NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
486910 |
1aj4   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1aj4
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 1131
_Distance_constraint_stats_list.Viol_count 11
_Distance_constraint_stats_list.Viol_total 0.097
_Distance_constraint_stats_list.Viol_max 0.029
_Distance_constraint_stats_list.Viol_rms 0.0013
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0088
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 ASP 0.000 0.000 . 0 "[ ]"
1 4 ILE 0.000 0.000 . 0 "[ ]"
1 5 TYR 0.000 0.000 . 0 "[ ]"
1 6 LYS 0.000 0.000 . 0 "[ ]"
1 7 ALA 0.000 0.000 . 0 "[ ]"
1 8 ALA 0.036 0.029 1 0 "[ ]"
1 9 VAL 0.000 0.000 . 0 "[ ]"
1 10 GLU 0.007 0.007 1 0 "[ ]"
1 11 GLN 0.000 0.000 . 0 "[ ]"
1 12 LEU 0.000 0.000 . 0 "[ ]"
1 13 THR 0.000 0.000 . 0 "[ ]"
1 14 GLU 0.001 0.001 1 0 "[ ]"
1 15 GLU 0.000 0.000 . 0 "[ ]"
1 16 GLN 0.000 0.000 . 0 "[ ]"
1 17 LYS 0.001 0.001 1 0 "[ ]"
1 18 ASN 0.000 0.000 . 0 "[ ]"
1 19 GLU 0.000 0.000 . 0 "[ ]"
1 20 PHE 0.000 0.000 . 0 "[ ]"
1 21 LYS 0.005 0.005 1 0 "[ ]"
1 22 ALA 0.000 0.000 . 0 "[ ]"
1 23 ALA 0.000 0.000 . 0 "[ ]"
1 24 PHE 0.007 0.005 1 0 "[ ]"
1 25 ASP 0.000 0.000 . 0 "[ ]"
1 26 ILE 0.000 0.000 . 0 "[ ]"
1 27 PHE 0.002 0.002 1 0 "[ ]"
1 28 VAL 0.000 0.000 . 0 "[ ]"
1 29 LEU 0.000 0.000 . 0 "[ ]"
1 30 GLY 0.000 0.000 . 0 "[ ]"
1 31 ALA 0.000 0.000 1 0 "[ ]"
1 32 GLU 0.000 0.000 . 0 "[ ]"
1 33 ASP 0.000 0.000 1 0 "[ ]"
1 34 GLY 0.000 0.000 . 0 "[ ]"
1 35 SER 0.000 0.000 . 0 "[ ]"
1 36 ILE 0.000 0.000 . 0 "[ ]"
1 37 SER 0.000 0.000 . 0 "[ ]"
1 38 THR 0.015 0.015 1 0 "[ ]"
1 39 LYS 0.000 0.000 . 0 "[ ]"
1 40 GLU 0.015 0.015 1 0 "[ ]"
1 41 LEU 0.000 0.000 . 0 "[ ]"
1 42 GLY 0.000 0.000 . 0 "[ ]"
1 43 LYS 0.000 0.000 . 0 "[ ]"
1 44 VAL 0.000 0.000 . 0 "[ ]"
1 45 MET 0.000 0.000 . 0 "[ ]"
1 46 ARG 0.000 0.000 . 0 "[ ]"
1 47 MET 0.000 0.000 1 0 "[ ]"
1 48 LEU 0.000 0.000 . 0 "[ ]"
1 49 GLY 0.000 0.000 . 0 "[ ]"
1 50 GLN 0.000 0.000 . 0 "[ ]"
1 51 ASN 0.000 0.000 . 0 "[ ]"
1 52 PRO 0.000 0.000 . 0 "[ ]"
1 53 THR 0.000 0.000 . 0 "[ ]"
1 54 PRO 0.000 0.000 . 0 "[ ]"
1 55 GLU 0.000 0.000 . 0 "[ ]"
1 56 GLU 0.000 0.000 . 0 "[ ]"
1 57 LEU 0.000 0.000 . 0 "[ ]"
1 58 GLN 0.000 0.000 . 0 "[ ]"
1 59 GLU 0.000 0.000 . 0 "[ ]"
1 60 MET 0.000 0.000 . 0 "[ ]"
1 61 ILE 0.000 0.000 . 0 "[ ]"
1 62 ASP 0.000 0.000 . 0 "[ ]"
1 63 GLU 0.000 0.000 . 0 "[ ]"
1 64 VAL 0.000 0.000 . 0 "[ ]"
1 65 ASP 0.002 0.002 1 0 "[ ]"
1 66 GLU 0.000 0.000 . 0 "[ ]"
1 67 ASP 0.000 0.000 . 0 "[ ]"
1 68 GLY 0.000 0.000 . 0 "[ ]"
1 69 SER 0.000 0.000 . 0 "[ ]"
1 70 GLY 0.002 0.002 1 0 "[ ]"
1 71 THR 0.000 0.000 . 0 "[ ]"
1 72 VAL 0.000 0.000 . 0 "[ ]"
1 73 ASP 0.000 0.000 . 0 "[ ]"
1 74 PHE 0.000 0.000 . 0 "[ ]"
1 75 ASP 0.000 0.000 . 0 "[ ]"
1 76 GLU 0.016 0.016 1 0 "[ ]"
1 77 PHE 0.000 0.000 . 0 "[ ]"
1 78 LEU 0.020 0.020 1 0 "[ ]"
1 79 VAL 0.016 0.016 1 0 "[ ]"
1 80 MET 0.000 0.000 . 0 "[ ]"
1 81 MET 0.020 0.020 1 0 "[ ]"
1 82 VAL 0.029 0.029 1 0 "[ ]"
1 83 ARG 0.000 0.000 . 0 "[ ]"
1 84 SER 0.000 0.000 . 0 "[ ]"
1 85 MET 0.000 0.000 . 0 "[ ]"
