21 . . 5.500 4.530 4.114 4.701 . 0 0 "[ . 1 . 2]" 1
784 1 33 LYS HA 1 37 ASN HD22 . . 5.500 5.544 5.449 5.574 0.074 19 0 "[ . 1 . 2]" 1
785 1 33 LYS HA 1 39 ASP H . . 5.500 5.179 4.973 5.299 . 0 0 "[ . 1 . 2]" 1
786 1 33 LYS HA 1 40 LEU H . . 5.500 3.870 3.722 4.001 . 0 0 "[ . 1 . 2]" 1
787 1 33 LYS HA 1 40 LEU HB2 . . 5.500 4.276 3.972 4.617 . 0 0 "[ . 1 . 2]" 1
788 1 33 LYS HA 1 40 LEU HB3 . . 5.500 2.767 2.566 3.034 . 0 0 "[ . 1 . 2]" 1
789 1 33 LYS HA 1 40 LEU QD . . 7.370 2.619 2.511 2.733 . 0 0 "[ . 1 . 2]" 1
790 1 33 LYS HA 1 40 LEU HG . . 5.500 3.776 3.679 3.939 . 0 0 "[ . 1 . 2]" 1
791 1 33 LYS QB 1 33 LYS QE . . 4.390 3.619 3.459 3.658 . 0 0 "[ . 1 . 2]" 1
792 1 33 LYS QB 1 34 HIS HA . . 6.380 4.178 3.962 4.267 . 0 0 "[ . 1 . 2]" 1
793 1 33 LYS QB 1 35 GLU H . . 6.380 4.280 4.159 4.390 . 0 0 "[ . 1 . 2]" 1
794 1 33 LYS QB 1 37 ASN QB . . 7.250 3.583 3.434 3.722 . 0 0 "[ . 1 . 2]" 1
795 1 33 LYS QB 1 38 PRO HA . . 6.380 4.815 4.409 4.965 . 0 0 "[ . 1 . 2]" 1
796 1 33 LYS QB 1 40 LEU H . . 6.380 4.615 4.413 4.901 . 0 0 "[ . 1 . 2]" 1
797 1 33 LYS QB 1 40 LEU QD . . 6.350 2.185 2.080 2.233 . 0 0 "[ . 1 . 2]" 1
798 1 33 LYS QB 1 40 LEU HG . . 4.480 2.337 2.209 2.802 . 0 0 "[ . 1 . 2]" 1
799 1 33 LYS QB 1 41 VAL HA . . 6.380 4.611 4.449 4.785 . 0 0 "[ . 1 . 2]" 1
800 1 33 LYS HB2 1 33 LYS HD2 . . 3.600 2.642 2.574 2.894 . 0 0 "[ . 1 . 2]" 1
801 1 33 LYS HB2 1 33 LYS HD3 . . 3.600 2.716 2.558 2.793 . 0 0 "[ . 1 . 2]" 1
802 1 33 LYS HB2 1 33 LYS HE2 . . 5.350 4.398 4.366 4.463 . 0 0 "[ . 1 . 2]" 1
803 1 33 LYS HB2 1 33 LYS HE3 . . 5.350 4.754 4.702 4.815 . 0 0 "[ . 1 . 2]" 1
804 1 33 LYS HB2 1 34 HIS H . . 3.600 3.574 3.306 3.652 0.052 14 0 "[ . 1 . 2]" 1
805 1 33 LYS HB3 1 33 LYS HD2 . . 3.600 3.318 3.216 3.449 . 0 0 "[ . 1 . 2]" 1
806 1 33 LYS HB3 1 33 LYS HD3 . . 3.600 2.426 2.290 2.492 . 0 0 "[ . 1 . 2]" 1
807 1 33 LYS HB3 1 33 LYS HE2 . . 5.350 4.422 3.944 4.521 . 0 0 "[ . 1 . 2]" 1
808 1 33 LYS HB3 1 33 LYS HE3 . . 5.350 4.782 4.652 4.832 . 0 0 "[ . 1 . 2]" 1
809 1 33 LYS HB3 1 34 HIS H . . 3.600 2.241 2.151 2.328 . 0 0 "[ . 1 . 2]" 1
810 1 33 LYS QD 1 40 LEU HA . . 6.380 4.499 4.427 4.620 . 0 0 "[ . 1 . 2]" 1
811 1 33 LYS QD 1 40 LEU QB . . 5.860 3.375 3.185 3.625 . 0 0 "[ . 1 . 2]" 1
812 1 33 LYS QD 1 40 LEU QD . . 4.510 3.083 2.953 3.128 . 0 0 "[ . 1 . 2]" 1
813 1 33 LYS HD2 1 34 HIS H . . 5.500 5.492 5.313 5.573 0.073 20 0 "[ . 1 . 2]" 1
814 1 33 LYS HD2 1 38 PRO HA . . 5.500 5.299 4.974 5.434 . 0 0 "[ . 1 . 2]" 1
815 1 33 LYS HD2 1 40 LEU H . . 5.500 4.311 4.259 4.445 . 0 0 "[ . 1 . 2]" 1
816 1 33 LYS HD2 1 40 LEU HB2 . . 7.250 4.798 4.698 5.003 . 0 0 "[ . 1 . 2]" 1
817 1 33 LYS HD2 1 40 LEU HB3 . . 7.250 3.556 3.339 3.876 . 0 0 "[ . 1 . 2]" 1
818 1 33 LYS HD2 1 40 LEU MD1 . . 5.650 3.515 3.471 3.579 . 0 0 "[ . 1 . 2]" 1
819 1 33 LYS HD2 1 40 LEU MD2 . . 5.650 3.717 3.422 3.806 . 0 0 "[ . 1 . 2]" 1
820 1 33 LYS HD2 1 40 LEU HG . . 3.600 2.263 2.199 2.317 . 0 0 "[ . 1 . 2]" 1
821 1 33 LYS HD2 1 41 VAL H . . 5.500 3.884 3.729 3.960 . 0 0 "[ . 1 . 2]" 1
822 1 33 LYS HD3 1 34 HIS H . . 5.500 4.534 4.263 4.674 . 0 0 "[ . 1 . 2]" 1
823 1 33 LYS HD3 1 38 PRO HA . . 5.500 5.504 5.111 5.573 0.073 10 0 "[ . 1 . 2]" 1