1 86 LYS 0.000 0.000 . 0 "[ ]"
1 87 ASP 0.000 0.000 . 0 "[ ]"
1 88 ASP 0.000 0.000 . 0 "[ ]"
1 89 SER 0.000 0.000 . 0 "[ ]"
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 4 ILE H 1 5 TYR QD 3.850 . 6.000 3.648 3.648 3.648 . 0 0 "[ ]" 1
2 1 3 ASP QB 1 4 ILE H 3.150 . 4.590 3.052 3.052 3.052 . 0 0 "[ ]" 1
3 1 4 ILE H 1 4 ILE HB 2.770 . 3.830 2.604 2.604 2.604 . 0 0 "[ ]" 1
4 1 4 ILE H 1 4 ILE HA 2.800 . 3.900 3.000 3.000 3.000 . 0 0 "[ ]" 1
5 1 4 ILE H 1 4 ILE QG 2.930 . 4.160 2.257 2.257 2.257 . 0 0 "[ ]" 1
6 1 4 ILE QG 1 5 TYR H 3.850 . 6.000 3.614 3.614 3.614 . 0 0 "[ ]" 1
7 1 5 TYR H 1 79 VAL MG1 3.850 . 6.000 4.436 4.436 4.436 . 0 0 "[ ]" 1
8 1 3 ASP QB 1 6 LYS H 3.620 . 5.540 3.797 3.797 3.797 . 0 0 "[ ]" 1
9 1 6 LYS H 1 6 LYS HA 2.610 . 3.530 2.779 2.779 2.779 . 0 0 "[ ]" 1
10 1 6 LYS H 1 6 LYS QG 3.190 . 4.680 3.455 3.455 3.455 . 0 0 "[ ]" 1
11 1 6 LYS H 1 6 LYS QB 2.980 . 4.250 1.952 1.952 1.952 . 0 0 "[ ]" 1
12 1 6 LYS HA 1 7 ALA H 2.760 . 3.820 3.557 3.557 3.557 . 0 0 "[ ]" 1
13 1 6 LYS QB 1 7 ALA H 2.890 . 4.080 2.665 2.665 2.665 . 0 0 "[ ]" 1
14 1 7 ALA H 1 7 ALA HA 2.610 . 3.530 2.858 2.858 2.858 . 0 0 "[ ]" 1
15 1 7 ALA H 1 7 ALA MB 2.560 . 3.420 2.113 2.113 2.113 . 0 0 "[ ]" 1
16 1 5 TYR HA 1 7 ALA H 3.310 . 4.920 4.117 4.117 4.117 . 0 0 "[ ]" 1
17 1 7 ALA H 1 8 ALA H 2.760 . 3.820 2.674 2.674 2.674 . 0 0 "[ ]" 1
18 1 7 ALA MB 1 8 ALA H 2.900 . 4.090 2.602 2.602 2.602 . 0 0 "[ ]" 1
19 1 8 ALA H 1 8 ALA HA 2.610 . 3.530 2.932 2.932 2.932 . 0 0 "[ ]" 1
20 1 8 ALA H 1 82 VAL MG2 3.850 . 6.000 3.219 3.219 3.219 . 0 0 "[ ]" 1
21 1 6 LYS QB 1 8 ALA H 3.490 . 5.280 4.608 4.608 4.608 . 0 0 "[ ]" 1
22 1 8 ALA H 1 8 ALA MB 3.040 . 4.380 2.123 2.123 2.123 . 0 0 "[ ]" 1
23 1 5 TYR HA 1 8 ALA H 2.760 . 3.820 3.311 3.311 3.311 . 0 0 "[ ]" 1
24 1 9 VAL H 1 9 VAL HB 2.350 . 3.000 2.301 2.301 2.301 . 0 0 "[ ]" 1
25 1 5 TYR HA 1 9 VAL H 3.500 . 5.300 4.373 4.373 4.373 . 0 0 "[ ]" 1
26 1 9 VAL H 1 10 GLU H 2.600 . 3.500 2.501 2.501 2.501 . 0 0 "[ ]" 1
27 1 8 ALA H 1 9 VAL H 2.570 . 3.440 2.435 2.435 2.435 . 0 0 "[ ]" 1
28 1 9 VAL H 1 9 VAL HA 2.580 . 3.460 2.921 2.921 2.921 . 0 0 "[ ]" 1
29 1 8 ALA MB 1 9 VAL H 3.310 . 4.910 2.598 2.598 2.598 . 0 0 "[ ]" 1
30 1 6 LYS HA 1 9 VAL H 2.860 . 4.020 3.287 3.287 3.287 . 0 0 "[ ]" 1
31 1 8 ALA HA 1 9 VAL H 2.710 . 3.730 3.548 3.548 3.548 . 0 0 "[ ]" 1
32 1 9 VAL H 1 11 GLN H 3.230 . 4.760 4.037 4.037 4.037 . 0 0 "[ ]" 1
33 1 9 VAL H 1 82 VAL MG2 3.830 . 5.960 2.700 2.700 2.700 . 0 0 "[ ]" 1
34 1 8 ALA MB 1 10 GLU H 3.830 . 5.960 4.534 4.534 4.534 . 0 0 "[ ]" 1
35 1 10 GLU H 1 10 GLU QG 2.850 . 4.000 2.398 2.398 2.398 . 0 0 "[ ]" 1
36 1 6 LYS HA 1 10 GLU H 3.340 . 4.980 3.622 3.622 3.622 . 0 0 "[ ]" 1
37 1 10 GLU H 1 82 VAL MG2 3.850 . 6.000 4.750 4.750 4.750 . 0 0 "[ ]" 1
38 1 9 VAL MG1 1 10 GLU H 3.350 . 5.000 3.472 3.472 3.472 . 0 0 "[ ]" 1
39 1 9 VAL HA 1 10 GLU H 2.910 . 4.120 3.557 3.557 3.557 . 0 0 "[ ]" 1
40 1 8 ALA HA 1 10 GLU H 3.120 . 4.540 4.547 4.547 4.547 0.007 1 0 "[ ]" 1
41 1 10 GLU H 1 11 GLN H 2.670 . 3.650 2.746 2.746 2.746 . 0 0 "[ ]" 1
42 1 11 GLN H 1 11 GLN HA 2.610 . 3.530 2.976 2.976 2.976 . 0 0 "[ ]" 1
43 1 10 GLU HA 1 11 GLN H 2.770 . 3.830 3.448 3.448 3.448 . 0 0 "[ ]" 1
44 1 9 VAL HA 1 11 GLN H 3.120 . 4.540 3.578 3.578 3.578 . 0 0 "[ ]" 1
45 1 8 ALA HA 1 11 GLN H 2.980 . 4.260 4.086 4.086 4.086 . 0 0 "[ ]" 1
46 1 8 ALA MB 1 11 GLN H 3.850 . 6.000 4.859 4.859 4.859 . 0 0 "[ ]" 1
47 1 11 GLN QG 1 12 LEU H 3.500 . 5.300 4.263 4.263 4.263 . 0 0 "[ ]" 1
48 1 10 GLU HA 1 12 LEU H 2.980 . 4.260 4.043 4.043 4.043 . 0 0 "[ ]" 1
49 1 12 LEU H 1 12 LEU HB3 2.750 . 3.810 3.476 3.476 3.476 . 0 0 "[ ]" 1
50 1 12 LEU H 1 12 LEU HA 2.770 . 3.830 2.762 2.762 2.762 . 0 0 "[ ]" 1
51 1 12 LEU H 1 12 LEU HB2 2.500 . 3.290 2.132 2.132 2.132 . 0 0 "[ ]" 1
52 1 9 VAL HA 1 12 LEU H 2.890 . 4.080 3.084 3.084 3.084 . 0 0 "[ ]" 1
53 1 11 GLN HA 1 12 LEU H 2.690 . 3.690 3.424 3.424 3.424 . 0 0 "[ ]" 1
54 1 12 LEU H 1 12 LEU MD1 3.170 . 4.630 3.774 3.774 3.774 . 0 0 "[ ]" 1
55 1 11 GLN HB3 1 12 LEU H 3.100 . 4.500 4.077 4.077 4.077 . 0 0 "[ ]" 1
56 1 12 LEU H 1 13 THR H 3.370 . 5.040 4.702 4.702 4.702 . 0 0 "[ ]" 1
57 1 10 GLU H 1 12 LEU H 3.850 . 6.000 4.152 4.152 4.152 . 0 0 "[ ]" 1
58 1 13 THR H 1 13 THR HA 2.620 . 3.540 2.981 2.981 2.981 . 0 0 "[ ]" 1
59 1 13 THR H 1 16 GLN QB 3.200 . 4.700 2.275 2.275 2.275 . 0 0 "[ ]" 1
60 1 13 THR H 1 16 GLN H 3.100 . 4.500 3.555 3.555 3.555 . 0 0 "[ ]" 1
61 1 13 THR H 1 13 THR HB 2.980 . 4.260 3.513 3.513 3.513 . 0 0 "[ ]" 1
62 1 12 LEU MD2 1 13 THR H 3.090 . 4.480 2.369 2.369 2.369 . 0 0 "[ ]" 1
63 1 12 LEU HA 1 13 THR H 2.340 . 2.980 2.447 2.447 2.447 . 0 0 "[ ]" 1
64 1 13 THR H 1 17 LYS H 3.390 . 5.080 4.316 4.316 4.316 . 0 0 "[ ]" 1
65 1 12 LEU HB2 1 13 THR H 3.020 . 4.330 4.000 4.000 4.000 . 0 0 "[ ]" 1
66 1 12 LEU MD1 1 13 THR H 3.850 . 6.000 4.110 4.110 4.110 . 0 0 "[ ]" 1
67 1 12 LEU HG 1 13 THR H 3.230 . 4.750 4.549 4.549 4.549 . 0 0 "[ ]" 1
68 1 14 GLU H 1 14 GLU QG 3.390 . 5.080 3.900 3.900 3.900 . 0 0 "[ ]" 1
69 1 14 GLU H 1 14 GLU HA 2.880 . 4.050 2.766 2.766 2.766 . 0 0 "[ ]" 1
70 1 14 GLU H 1 15 GLU H 2.790 . 3.870 2.937 2.937 2.937 . 0 0 "[ ]" 1
71 1 13 THR MG 1 14 GLU H 3.470 . 5.240 3.633 3.633 3.633 . 0 0 "[ ]" 1
72 1 13 THR HB 1 14 GLU H 2.470 . 3.240 3.031 3.031 3.031 . 0 0 "[ ]" 1
73 1 13 THR HA 1 14 GLU H 2.370 . 3.040 2.304 2.304 2.304 . 0 0 "[ ]" 1
74 1 14 GLU H 1 14 GLU QB 2.690 . 3.670 2.036 2.036 2.036 . 0 0 "[ ]" 1
75 1 15 GLU H 1 16 GLN H 2.600 . 3.500 2.628 2.628 2.628 . 0 0 "[ ]" 1
76 1 13 THR HB 1 15 GLU H 2.620 . 3.540 2.692 2.692 2.692 . 0 0 "[ ]" 1
77 1 15 GLU H 1 15 GLU HA 2.610 . 3.520 2.872 2.872 2.872 . 0 0 "[ ]" 1
78 1 15 GLU H 1 15 GLU QB 2.780 . 3.860 2.386 2.386 2.386 . 0 0 "[ ]" 1
79 1 14 GLU HA 1 15 GLU H 3.060 . 4.420 3.561 3.561 3.561 . 0 0 "[ ]" 1
80 1 13 THR HG1 1 15 GLU H 3.620 . 5.540 3.793 3.793 3.793 . 0 0 "[ ]" 1
81 1 13 THR HB 1 16 GLN H 2.970 . 4.240 3.576 3.576 3.576 . 0 0 "[ ]" 1
82 1 16 GLN H 1 18 ASN H 3.500 . 5.290 4.008 4.008 4.008 . 0 0 "[ ]" 1
83 1 12 LEU MD1 1 16 GLN H 3.850 . 6.000 5.004 5.004 5.004 . 0 0 "[ ]" 1