824 1 33 LYS HD3 1 40 LEU H . . 5.500 5.593 5.586 5.602 0.102 6 0 "[ . 1 . 2]" 1
825 1 33 LYS HD3 1 40 LEU HB2 . . 7.250 6.218 6.018 6.308 . 0 0 "[ . 1 . 2]" 1
826 1 33 LYS HD3 1 40 LEU HB3 . . 7.250 4.798 4.489 4.973 . 0 0 "[ . 1 . 2]" 1
827 1 33 LYS HD3 1 40 LEU MD1 . . 5.650 4.658 4.631 4.680 . 0 0 "[ . 1 . 2]" 1
828 1 33 LYS HD3 1 40 LEU MD2 . . 5.650 4.339 3.887 4.474 . 0 0 "[ . 1 . 2]" 1
829 1 33 LYS HD3 1 40 LEU HG . . 3.600 3.560 3.496 3.608 0.008 13 0 "[ . 1 . 2]" 1
830 1 33 LYS HD3 1 41 VAL H . . 5.500 5.518 5.350 5.584 0.084 20 0 "[ . 1 . 2]" 1
831 1 33 LYS QE 1 40 LEU QB . . 5.350 4.051 4.010 4.126 . 0 0 "[ . 1 . 2]" 1
832 1 33 LYS HE2 1 33 LYS HG2 . . 3.600 2.544 1.990 2.677 . 0 0 "[ . 1 . 2]" 1
833 1 33 LYS HE2 1 33 LYS HG3 . . 3.600 2.485 2.391 2.723 . 0 0 "[ . 1 . 2]" 1
834 1 33 LYS HE2 1 38 PRO HA . . 5.500 3.569 3.123 3.891 . 0 0 "[ . 1 . 2]" 1
835 1 33 LYS HE2 1 40 LEU HG . . 5.500 4.334 4.243 4.462 . 0 0 "[ . 1 . 2]" 1
836 1 33 LYS HE3 1 33 LYS HG2 . . 3.600 3.618 3.389 3.658 0.058 11 0 "[ . 1 . 2]" 1
837 1 33 LYS HE3 1 33 LYS HG3 . . 3.600 3.603 3.481 3.660 0.060 4 0 "[ . 1 . 2]" 1
838 1 33 LYS HE3 1 38 PRO HA . . 5.500 5.274 4.819 5.559 0.059 12 0 "[ . 1 . 2]" 1
839 1 33 LYS HE3 1 40 LEU HG . . 5.500 4.478 4.248 4.571 . 0 0 "[ . 1 . 2]" 1
840 1 33 LYS QG 1 34 HIS HA . . 6.380 3.927 3.634 4.366 . 0 0 "[ . 1 . 2]" 1
841 1 33 LYS QG 1 37 ASN H . . 6.380 4.174 4.090 4.281 . 0 0 "[ . 1 . 2]" 1
842 1 33 LYS QG 1 37 ASN QB . . 7.250 3.312 2.996 3.443 . 0 0 "[ . 1 . 2]" 1
843 1 33 LYS QG 1 40 LEU QB . . 5.350 2.371 2.187 2.532 . 0 0 "[ . 1 . 2]" 1
844 1 33 LYS QG 1 40 LEU QD . . 5.020 3.155 2.651 3.289 . 0 0 "[ . 1 . 2]" 1
845 1 33 LYS QG 1 40 LEU HG . . 6.380 2.796 2.276 2.947 . 0 0 "[ . 1 . 2]" 1
846 1 33 LYS HG2 1 38 PRO HA . . 5.500 3.051 2.646 3.221 . 0 0 "[ . 1 . 2]" 1
847 1 33 LYS HG2 1 40 LEU MD1 . . 7.040 5.583 5.309 5.636 . 0 0 "[ . 1 . 2]" 1
848 1 33 LYS HG2 1 40 LEU MD2 . . 7.040 4.420 3.965 4.535 . 0 0 "[ . 1 . 2]" 1
849 1 33 LYS HG3 1 38 PRO HA . . 5.500 3.386 2.943 3.993 . 0 0 "[ . 1 . 2]" 1
850 1 33 LYS HG3 1 40 LEU MD1 . . 7.040 4.338 3.904 4.427 . 0 0 "[ . 1 . 2]" 1
851 1 33 LYS HG3 1 40 LEU MD2 . . 7.040 3.362 2.750 3.551 . 0 0 "[ . 1 . 2]" 1
852 1 33 LYS O 1 37 ASN H . . 1.800 2.065 2.053 2.080 0.280 1 0 "[ . 1 . 2]" 1
853 1 33 LYS O 1 37 ASN N . . 2.700 2.999 2.957 3.056 0.356 5 0 "[ . 1 . 2]" 1
854 1 34 HIS H 1 34 HIS HB2 . . 3.600 2.154 2.072 2.280 . 0 0 "[ . 1 . 2]" 1
855 1 34 HIS H 1 34 HIS HB3 . . 3.600 3.390 3.218 3.489 . 0 0 "[ . 1 . 2]" 1
856 1 34 HIS H 1 35 GLU H . . 3.600 2.578 2.431 2.710 . 0 0 "[ . 1 . 2]" 1
857 1 34 HIS H 1 36 GLY H . . 5.500 4.709 4.360 5.041 . 0 0 "[ . 1 . 2]" 1
858 1 34 HIS H 1 40 LEU QD . . 7.370 4.569 4.471 4.625 . 0 0 "[ . 1 . 2]" 1
859 1 34 HIS HA 1 35 GLU H . . 3.600 3.489 3.409 3.542 . 0 0 "[ . 1 . 2]" 1
860 1 34 HIS HA 1 35 GLU HA . . 5.500 4.686 4.593 4.749 . 0 0 "[ . 1 . 2]" 1
861 1 34 HIS HA 1 38 PRO HA . . 5.500 4.815 4.141 5.194 . 0 0 "[ . 1 . 2]" 1
862 1 34 HIS HA 1 38 PRO QB . . 6.380 5.155 4.397 5.481 . 0 0 "[ . 1 . 2]" 1
863 1 34 HIS HB2 1 35 GLU H . . 3.600 3.305 2.807 3.662 0.062 18 0 "[ . 1 . 2]" 1
864 1 34 HIS HB2 1 35 GLU HA . . 5.500 4.898 4.383 5.282 . 0 0 "[ . 1 . 2]" 1