84 1 12 LEU MD2 1 16 GLN H 3.850 . 6.000 4.413 4.413 4.413 . 0 0 "[ ]" 1
85 1 16 GLN H 1 17 LYS H 2.540 . 3.380 2.546 2.546 2.546 . 0 0 "[ ]" 1
86 1 13 THR HG1 1 16 GLN H 3.060 . 4.410 3.441 3.441 3.441 . 0 0 "[ ]" 1
87 1 16 GLN H 1 16 GLN HA 2.930 . 4.160 2.947 2.947 2.947 . 0 0 "[ ]" 1
88 1 15 GLU QB 1 16 GLN H 2.710 . 3.710 2.950 2.950 2.950 . 0 0 "[ ]" 1
89 1 17 LYS H 1 17 LYS QB 2.610 . 3.520 2.377 2.377 2.377 . 0 0 "[ ]" 1
90 1 14 GLU HA 1 17 LYS H 2.640 . 3.580 3.581 3.581 3.581 0.001 1 0 "[ ]" 1
91 1 17 LYS H 1 17 LYS HA 2.970 . 4.240 2.833 2.833 2.833 . 0 0 "[ ]" 1
92 1 17 LYS H 1 17 LYS QE 3.650 . 5.590 4.403 4.403 4.403 . 0 0 "[ ]" 1
93 1 14 GLU HA 1 18 ASN H 3.330 . 4.950 3.850 3.850 3.850 . 0 0 "[ ]" 1
94 1 18 ASN H 1 18 ASN HD22 3.850 . 6.000 3.859 3.859 3.859 . 0 0 "[ ]" 1
95 1 18 ASN H 1 21 LYS H 3.850 . 6.000 4.842 4.842 4.842 . 0 0 "[ ]" 1
96 1 18 ASN H 1 19 GLU H 2.610 . 3.530 2.829 2.829 2.829 . 0 0 "[ ]" 1
97 1 17 LYS H 1 18 ASN H 2.600 . 3.500 2.864 2.864 2.864 . 0 0 "[ ]" 1
98 1 18 ASN H 1 18 ASN HB3 2.750 . 3.810 3.496 3.496 3.496 . 0 0 "[ ]" 1
99 1 17 LYS HA 1 18 ASN H 3.250 . 4.800 3.588 3.588 3.588 . 0 0 "[ ]" 1
100 1 17 LYS QB 1 18 ASN H 3.000 . 4.300 2.301 2.301 2.301 . 0 0 "[ ]" 1
101 1 18 ASN H 1 18 ASN HB2 2.670 . 3.650 2.200 2.200 2.200 . 0 0 "[ ]" 1
102 1 18 ASN H 1 18 ASN HA 2.610 . 3.520 2.836 2.836 2.836 . 0 0 "[ ]" 1
103 1 18 ASN H 1 18 ASN HD21 3.570 . 5.440 2.906 2.906 2.906 . 0 0 "[ ]" 1
104 1 16 GLN HA 1 18 ASN H 3.750 . 5.800 4.766 4.766 4.766 . 0 0 "[ ]" 1
105 1 19 GLU H 1 21 LYS H 3.520 . 5.340 4.679 4.679 4.679 . 0 0 "[ ]" 1
106 1 17 LYS HA 1 19 GLU H 3.620 . 5.540 4.633 4.633 4.633 . 0 0 "[ ]" 1
107 1 18 ASN HB2 1 19 GLU H 2.770 . 3.850 2.525 2.525 2.525 . 0 0 "[ ]" 1
108 1 16 GLN HA 1 19 GLU H 2.870 . 4.040 3.737 3.737 3.737 . 0 0 "[ ]" 1
109 1 15 GLU HA 1 19 GLU H 3.600 . 5.500 4.005 4.005 4.005 . 0 0 "[ ]" 1
110 1 19 GLU H 1 19 GLU QG 3.040 . 4.380 3.192 3.192 3.192 . 0 0 "[ ]" 1
111 1 18 ASN HB3 1 19 GLU H 2.860 . 4.020 3.252 3.252 3.252 . 0 0 "[ ]" 1
112 1 18 ASN HA 1 19 GLU H 3.170 . 4.630 3.581 3.581 3.581 . 0 0 "[ ]" 1
113 1 19 GLU H 1 19 GLU HA 2.790 . 3.870 2.878 2.878 2.878 . 0 0 "[ ]" 1
114 1 19 GLU H 1 20 PHE QD 3.850 . 6.000 4.830 4.830 4.830 . 0 0 "[ ]" 1
115 1 17 LYS H 1 19 GLU H 3.260 . 4.820 4.330 4.330 4.330 . 0 0 "[ ]" 1
116 1 19 GLU HA 1 20 PHE H 3.260 . 4.820 3.561 3.561 3.561 . 0 0 "[ ]" 1
117 1 19 GLU H 1 20 PHE H 2.450 . 3.200 2.642 2.642 2.642 . 0 0 "[ ]" 1
118 1 17 LYS HA 1 20 PHE H 2.880 . 4.060 3.516 3.516 3.516 . 0 0 "[ ]" 1
119 1 16 GLN HA 1 20 PHE H 3.100 . 4.500 3.920 3.920 3.920 . 0 0 "[ ]" 1
120 1 20 PHE H 1 21 LYS H 2.500 . 3.290 2.844 2.844 2.844 . 0 0 "[ ]" 1
121 1 20 PHE H 1 20 PHE QB 3.290 . 4.880 2.192 2.192 2.192 . 0 0 "[ ]" 1
122 1 20 PHE H 1 20 PHE HA 2.960 . 4.210 2.906 2.906 2.906 . 0 0 "[ ]" 1
123 1 20 PHE H 1 20 PHE QD 2.910 . 4.120 3.141 3.141 3.141 . 0 0 "[ ]" 1
124 1 19 GLU QB 1 20 PHE H 2.650 . 3.590 2.683 2.683 2.683 . 0 0 "[ ]" 1
125 1 20 PHE H 1 78 LEU MD2 3.850 . 6.000 4.762 4.762 4.762 . 0 0 "[ ]" 1