865 1 34 HIS HB3 1 35 GLU H . . 3.600 3.646 3.516 3.696 0.096 12 0 "[ . 1 . 2]" 1
866 1 34 HIS HB3 1 35 GLU HA . . 5.500 4.193 4.017 4.469 . 0 0 "[ . 1 . 2]" 1
867 1 35 GLU H 1 35 GLU HB2 . . 3.600 2.348 2.239 2.460 . 0 0 "[ . 1 . 2]" 1
868 1 35 GLU H 1 35 GLU QB . . 3.060 2.236 2.169 2.308 . 0 0 "[ . 1 . 2]" 1
869 1 35 GLU H 1 35 GLU HB3 . . 3.600 2.828 2.659 3.053 . 0 0 "[ . 1 . 2]" 1
870 1 35 GLU H 1 35 GLU HG2 . . 5.500 4.409 4.244 4.664 . 0 0 "[ . 1 . 2]" 1
871 1 35 GLU H 1 35 GLU HG3 . . 5.500 4.458 4.213 4.651 . 0 0 "[ . 1 . 2]" 1
872 1 35 GLU H 1 36 GLY H . . 5.500 2.738 2.572 2.941 . 0 0 "[ . 1 . 2]" 1
873 1 35 GLU H 1 37 ASN H . . 5.500 3.780 3.663 3.880 . 0 0 "[ . 1 . 2]" 1
874 1 35 GLU H 1 37 ASN QB . . 6.380 4.790 4.575 4.981 . 0 0 "[ . 1 . 2]" 1
875 1 35 GLU HA 1 36 GLY H . . 3.600 3.580 3.513 3.621 0.021 16 0 "[ . 1 . 2]" 1
876 1 35 GLU HA 1 36 GLY HA2 . . 5.500 4.731 4.688 4.850 . 0 0 "[ . 1 . 2]" 1
877 1 35 GLU HA 1 36 GLY HA3 . . 5.500 4.903 4.800 4.956 . 0 0 "[ . 1 . 2]" 1
878 1 35 GLU HA 1 37 ASN H . . 5.500 5.222 5.140 5.292 . 0 0 "[ . 1 . 2]" 1
879 1 36 GLY H 1 37 ASN H . . 3.600 2.109 1.875 2.485 . 0 0 "[ . 1 . 2]" 1
880 1 36 GLY H 1 37 ASN HA . . 5.500 4.598 4.513 4.687 . 0 0 "[ . 1 . 2]" 1
881 1 36 GLY H 1 37 ASN QB . . 6.380 3.503 3.315 3.615 . 0 0 "[ . 1 . 2]" 1
882 1 36 GLY QA 1 37 ASN HA . . 6.380 4.078 3.976 4.120 . 0 0 "[ . 1 . 2]" 1
883 1 36 GLY QA 1 37 ASN QB . . 6.320 4.179 4.066 4.250 . 0 0 "[ . 1 . 2]" 1
884 1 36 GLY QA 1 38 PRO QD . . 5.860 3.084 2.960 3.347 . 0 0 "[ . 1 . 2]" 1
885 1 36 GLY HA2 1 37 ASN H . . 3.600 3.117 2.821 3.207 . 0 0 "[ . 1 . 2]" 1
886 1 36 GLY HA2 1 37 ASN HB2 . . 7.250 5.222 4.913 5.335 . 0 0 "[ . 1 . 2]" 1
887 1 36 GLY HA2 1 37 ASN HB3 . . 7.250 5.952 5.826 6.050 . 0 0 "[ . 1 . 2]" 1
888 1 36 GLY HA2 1 38 PRO HD2 . . 7.250 4.366 4.082 4.755 . 0 0 "[ . 1 . 2]" 1
889 1 36 GLY HA2 1 38 PRO HD3 . . 7.250 3.250 3.116 3.573 . 0 0 "[ . 1 . 2]" 1
890 1 36 GLY HA3 1 37 ASN H . . 3.600 3.589 3.533 3.637 0.037 6 0 "[ . 1 . 2]" 1
891 1 36 GLY HA3 1 37 ASN HB2 . . 7.250 4.713 4.553 4.807 . 0 0 "[ . 1 . 2]" 1
892 1 36 GLY HA3 1 37 ASN HB3 . . 7.250 5.877 5.741 5.993 . 0 0 "[ . 1 . 2]" 1
893 1 36 GLY HA3 1 38 PRO HD2 . . 7.250 5.198 4.939 5.691 . 0 0 "[ . 1 . 2]" 1
894 1 36 GLY HA3 1 38 PRO HD3 . . 7.250 4.541 4.416 4.832 . 0 0 "[ . 1 . 2]" 1
895 1 37 ASN H 1 37 ASN HB2 . . 3.600 2.972 2.911 3.044 . 0 0 "[ . 1 . 2]" 1
896 1 37 ASN H 1 37 ASN HB3 . . 3.600 3.071 2.959 3.339 . 0 0 "[ . 1 . 2]" 1
897 1 37 ASN H 1 38 PRO HA . . 5.500 4.191 4.012 4.287 . 0 0 "[ . 1 . 2]" 1
898 1 37 ASN H 1 38 PRO QD . . 4.480 2.978 2.775 3.139 . 0 0 "[ . 1 . 2]" 1
899 1 37 ASN H 1 38 PRO QG . . 6.380 4.909 4.546 5.091 . 0 0 "[ . 1 . 2]" 1
900 1 37 ASN HA 1 38 PRO QB . . 6.010 5.017 4.962 5.132 . 0 0 "[ . 1 . 2]" 1
901 1 37 ASN HA 1 38 PRO HD2 . . 3.600 2.382 2.285 2.536 . 0 0 "[ . 1 . 2]" 1
902 1 37 ASN HA 1 38 PRO HD3 . . 3.600 3.213 2.801 3.403 . 0 0 "[ . 1 . 2]" 1
903 1 37 ASN HA 1 38 PRO HG2 . . 5.500 4.462 4.334 4.668 . 0 0 "[ . 1 . 2]" 1
904 1 37 ASN HA 1 38 PRO HG3 . . 5.500 4.980 4.866 5.151 . 0 0 "[ . 1 . 2]" 1
905 1 37 ASN HA 1 39 ASP H . . 5.500 3.328 3.136 3.522 . 0 0 "[ . 1 . 2]" 1