126 1 21 LYS H 1 21 LYS QD 3.350 . 5.000 2.553 2.553 2.553 . 0 0 "[ ]" 1
127 1 21 LYS H 1 22 ALA H 2.500 . 3.310 2.840 2.840 2.840 . 0 0 "[ ]" 1
128 1 17 LYS HA 1 21 LYS H 3.110 . 4.520 3.201 3.201 3.201 . 0 0 "[ ]" 1
129 1 21 LYS H 1 21 LYS QB 2.950 . 4.200 2.231 2.231 2.231 . 0 0 "[ ]" 1
130 1 20 PHE QB 1 21 LYS H 3.400 . 5.100 2.113 2.113 2.113 . 0 0 "[ ]" 1
131 1 18 ASN HA 1 21 LYS H 3.310 . 4.920 4.208 4.208 4.208 . 0 0 "[ ]" 1
132 1 20 PHE HA 1 21 LYS H 3.020 . 4.340 3.592 3.592 3.592 . 0 0 "[ ]" 1
133 1 21 LYS H 1 22 ALA MB 3.850 . 6.000 4.431 4.431 4.431 . 0 0 "[ ]" 1
134 1 21 LYS H 1 21 LYS QG 3.650 . 5.600 2.611 2.611 2.611 . 0 0 "[ ]" 1
135 1 21 LYS HA 1 22 ALA H 2.980 . 4.260 3.536 3.536 3.536 . 0 0 "[ ]" 1
136 1 21 LYS QD 1 22 ALA H 3.300 . 4.900 4.370 4.370 4.370 . 0 0 "[ ]" 1
137 1 21 LYS QB 1 22 ALA H 2.600 . 3.500 2.689 2.689 2.689 . 0 0 "[ ]" 1
138 1 20 PHE HA 1 22 ALA H 3.410 . 5.120 4.160 4.160 4.160 . 0 0 "[ ]" 1
139 1 22 ALA H 1 23 ALA H 2.360 . 3.020 2.665 2.665 2.665 . 0 0 "[ ]" 1
140 1 22 ALA H 1 22 ALA MB 2.790 . 3.890 2.159 2.159 2.159 . 0 0 "[ ]" 1
141 1 22 ALA H 1 25 ASP H 3.300 . 4.900 4.866 4.866 4.866 . 0 0 "[ ]" 1
142 1 18 ASN HA 1 22 ALA H 2.890 . 4.080 3.839 3.839 3.839 . 0 0 "[ ]" 1
143 1 22 ALA H 1 24 PHE H 3.250 . 4.800 4.227 4.227 4.227 . 0 0 "[ ]" 1
144 1 20 PHE H 1 22 ALA H 2.920 . 4.130 3.785 3.785 3.785 . 0 0 "[ ]" 1
145 1 23 ALA H 1 48 LEU MD2 3.850 . 6.000 4.879 4.879 4.879 . 0 0 "[ ]" 1
146 1 20 PHE HA 1 23 ALA H 3.270 . 4.830 3.533 3.533 3.533 . 0 0 "[ ]" 1
147 1 23 ALA H 1 24 PHE H 2.520 . 3.330 2.996 2.996 2.996 . 0 0 "[ ]" 1
148 1 20 PHE H 1 23 ALA H 3.200 . 4.700 4.553 4.553 4.553 . 0 0 "[ ]" 1
149 1 21 LYS HA 1 23 ALA H 3.460 . 5.220 5.010 5.010 5.010 . 0 0 "[ ]" 1
150 1 21 LYS H 1 23 ALA H 3.360 . 5.020 4.640 4.640 4.640 . 0 0 "[ ]" 1
151 1 22 ALA MB 1 23 ALA H 3.170 . 4.630 2.189 2.189 2.189 . 0 0 "[ ]" 1
152 1 23 ALA H 1 23 ALA HA 2.860 . 4.020 2.789 2.789 2.789 . 0 0 "[ ]" 1
153 1 23 ALA H 1 25 ASP H 3.290 . 4.880 4.449 4.449 4.449 . 0 0 "[ ]" 1
154 1 23 ALA H 1 23 ALA MB 2.540 . 3.370 1.997 1.997 1.997 . 0 0 "[ ]" 1
155 1 23 ALA HA 1 24 PHE H 3.370 . 5.040 3.590 3.590 3.590 . 0 0 "[ ]" 1
156 1 23 ALA MB 1 24 PHE H 2.830 . 3.960 2.422 2.422 2.422 . 0 0 "[ ]" 1
157 1 24 PHE H 1 24 PHE HA 2.650 . 3.590 2.806 2.806 2.806 . 0 0 "[ ]" 1
158 1 20 PHE HA 1 24 PHE H 3.190 . 4.680 3.897 3.897 3.897 . 0 0 "[ ]" 1
159 1 24 PHE H 1 24 PHE QB 2.560 . 3.410 2.140 2.140 2.140 . 0 0 "[ ]" 1
160 1 21 LYS HA 1 24 PHE H 3.110 . 4.520 4.079 4.079 4.079 . 0 0 "[ ]" 1
161 1 24 PHE H 1 25 ASP H 2.620 . 3.540 2.925 2.925 2.925 . 0 0 "[ ]" 1
162 1 21 LYS H 1 24 PHE H 3.390 . 5.080 5.085 5.085 5.085 0.005 1 0 "[ ]" 1
163 1 24 PHE H 1 77 PHE QD 3.850 . 6.000 4.777 4.777 4.777 . 0 0 "[ ]" 1
164 1 24 PHE HA 1 25 ASP H 3.060 . 4.410 3.586 3.586 3.586 . 0 0 "[ ]" 1
165 1 22 ALA MB 1 25 ASP H 3.850 . 6.000 4.647 4.647 4.647 . 0 0 "[ ]" 1
166 1 24 PHE QD 1 25 ASP H 3.220 . 4.740 2.326 2.326 2.326 . 0 0 "[ ]" 1
167 1 25 ASP H 1 25 ASP QB 3.020 . 4.330 1.922 1.922 1.922 . 0 0 "[ ]" 1