906 1 37 ASN HA 1 39 ASP QB . . 4.480 3.876 3.622 4.071 . 0 0 "[ . 1 . 2]" 1
907 1 37 ASN HA 1 40 LEU QB . . 6.380 4.144 4.077 4.181 . 0 0 "[ . 1 . 2]" 1
908 1 37 ASN QB 1 40 LEU HA . . 6.380 4.837 4.749 4.927 . 0 0 "[ . 1 . 2]" 1
909 1 37 ASN QB 1 40 LEU QD . . 7.320 2.362 2.239 2.502 . 0 0 "[ . 1 . 2]" 1
910 1 37 ASN HB2 1 38 PRO HD2 . . 5.500 4.982 4.877 5.168 . 0 0 "[ . 1 . 2]" 1
911 1 37 ASN HB2 1 38 PRO HD3 . . 5.500 5.197 4.933 5.296 . 0 0 "[ . 1 . 2]" 1
912 1 37 ASN HB2 1 40 LEU H . . 5.500 4.791 4.657 4.911 . 0 0 "[ . 1 . 2]" 1
913 1 37 ASN HB2 1 40 LEU HB2 . . 5.500 4.219 4.066 4.518 . 0 0 "[ . 1 . 2]" 1
914 1 37 ASN HB2 1 40 LEU HB3 . . 5.500 3.861 3.777 3.989 . 0 0 "[ . 1 . 2]" 1
915 1 37 ASN HB2 1 40 LEU MD1 . . 8.940 5.569 5.451 5.638 . 0 0 "[ . 1 . 2]" 1
916 1 37 ASN HB2 1 40 LEU MD2 . . 8.940 3.379 3.308 3.485 . 0 0 "[ . 1 . 2]" 1
917 1 37 ASN HB2 1 40 LEU HG . . 5.500 5.593 5.588 5.597 0.097 4 0 "[ . 1 . 2]" 1
918 1 37 ASN HB3 1 38 PRO HD2 . . 5.500 4.996 4.948 5.070 . 0 0 "[ . 1 . 2]" 1
919 1 37 ASN HB3 1 38 PRO HD3 . . 5.500 5.159 5.031 5.237 . 0 0 "[ . 1 . 2]" 1
920 1 37 ASN HB3 1 40 LEU H . . 5.500 3.418 3.314 3.516 . 0 0 "[ . 1 . 2]" 1
921 1 37 ASN HB3 1 40 LEU HB2 . . 5.500 3.089 2.793 3.286 . 0 0 "[ . 1 . 2]" 1
922 1 37 ASN HB3 1 40 LEU HB3 . . 5.500 2.262 2.178 2.328 . 0 0 "[ . 1 . 2]" 1
923 1 37 ASN HB3 1 40 LEU MD1 . . 8.940 4.581 4.470 4.655 . 0 0 "[ . 1 . 2]" 1
924 1 37 ASN HB3 1 40 LEU MD2 . . 8.940 2.424 2.285 2.581 . 0 0 "[ . 1 . 2]" 1
925 1 37 ASN HB3 1 40 LEU HG . . 5.500 4.043 4.019 4.076 . 0 0 "[ . 1 . 2]" 1
926 1 37 ASN QD 1 40 LEU QB . . 6.320 2.455 2.164 2.580 . 0 0 "[ . 1 . 2]" 1
927 1 37 ASN QD 1 40 LEU QD . . 7.320 2.498 2.263 2.683 . 0 0 "[ . 1 . 2]" 1
928 1 37 ASN HD21 1 40 LEU HA . . 5.500 5.272 4.761 5.540 0.040 15 0 "[ . 1 . 2]" 1
929 1 37 ASN HD21 1 40 LEU HB2 . . 7.250 2.982 2.427 3.251 . 0 0 "[ . 1 . 2]" 1
930 1 37 ASN HD21 1 40 LEU HB3 . . 7.250 3.674 2.818 3.947 . 0 0 "[ . 1 . 2]" 1
931 1 37 ASN HD21 1 40 LEU MD1 . . 8.940 4.255 3.701 4.468 . 0 0 "[ . 1 . 2]" 1
932 1 37 ASN HD21 1 40 LEU MD2 . . 8.940 2.606 2.314 2.830 . 0 0 "[ . 1 . 2]" 1
933 1 37 ASN HD21 1 40 LEU HG . . 5.500 5.044 4.308 5.273 . 0 0 "[ . 1 . 2]" 1
934 1 37 ASN HD22 1 40 LEU HA . . 5.500 4.573 4.395 4.794 . 0 0 "[ . 1 . 2]" 1
935 1 37 ASN HD22 1 40 LEU HB2 . . 7.250 2.741 2.612 2.877 . 0 0 "[ . 1 . 2]" 1
936 1 37 ASN HD22 1 40 LEU HB3 . . 7.250 3.953 3.668 4.292 . 0 0 "[ . 1 . 2]" 1
937 1 37 ASN HD22 1 40 LEU MD1 . . 8.940 4.318 4.182 4.424 . 0 0 "[ . 1 . 2]" 1
938 1 37 ASN HD22 1 40 LEU MD2 . . 8.940 3.481 3.264 3.750 . 0 0 "[ . 1 . 2]" 1
939 1 37 ASN HD22 1 40 LEU HG . . 5.500 5.530 5.410 5.566 0.066 4 0 "[ . 1 . 2]" 1
940 1 38 PRO HA 1 39 ASP HA . . 5.500 4.931 4.805 5.066 . 0 0 "[ . 1 . 2]" 1
941 1 38 PRO HA 1 40 LEU H . . 5.500 3.857 3.752 3.964 . 0 0 "[ . 1 . 2]" 1
942 1 38 PRO QB 1 39 ASP H . . 4.120 3.487 3.321 3.696 . 0 0 "[ . 1 . 2]" 1
943 1 38 PRO QB 1 39 ASP QB . . 7.250 4.767 4.548 5.014 . 0 0 "[ . 1 . 2]" 1
944 1 38 PRO QD 1 39 ASP QB . . 7.250 3.784 3.448 3.997 . 0 0 "[ . 1 . 2]" 1
945 1 38 PRO QD 1 40 LEU H . . 6.380 4.560 4.397 4.609 . 0 0 "[ . 1 . 2]" 1
946 1 38 PRO HD2 1 39 ASP H . . 5.500 2.876 2.572 3.001 . 0 0 "[ . 1 . 2]" 1
947 1 38 PRO HD3 1 39 ASP H . . 5.500 3.962 3.871 4.036 . 0 0 "[ . 1 . 2]" 1
948 1 38 PRO QG 1 39 ASP HA . . 6.380 4.497 4.326 5.003 . 0 0 "[ . 1 . 2]" 1
949 1 38 PRO QG 1 39 ASP QB . . 7.250 3.831 3.385 4.229 . 0 0 "[ . 1 . 2]" 1
950 1 38 PRO HG2 1 39 ASP H . . 5.500 2.845 2.602 3.638 . 0 0 "[ . 1 . 2]" 1
951 1 38 PRO HG3 1 39 ASP H . . 5.500 4.277 4.106 4.675 . 0 0 "[ . 1 . 2]" 1
952 1 39 ASP H 1 39 ASP HB2 . . 3.600 2.032 1.935 2.204 . 0 0 "[ . 1 . 2]" 1
953 1 39 ASP H 1 39 ASP QB . . 3.060 2.006 1.920 2.176 . 0 0 "[ . 1 . 2]" 1
954 1 39 ASP H 1 39 ASP HB3 . . 3.600 3.137 2.909 3.349 . 0 0 "[ . 1 . 2]" 1
955 1 39 ASP H 1 40 LEU H . . 2.700 2.622 2.351 2.766 0.066 15 0 "[ . 1 . 2]" 1
956 1 39 ASP H 1 40 LEU HA . . 5.500 5.203 4.992 5.396 . 0 0 "[ . 1 . 2]" 1
957 1 39 ASP H 1 40 LEU HB2 . . 5.500 5.163 4.956 5.476 . 0 0 "[ . 1 . 2]" 1
958 1 39 ASP H 1 40 LEU HB3 . . 5.500 4.446 4.123 4.650 . 0 0 "[ . 1 . 2]" 1
959 1 39 ASP HA 1 40 LEU H . . 3.600 3.514 3.447 3.562 . 0 0 "[ . 1 . 2]" 1
960 1 39 ASP HA 1 40 LEU QB . . 6.380 5.142 5.113 5.172 . 0 0 "[ . 1 . 2]" 1
961 1 39 ASP HA 1 41 VAL QG . . 7.360 3.990 3.739 4.341 . 0 0 "[ . 1 . 2]" 1
962 1 39 ASP QB 1 40 LEU QB . . 7.250 3.948 3.674 4.186 . 0 0 "[ . 1 . 2]" 1
963 1 39 ASP QB 1 41 VAL QG . . 7.310 4.628 4.557 4.722 . 0 0 "[ . 1 . 2]" 1
964 1 39 ASP HB2 1 40 LEU H . . 3.600 3.391 2.736 3.683 0.083 20 0 "[ . 1 . 2]" 1
965 1 39 ASP HB2 1 40 LEU HA . . 5.500 5.015 4.287 5.392 . 0 0 "[ . 1 . 2]" 1
966 1 39 ASP HB2 1 41 VAL MG1 . . 8.920 5.951 5.752 6.057 . 0 0 "[ . 1 . 2]" 1
967 1 39 ASP HB2 1 41 VAL MG2 . . 8.920 6.898 6.565 7.364 . 0 0 "[ . 1 . 2]" 1
968 1 39 ASP HB3 1 40 LEU H . . 3.600 3.489 3.182 3.685 0.085 15 0 "[ . 1 . 2]" 1
969 1 39 ASP HB3 1 40 LEU HA . . 5.500 4.099 3.840 4.357 . 0 0 "[ . 1 . 2]" 1
970 1 39 ASP HB3 1 41 VAL MG1 . . 8.920 5.293 5.028 5.530 . 0 0 "[ . 1 . 2]" 1
971 1 39 ASP HB3 1 41 VAL MG2 . . 8.920 5.899 5.743 6.305 . 0 0 "[ . 1 . 2]" 1
972 1 40 LEU H 1 40 LEU HB2 . . 3.600 2.957 2.781 3.119 . 0 0 "[ . 1 . 2]" 1
973 1 40 LEU H 1 40 LEU HB3 . . 3.600 2.103 2.075 2.141 . 0 0 "[ . 1 . 2]" 1
974 1 40 LEU H 1 40 LEU MD1 . . 5.800 4.317 4.269 4.394 . 0 0 "[ . 1 . 2]" 1
975 1 40 LEU H 1 40 LEU QD . . 4.690 3.746 3.704 3.777 . 0 0 "[ . 1 . 2]" 1
976 1 40 LEU H 1 40 LEU MD2 . . 5.800 4.112 4.050 4.194 . 0 0 "[ . 1 . 2]" 1
977 1 40 LEU H 1 40 LEU HG . . 5.500 3.920 3.829 4.027 . 0 0 "[ . 1 . 2]" 1
978 1 40 LEU H 1 41 VAL H . . 5.500 4.589 4.526 4.663 . 0 0 "[ . 1 . 2]" 1
979 1 40 LEU HA 1 40 LEU HG . . 3.600 3.517 3.444 3.584 . 0 0 "[ . 1 . 2]" 1
980 1 40 LEU HA 1 41 VAL H . . 2.700 2.300 2.203 2.366 . 0 0 "[ . 1 . 2]" 1
981 1 40 LEU HA 1 41 VAL HB . . 5.500 5.583 5.579 5.593 0.093 12 0 "[ . 1 . 2]" 1
982 1 40 LEU HA 1 41 VAL QG . . 5.460 3.146 3.087 3.262 . 0 0 "[ . 1 . 2]" 1
983 1 40 LEU QB 1 41 VAL QG . . 6.340 4.197 4.169 4.256 . 0 0 "[ . 1 . 2]" 1
984 1 40 LEU HB2 1 41 VAL H . . 5.500 3.833 3.694 3.922 . 0 0 "[ . 1 . 2]" 1
985 1 40 LEU HB3 1 41 VAL H . . 5.500 4.124 4.045 4.226 . 0 0 "[ . 1 . 2]" 1
986 1 40 LEU QD 1 41 VAL QG . . 8.030 3.343 3.265 3.466 . 0 0 "[ . 1 . 2]" 1