168 1 21 LYS HA 1 25 ASP H 3.480 . 5.250 4.457 4.457 4.457 . 0 0 "[ ]" 1
169 1 25 ASP H 1 26 ILE H 2.770 . 3.830 2.641 2.641 2.641 . 0 0 "[ ]" 1
170 1 22 ALA HA 1 25 ASP H 2.980 . 4.260 3.543 3.543 3.543 . 0 0 "[ ]" 1
171 1 25 ASP H 1 25 ASP HA 2.920 . 4.140 2.868 2.868 2.868 . 0 0 "[ ]" 1
172 1 25 ASP H 1 28 VAL MG2 3.850 . 6.000 4.839 4.839 4.839 . 0 0 "[ ]" 1
173 1 24 PHE QB 1 25 ASP H 2.730 . 3.760 2.410 2.410 2.410 . 0 0 "[ ]" 1
174 1 24 PHE QB 1 26 ILE H 3.740 . 5.780 4.314 4.314 4.314 . 0 0 "[ ]" 1
175 1 25 ASP QB 1 26 ILE H 3.450 . 5.200 3.118 3.118 3.118 . 0 0 "[ ]" 1
176 1 23 ALA HA 1 26 ILE H 3.230 . 4.750 3.399 3.399 3.399 . 0 0 "[ ]" 1
177 1 24 PHE H 1 26 ILE H 3.770 . 5.840 3.884 3.884 3.884 . 0 0 "[ ]" 1
178 1 26 ILE H 1 26 ILE MD 3.230 . 4.760 3.325 3.325 3.325 . 0 0 "[ ]" 1
179 1 26 ILE H 1 26 ILE HB 2.420 . 3.130 2.431 2.431 2.431 . 0 0 "[ ]" 1
180 1 26 ILE H 1 27 PHE H 2.560 . 3.420 2.135 2.135 2.135 . 0 0 "[ ]" 1
181 1 26 ILE H 1 26 ILE QG 2.580 . 3.460 2.331 2.331 2.331 . 0 0 "[ ]" 1
182 1 26 ILE H 1 26 ILE MG 3.500 . 5.290 3.762 3.762 3.762 . 0 0 "[ ]" 1
183 1 26 ILE H 1 26 ILE HA 2.790 . 3.880 2.983 2.983 2.983 . 0 0 "[ ]" 1
184 1 25 ASP HA 1 26 ILE H 3.390 . 5.080 3.430 3.430 3.430 . 0 0 "[ ]" 1
185 1 26 ILE H 1 29 LEU H 3.740 . 5.780 5.037 5.037 5.037 . 0 0 "[ ]" 1
186 1 24 PHE QD 1 26 ILE H 3.850 . 6.000 4.391 4.391 4.391 . 0 0 "[ ]" 1
187 1 26 ILE HB 1 27 PHE H 2.770 . 3.830 2.945 2.945 2.945 . 0 0 "[ ]" 1
188 1 26 ILE MG 1 27 PHE H 3.850 . 6.000 3.827 3.827 3.827 . 0 0 "[ ]" 1
189 1 27 PHE H 1 27 PHE HA 2.630 . 3.560 2.980 2.980 2.980 . 0 0 "[ ]" 1
190 1 27 PHE H 1 27 PHE HB2 2.690 . 3.680 2.298 2.298 2.298 . 0 0 "[ ]" 1
191 1 27 PHE H 1 27 PHE HB3 2.890 . 4.080 3.580 3.580 3.580 . 0 0 "[ ]" 1
192 1 26 ILE QG 1 27 PHE H 3.130 . 4.560 4.032 4.032 4.032 . 0 0 "[ ]" 1
193 1 27 PHE HB3 1 28 VAL H 3.240 . 4.780 3.908 3.908 3.908 . 0 0 "[ ]" 1
194 1 27 PHE HB2 1 28 VAL H 3.040 . 4.370 3.003 3.003 3.003 . 0 0 "[ ]" 1
195 1 28 VAL H 1 28 VAL MG1 2.910 . 4.120 3.463 3.463 3.463 . 0 0 "[ ]" 1
196 1 28 VAL H 1 28 VAL HA 2.710 . 3.730 2.912 2.912 2.912 . 0 0 "[ ]" 1
197 1 28 VAL H 1 28 VAL HB 2.670 . 3.640 1.998 1.998 1.998 . 0 0 "[ ]" 1
198 1 28 VAL MG1 1 29 LEU H 3.620 . 5.540 3.338 3.338 3.338 . 0 0 "[ ]" 1
199 1 26 ILE HA 1 29 LEU H 3.750 . 5.790 4.124 4.124 4.124 . 0 0 "[ ]" 1
200 1 28 VAL MG2 1 29 LEU H 3.850 . 6.000 4.329 4.329 4.329 . 0 0 "[ ]" 1
201 1 29 LEU H 1 29 LEU QB 2.810 . 3.920 2.026 2.026 2.026 . 0 0 "[ ]" 1
202 1 29 LEU H 1 30 GLY H 3.380 . 5.050 2.785 2.785 2.785 . 0 0 "[ ]" 1
203 1 29 LEU H 1 29 LEU HA 2.620 . 3.540 2.804 2.804 2.804 . 0 0 "[ ]" 1
204 1 28 VAL HA 1 29 LEU H 2.830 . 3.950 3.408 3.408 3.408 . 0 0 "[ ]" 1
205 1 28 VAL MG2 1 30 GLY H 3.850 . 6.000 5.042 5.042 5.042 . 0 0 "[ ]" 1
206 1 29 LEU QD 1 30 GLY H 3.850 . 6.000 3.867 3.867 3.867 . 0 0 "[ ]" 1
207 1 28 VAL MG1 1 30 GLY H 3.850 . 6.000 4.383 4.383 4.383 . 0 0 "[ ]" 1
208 1 29 LEU HA 1 30 GLY H 2.930 . 4.160 3.524 3.524 3.524 . 0 0 "[ ]" 1