987 1 40 LEU QD 1 43 VAL QG . . 8.030 3.745 3.592 3.871 . 0 0 "[ . 1 . 2]" 1
988 1 40 LEU MD1 1 41 VAL H . . 5.800 1.898 1.802 2.023 . 0 0 "[ . 1 . 2]" 1
989 1 40 LEU MD2 1 41 VAL H . . 5.800 4.242 4.178 4.318 . 0 0 "[ . 1 . 2]" 1
990 1 40 LEU HG 1 41 VAL H . . 3.600 3.146 3.027 3.225 . 0 0 "[ . 1 . 2]" 1
991 1 40 LEU HG 1 41 VAL HA . . 5.500 3.564 3.430 3.624 . 0 0 "[ . 1 . 2]" 1
992 1 40 LEU HG 1 41 VAL QG . . 5.460 4.260 4.201 4.276 . 0 0 "[ . 1 . 2]" 1
993 1 41 VAL H 1 41 VAL MG1 . . 3.900 3.205 3.087 3.235 . 0 0 "[ . 1 . 2]" 1
994 1 41 VAL H 1 41 VAL QG . . 3.110 2.359 2.293 2.477 . 0 0 "[ . 1 . 2]" 1
995 1 41 VAL H 1 41 VAL MG2 . . 3.900 2.431 2.348 2.597 . 0 0 "[ . 1 . 2]" 1
996 1 41 VAL H 1 42 GLN H . . 5.500 4.284 4.208 4.333 . 0 0 "[ . 1 . 2]" 1
997 1 41 VAL H 1 42 GLN HA . . 5.500 4.704 4.591 4.832 . 0 0 "[ . 1 . 2]" 1
998 1 41 VAL H 1 43 VAL QG . . 7.360 3.878 3.675 3.982 . 0 0 "[ . 1 . 2]" 1
999 1 41 VAL HA 1 42 GLN H . . 2.700 2.319 2.265 2.404 . 0 0 "[ . 1 . 2]" 1
1000 1 41 VAL HA 1 42 GLN QB . . 6.380 4.185 4.109 4.262 . 0 0 "[ . 1 . 2]" 1
1001 1 41 VAL HB 1 42 GLN H . . 3.600 2.808 2.565 3.009 . 0 0 "[ . 1 . 2]" 1
1002 1 41 VAL HB 1 42 GLN HA . . 5.500 4.791 4.635 5.092 . 0 0 "[ . 1 . 2]" 1
1003 1 41 VAL QG 1 42 GLN HA . . 7.360 4.155 4.034 4.295 . 0 0 "[ . 1 . 2]" 1
1004 1 41 VAL QG 1 43 VAL HA . . 7.360 3.262 3.007 3.647 . 0 0 "[ . 1 . 2]" 1
1005 1 41 VAL QG 1 43 VAL QG . . 6.270 2.060 1.879 2.230 . 0 0 "[ . 1 . 2]" 1
1006 1 41 VAL MG1 1 42 GLN H . . 5.800 3.866 3.752 4.118 . 0 0 "[ . 1 . 2]" 1
1007 1 41 VAL MG1 1 43 VAL MG1 . . 8.020 4.398 4.076 4.639 . 0 0 "[ . 1 . 2]" 1
1008 1 41 VAL MG1 1 43 VAL MG2 . . 8.020 5.520 5.498 5.569 . 0 0 "[ . 1 . 2]" 1
1009 1 41 VAL MG2 1 42 GLN H . . 5.800 3.780 3.613 3.904 . 0 0 "[ . 1 . 2]" 1
1010 1 41 VAL MG2 1 43 VAL MG1 . . 8.020 2.087 1.892 2.276 . 0 0 "[ . 1 . 2]" 1
1011 1 41 VAL MG2 1 43 VAL MG2 . . 8.020 3.297 3.225 3.367 . 0 0 "[ . 1 . 2]" 1
1012 1 42 GLN H 1 42 GLN QB . . 3.810 2.283 2.250 2.333 . 0 0 "[ . 1 . 2]" 1
1013 1 42 GLN H 1 43 VAL H . . 5.500 3.952 3.885 4.030 . 0 0 "[ . 1 . 2]" 1
1014 1 42 GLN HA 1 43 VAL H . . 3.600 2.333 2.211 2.428 . 0 0 "[ . 1 . 2]" 1
1015 1 42 GLN HA 1 43 VAL HA . . 5.500 4.557 4.498 4.605 . 0 0 "[ . 1 . 2]" 1
1016 1 42 GLN HA 1 43 VAL MG1 . . 5.800 4.640 4.400 4.731 . 0 0 "[ . 1 . 2]" 1
1017 1 42 GLN HA 1 43 VAL MG2 . . 5.800 3.469 3.252 3.643 . 0 0 "[ . 1 . 2]" 1
1018 1 42 GLN HA 1 44 HIS H . . 5.500 3.503 3.266 3.641 . 0 0 "[ . 1 . 2]" 1
1019 1 42 GLN QB 1 43 VAL H . . 4.480 4.085 4.030 4.110 . 0 0 "[ . 1 . 2]" 1
1020 1 42 GLN QE 1 43 VAL QG . . 7.310 4.030 3.640 4.725 . 0 0 "[ . 1 . 2]" 1
1021 1 42 GLN QE 1 45 GLU HA . . 6.370 3.037 2.021 5.347 . 0 0 "[ . 1 . 2]" 1
1022 1 42 GLN HE21 1 43 VAL MG1 . . 8.920 6.170 5.667 7.030 . 0 0 "[ . 1 . 2]" 1
1023 1 42 GLN HE21 1 43 VAL MG2 . . 8.920 4.321 3.858 5.226 . 0 0 "[ . 1 . 2]" 1
1024 1 42 GLN HE21 1 45 GLU HG2 . . 5.500 4.963 3.911 5.569 0.069 3 0 "[ . 1 . 2]" 1
1025 1 42 GLN HE21 1 45 GLU HG3 . . 5.500 5.078 3.961 5.569 0.069 15 0 "[ . 1 . 2]" 1
1026 1 42 GLN HE22 1 43 VAL MG1 . . 8.920 7.210 6.796 7.454 . 0 0 "[ . 1 . 2]" 1
1027 1 42 GLN HE22 1 43 VAL MG2 . . 8.920 5.317 4.688 6.604 . 0 0 "[ . 1 . 2]" 1