209 1 30 GLY H 1 31 ALA H 3.040 . 4.380 2.342 2.342 2.342 . 0 0 "[ ]" 1
210 1 30 GLY H 1 30 GLY QA 2.290 . 2.880 2.327 2.327 2.327 . 0 0 "[ ]" 1
211 1 29 LEU QB 1 30 GLY H 3.690 . 5.680 2.776 2.776 2.776 . 0 0 "[ ]" 1
212 1 28 VAL MG2 1 31 ALA H 3.450 . 5.200 4.278 4.278 4.278 . 0 0 "[ ]" 1
213 1 29 LEU QB 1 31 ALA H 3.250 . 4.800 4.366 4.366 4.366 . 0 0 "[ ]" 1
214 1 31 ALA H 1 31 ALA HA 2.560 . 3.420 2.920 2.920 2.920 . 0 0 "[ ]" 1
215 1 28 VAL MG1 1 31 ALA H 3.780 . 5.860 3.359 3.359 3.359 . 0 0 "[ ]" 1
216 1 31 ALA H 1 31 ALA MB 2.650 . 3.610 2.016 2.016 2.016 . 0 0 "[ ]" 1
217 1 30 GLY QA 1 31 ALA H 2.870 . 4.040 2.927 2.927 2.927 . 0 0 "[ ]" 1
218 1 31 ALA H 1 40 GLU QG 3.590 . 5.480 4.777 4.777 4.777 . 0 0 "[ ]" 1
219 1 29 LEU HA 1 31 ALA H 3.150 . 4.600 3.855 3.855 3.855 . 0 0 "[ ]" 1
220 1 31 ALA H 1 32 GLU H 3.460 . 5.220 4.416 4.416 4.416 . 0 0 "[ ]" 1
221 1 32 GLU H 1 32 GLU QG 3.580 . 5.460 4.153 4.153 4.153 . 0 0 "[ ]" 1
222 1 28 VAL MG2 1 32 GLU H 3.850 . 6.000 4.946 4.946 4.946 . 0 0 "[ ]" 1
223 1 32 GLU H 1 32 GLU QB 2.760 . 3.820 2.638 2.638 2.638 . 0 0 "[ ]" 1
224 1 31 ALA MB 1 32 GLU H 3.200 . 4.700 2.106 2.106 2.106 . 0 0 "[ ]" 1
225 1 32 GLU H 1 33 ASP H 3.080 . 4.460 1.876 1.876 1.876 . 0 0 "[ ]" 1
226 1 32 GLU H 1 32 GLU HA 2.620 . 3.540 2.978 2.978 2.978 . 0 0 "[ ]" 1
227 1 31 ALA HA 1 32 GLU H 2.340 . 2.980 2.834 2.834 2.834 . 0 0 "[ ]" 1
228 1 31 ALA HA 1 33 ASP H 3.160 . 4.620 4.620 4.620 4.620 0.000 1 0 "[ ]" 1
229 1 33 ASP H 1 35 SER H 3.420 . 5.140 3.378 3.378 3.378 . 0 0 "[ ]" 1
230 1 32 GLU HA 1 33 ASP H 2.960 . 4.210 3.560 3.560 3.560 . 0 0 "[ ]" 1
231 1 33 ASP H 1 33 ASP QB 3.290 . 4.880 2.110 2.110 2.110 . 0 0 "[ ]" 1
232 1 31 ALA MB 1 33 ASP H 3.360 . 5.020 3.297 3.297 3.297 . 0 0 "[ ]" 1
233 1 33 ASP H 1 34 GLY H 3.160 . 4.620 2.424 2.424 2.424 . 0 0 "[ ]" 1
234 1 33 ASP H 1 34 GLY QA 3.800 . 5.900 4.326 4.326 4.326 . 0 0 "[ ]" 1
235 1 32 GLU QB 1 33 ASP H 3.540 . 5.380 2.553 2.553 2.553 . 0 0 "[ ]" 1
236 1 32 GLU QG 1 33 ASP H 3.850 . 6.000 4.121 4.121 4.121 . 0 0 "[ ]" 1
237 1 33 ASP QB 1 34 GLY H 3.850 . 6.000 3.508 3.508 3.508 . 0 0 "[ ]" 1
238 1 34 GLY H 1 35 SER H 3.310 . 4.920 2.466 2.466 2.466 . 0 0 "[ ]" 1
239 1 32 GLU HA 1 34 GLY H 3.850 . 6.000 4.006 4.006 4.006 . 0 0 "[ ]" 1
240 1 31 ALA MB 1 34 GLY H 3.410 . 5.120 2.652 2.652 2.652 . 0 0 "[ ]" 1
241 1 28 VAL MG1 1 34 GLY H 3.850 . 6.000 3.494 3.494 3.494 . 0 0 "[ ]" 1
242 1 28 VAL MG2 1 34 GLY H 3.850 . 6.000 4.353 4.353 4.353 . 0 0 "[ ]" 1
243 1 35 SER H 1 35 SER QB 2.900 . 4.100 3.133 3.133 3.133 . 0 0 "[ ]" 1
244 1 28 VAL MG2 1 35 SER H 3.750 . 5.800 2.913 2.913 2.913 . 0 0 "[ ]" 1
245 1 28 VAL MG1 1 35 SER H 3.450 . 5.200 3.282 3.282 3.282 . 0 0 "[ ]" 1
246 1 35 SER H 1 35 SER HA 2.750 . 3.790 2.964 2.964 2.964 . 0 0 "[ ]" 1
247 1 35 SER H 1 73 ASP HA 3.730 . 5.760 5.567 5.567 5.567 . 0 0 "[ ]" 1
248 1 31 ALA MB 1 35 SER H 3.090 . 4.480 2.405 2.405 2.405 . 0 0 "[ ]" 1
249 1 35 SER H 1 40 GLU QG 3.840 . 5.980 5.341 5.341 5.341 . 0 0 "[ ]" 1
250 1 35 SER H 1 36 ILE H 3.160 . 4.620 4.430 4.430 4.430 . 0 0 "[ ]" 1