1028 1 42 GLN HE22 1 45 GLU HG2 . . 5.500 4.829 3.830 5.557 0.057 7 0 "[ . 1 . 2]" 1
1029 1 42 GLN HE22 1 45 GLU HG3 . . 5.500 4.930 3.673 5.585 0.085 17 0 "[ . 1 . 2]" 1
1030 1 42 GLN QG 1 44 HIS QB . . 5.980 4.631 4.561 4.667 . 0 0 "[ . 1 . 2]" 1
1031 1 43 VAL H 1 43 VAL HA . . 2.700 2.780 2.767 2.789 0.089 11 0 "[ . 1 . 2]" 1
1032 1 43 VAL H 1 43 VAL HB . . 3.600 3.568 3.525 3.624 0.024 7 0 "[ . 1 . 2]" 1
1033 1 43 VAL H 1 43 VAL QG . . 3.760 1.748 1.685 1.802 . 0 0 "[ . 1 . 2]" 1
1034 1 43 VAL H 1 44 HIS H . . 2.700 2.762 2.747 2.774 0.074 15 0 "[ . 1 . 2]" 1
1035 1 43 VAL H 1 44 HIS HA . . 5.500 5.092 4.898 5.306 . 0 0 "[ . 1 . 2]" 1
1036 1 43 VAL HB 1 44 HIS H . . 3.600 3.331 3.060 3.620 0.020 18 0 "[ . 1 . 2]" 1
1037 1 43 VAL QG 1 44 HIS H . . 4.690 2.050 1.836 2.294 . 0 0 "[ . 1 . 2]" 1
1038 1 43 VAL QG 1 44 HIS QB . . 6.490 3.698 2.911 4.138 . 0 0 "[ . 1 . 2]" 1
1039 1 43 VAL MG1 1 44 HIS H . . 5.800 4.102 3.948 4.227 . 0 0 "[ . 1 . 2]" 1
1040 1 43 VAL MG1 1 44 HIS HB2 . . 7.550 6.008 5.144 6.405 . 0 0 "[ . 1 . 2]" 1
1041 1 43 VAL MG1 1 44 HIS HB3 . . 7.550 5.357 4.762 6.225 . 0 0 "[ . 1 . 2]" 1
1042 1 43 VAL MG2 1 44 HIS H . . 5.800 2.056 1.840 2.304 . 0 0 "[ . 1 . 2]" 1
1043 1 43 VAL MG2 1 44 HIS HB2 . . 7.550 4.688 3.697 5.189 . 0 0 "[ . 1 . 2]" 1
1044 1 43 VAL MG2 1 44 HIS HB3 . . 7.550 4.096 3.087 4.919 . 0 0 "[ . 1 . 2]" 1
1045 1 44 HIS H 1 45 GLU HA . . 5.500 4.616 4.425 4.801 . 0 0 "[ . 1 . 2]" 1
1046 1 44 HIS H 1 45 GLU QB . . 6.380 5.521 5.191 5.787 . 0 0 "[ . 1 . 2]" 1
1047 1 44 HIS HA 1 45 GLU H . . 2.700 2.558 2.280 2.765 0.065 5 0 "[ . 1 . 2]" 1
1048 1 44 HIS QB 1 45 GLU H . . 4.480 2.726 2.068 3.789 . 0 0 "[ . 1 . 2]" 1
1049 1 44 HIS QB 1 45 GLU HA . . 6.380 4.674 4.288 5.235 . 0 0 "[ . 1 . 2]" 1
1050 1 45 GLU H 1 45 GLU QB . . 3.810 2.357 2.040 2.957 . 0 0 "[ . 1 . 2]" 1
1051 1 45 GLU H 1 45 GLU HG2 . . 5.500 3.984 1.972 4.561 . 0 0 "[ . 1 . 2]" 1
1052 1 45 GLU H 1 45 GLU HG3 . . 5.500 3.929 2.025 4.548 . 0 0 "[ . 1 . 2]" 1
1053 1 45 GLU H 1 46 GLY H . . 5.500 4.170 3.109 4.550 . 0 0 "[ . 1 . 2]" 1
1054 1 45 GLU HA 1 46 GLY H . . 3.600 2.755 2.462 3.175 . 0 0 "[ . 1 . 2]" 1
1055 1 45 GLU HA 1 46 GLY HA2 . . 5.500 4.725 4.205 5.149 . 0 0 "[ . 1 . 2]" 1
1056 1 45 GLU HA 1 46 GLY HA3 . . 5.500 4.753 4.638 4.967 . 0 0 "[ . 1 . 2]" 1
1057 1 45 GLU QB 1 46 GLY QA . . 7.250 3.839 3.380 4.558 . 0 0 "[ . 1 . 2]" 1
1058 1 45 GLU HB2 1 46 GLY H . . 5.500 3.699 2.031 4.689 . 0 0 "[ . 1 . 2]" 1
1059 1 45 GLU HB3 1 46 GLY H . . 5.500 3.120 2.141 4.612 . 0 0 "[ . 1 . 2]" 1
1060 1 45 GLU QG 1 46 GLY H . . 4.480 3.239 1.676 4.128 . 0 0 "[ . 1 . 2]" 1
1061 1 46 GLY H 1 47 PRO HD2 . . 5.500 4.808 4.510 5.097 . 0 0 "[ . 1 . 2]" 1
1062 1 46 GLY H 1 47 PRO HD3 . . 5.500 4.169 3.738 4.786 . 0 0 "[ . 1 . 2]" 1
1063 1 47 PRO HA 1 48 CYS H . . 2.700 2.240 2.076 2.364 . 0 0 "[ . 1 . 2]" 1
1064 1 47 PRO HA 1 49 ASP H . . 5.500 4.350 3.730 5.470 . 0 0 "[ . 1 . 2]" 1
1065 1 47 PRO QB 1 49 ASP H . . 6.500 3.566 2.702 4.930 . 0 0 "[ . 1 . 2]" 1
1066 1 47 PRO QB 1 49 ASP QB . . 7.500 4.164 2.753 5.651 . 0 0 "[ . 1 . 2]" 1
1067 1 48 CYS H 1 48 CYS HB2 . . 3.600 2.359 2.277 2.442 . 0 0 "[ . 1 . 2]" 1
1068 1 48 CYS H 1 48 CYS HB3 . . 3.600 3.598 3.512 3.649 0.049 15 0 "[ . 1 . 2]" 1
1069 1 48 CYS H 1 49 ASP H . . 5.500 2.524 2.125 3.316 . 0 0 "[ . 1 . 2]" 1
1070 1 48 CYS HA 1 49 ASP H . . 3.600 3.594 3.507 3.662 0.062 5 0 "[ . 1 . 2]" 1
1071 1 48 CYS HA 1 49 ASP HA . . 5.500 4.772 4.670 4.872 . 0 0 "[ . 1 . 2]" 1
1072 1 48 CYS QB 1 49 ASP HA . . 4.480 3.986 3.773 4.140 . 0 0 "[ . 1 . 2]" 1
1073 1 48 CYS QB 1 49 ASP QB . . 5.780 3.728 2.844 4.222 . 0 0 "[ . 1 . 2]" 1
1074 1 48 CYS HB2 1 49 ASP H . . 3.600 2.533 1.960 2.956 . 0 0 "[ . 1 . 2]" 1
1075 1 48 CYS HB2 1 49 ASP QB . . 6.500 4.180 3.747 4.670 . 0 0 "[ . 1 . 2]" 1
1076 1 48 CYS HB3 1 49 ASP H . . 3.600 3.173 1.885 3.671 0.071 14 0 "[ . 1 . 2]" 1
1077 1 48 CYS HB3 1 49 ASP QB . . 6.500 4.361 2.942 5.157 . 0 0 "[ . 1 . 2]" 1
1078 1 49 ASP H 1 49 ASP HA . . 2.700 2.782 2.729 2.799 0.099 13 0 "[ . 1 . 2]" 1
1079 1 49 ASP H 1 49 ASP QB . . 3.700 2.390 2.058 3.217 . 0 0 "[ . 1 . 2]" 1
1080 1 49 ASP H 1 50 GLU H . . 5.500 4.292 3.125 4.645 . 0 0 "[ . 1 . 2]" 1
1081 1 49 ASP HA 1 50 GLU H . . 3.600 2.531 2.192 3.646 0.046 7 0 "[ . 1 . 2]" 1
1082 1 49 ASP QB 1 50 GLU H . . 4.100 3.165 2.041 3.793 . 0 0 "[ . 1 . 2]" 1
1083 1 49 ASP QB 1 50 GLU HA . . 6.500 4.505 3.853 5.063 . 0 0 "[ . 1 . 2]" 1
1084 1 50 GLU H 1 50 GLU QB . . 3.810 2.803 2.188 3.361 . 0 0 "[ . 1 . 2]" 1
1085 1 50 GLU HA 1 52 ASP H . . 5.500 4.788 3.215 5.580 0.080 15 0 "[ . 1 . 2]" 1
1086 1 50 GLU QG 1 51 HIS H . . 6.380 3.389 2.044 4.598 . 0 0 "[ . 1 . 2]" 1
1087 1 50 GLU QG 1 52 ASP H . . 6.380 4.790 2.048 5.790 . 0 0 "[ . 1 . 2]" 1
1088 1 51 HIS H 1 52 ASP H . . 5.500 2.911 1.638 4.129 . 0 0 "[ . 1 . 2]" 1
1089 1 52 ASP H 1 52 ASP HA . . 2.700 2.772 2.703 2.793 0.093 12 0 "[ . 1 . 2]" 1
1090 1 52 ASP H 1 52 ASP QB . . 3.700 2.745 2.134 3.371 . 0 0 "[ . 1 . 2]" 1
1091 1 52 ASP H 1 53 HIS H . . 5.500 4.351 3.690 4.653 . 0 0 "[ . 1 . 2]" 1
1092 1 52 ASP HA 1 53 HIS H . . 3.600 2.430 2.116 2.976 . 0 0 "[ . 1 . 2]" 1
1093 1 52 ASP HA 1 53 HIS HA . . 5.500 4.553 4.387 4.713 . 0 0 "[ . 1 . 2]" 1
1094 1 52 ASP QB 1 54 ASP HA . . 6.500 5.159 4.599 5.643 . 0 0 "[ . 1 . 2]" 1
1095 1 52 ASP QB 1 54 ASP QB . . 5.980 3.880 2.401 4.497 . 0 0 "[ . 1 . 2]" 1
1096 1 53 HIS H 1 53 HIS QB . . 3.810 2.764 2.187 3.336 . 0 0 "[ . 1 . 2]" 1
1097 1 53 HIS H 1 54 ASP H . . 3.600 2.984 2.351 3.674 0.074 3 0 "[ . 1 . 2]" 1
1098 1 53 HIS HA 1 54 ASP H . . 3.600 2.574 2.258 2.897 . 0 0 "[ . 1 . 2]" 1
1099 1 53 HIS HA 1 54 ASP HA . . 5.500 4.592 4.182 4.775 . 0 0 "[ . 1 . 2]" 1
1100 1 53 HIS HB2 1 54 ASP H . . 5.500 4.586 4.220 4.732 . 0 0 "[ . 1 . 2]" 1
1101 1 53 HIS HB3 1 54 ASP H . . 5.500 4.507 4.249 4.745 . 0 0 "[ . 1 . 2]" 1
1102 1 54 ASP H 1 54 ASP QB . . 3.810 2.465 2.148 3.345 . 0 0 "[ . 1 . 2]" 1
1103 1 54 ASP H 1 55 PHE H . . 5.500 3.990 2.600 4.738 . 0 0 "[ . 1 . 2]" 1
1104 1 54 ASP HA 1 55 PHE H . . 3.600 2.825 2.162 3.592 . 0 0 "[ . 1 . 2]" 1
1105 1 54 ASP HA 1 55 PHE HA . . 5.500 4.559 4.379 4.698 . 0 0 "[ . 1 . 2]" 1
1106 1 54 ASP QB 1 55 PHE H . . 3.580 2.658 2.089 3.230 . 0 0 "[ . 1 . 2]" 1
1107 1 55 PHE H 1 55 PHE QB . . 3.800 2.714 2.218 3.337 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Saturday, May 18, 2024 4:48:32 AM GMT (wattos1)