251 1 36 ILE H 1 73 ASP HA 3.850 . 6.000 3.101 3.101 3.101 . 0 0 "[ ]" 1
252 1 35 SER QB 1 36 ILE H 3.100 . 4.500 2.570 2.570 2.570 . 0 0 "[ ]" 1
253 1 24 PHE QE 1 36 ILE H 3.850 . 6.000 3.197 3.197 3.197 . 0 0 "[ ]" 1
254 1 35 SER HA 1 36 ILE H 2.720 . 3.740 2.540 2.540 2.540 . 0 0 "[ ]" 1
255 1 36 ILE H 1 72 VAL HB 3.410 . 5.120 3.739 3.739 3.739 . 0 0 "[ ]" 1
256 1 36 ILE H 1 72 VAL H 3.080 . 4.460 3.004 3.004 3.004 . 0 0 "[ ]" 1
257 1 36 ILE H 1 36 ILE HB 2.990 . 4.280 3.618 3.618 3.618 . 0 0 "[ ]" 1
258 1 36 ILE H 1 36 ILE MG 3.540 . 5.380 3.428 3.428 3.428 . 0 0 "[ ]" 1
259 1 36 ILE H 1 36 ILE QG 2.960 . 4.220 1.956 1.956 1.956 . 0 0 "[ ]" 1
260 1 36 ILE H 1 36 ILE MD 3.790 . 5.870 3.701 3.701 3.701 . 0 0 "[ ]" 1
261 1 24 PHE HZ 1 36 ILE H 3.520 . 5.330 5.259 5.259 5.259 . 0 0 "[ ]" 1
262 1 37 SER H 1 37 SER QB 3.230 . 4.760 2.318 2.318 2.318 . 0 0 "[ ]" 1
263 1 36 ILE MG 1 37 SER H 3.350 . 5.000 3.929 3.929 3.929 . 0 0 "[ ]" 1
264 1 36 ILE HB 1 37 SER H 3.290 . 4.870 3.946 3.946 3.946 . 0 0 "[ ]" 1
265 1 36 ILE HA 1 37 SER H 2.650 . 3.610 2.244 2.244 2.244 . 0 0 "[ ]" 1
266 1 38 THR H 1 71 THR HA 2.940 . 4.180 3.671 3.671 3.671 . 0 0 "[ ]" 1
267 1 38 THR H 1 38 THR HA 2.630 . 3.570 2.760 2.760 2.760 . 0 0 "[ ]" 1
268 1 37 SER QB 1 38 THR H 3.190 . 4.680 2.444 2.444 2.444 . 0 0 "[ ]" 1
269 1 38 THR H 1 39 LYS H 2.770 . 3.840 2.888 2.888 2.888 . 0 0 "[ ]" 1
270 1 38 THR H 1 38 THR MG 2.680 . 3.660 1.954 1.954 1.954 . 0 0 "[ ]" 1
271 1 38 THR H 1 61 ILE MD 3.600 . 5.500 2.769 2.769 2.769 . 0 0 "[ ]" 1
272 1 38 THR HA 1 39 LYS H 3.090 . 4.480 3.502 3.502 3.502 . 0 0 "[ ]" 1
273 1 39 LYS H 1 40 GLU H 2.600 . 3.500 2.486 2.486 2.486 . 0 0 "[ ]" 1
274 1 39 LYS H 1 40 GLU QG 3.850 . 6.000 4.118 4.118 4.118 . 0 0 "[ ]" 1
275 1 39 LYS H 1 39 LYS HA 2.610 . 3.530 2.919 2.919 2.919 . 0 0 "[ ]" 1
276 1 39 LYS H 1 40 GLU QB 3.390 . 5.080 4.464 4.464 4.464 . 0 0 "[ ]" 1
277 1 39 LYS HA 1 40 GLU H 3.170 . 4.640 3.549 3.549 3.549 . 0 0 "[ ]" 1
278 1 37 SER QB 1 40 GLU H 3.330 . 4.950 4.047 4.047 4.047 . 0 0 "[ ]" 1
279 1 38 THR HA 1 40 GLU H 3.020 . 4.340 4.355 4.355 4.355 0.015 1 0 "[ ]" 1
280 1 40 GLU H 1 40 GLU HA 2.620 . 3.540 2.975 2.975 2.975 . 0 0 "[ ]" 1
281 1 40 GLU H 1 40 GLU QG 2.900 . 4.100 2.434 2.434 2.434 . 0 0 "[ ]" 1
282 1 39 LYS QB 1 40 GLU H 3.200 . 4.700 2.621 2.621 2.621 . 0 0 "[ ]" 1
283 1 39 LYS QG 1 40 GLU H 3.560 . 5.420 3.791 3.791 3.791 . 0 0 "[ ]" 1
284 1 36 ILE MG 1 40 GLU H 3.470 . 5.240 4.391 4.391 4.391 . 0 0 "[ ]" 1
285 1 37 SER H 1 40 GLU H 3.410 . 5.120 3.084 3.084 3.084 . 0 0 "[ ]" 1
286 1 41 LEU H 1 42 GLY H 3.310 . 4.920 2.557 2.557 2.557 . 0 0 "[ ]" 1
287 1 36 ILE MG 1 41 LEU H 3.850 . 6.000 3.877 3.877 3.877 . 0 0 "[ ]" 1
288 1 40 GLU QB 1 41 LEU H 2.940 . 4.170 2.607 2.607 2.607 . 0 0 "[ ]" 1
289 1 41 LEU H 1 41 LEU MD2 3.440 . 5.170 3.440 3.440 3.440 . 0 0 "[ ]" 1
290 1 38 THR HA 1 41 LEU H 2.920 . 4.140 3.619 3.619 3.619 . 0 0 "[ ]" 1
291 1 40 GLU HA 1 41 LEU H 2.900 . 4.090 3.546 3.546 3.546 . 0 0 "[ ]" 1
292 1 39 LYS QB 1 41 LEU H 3.850 . 6.000 4.601 4.601 4.601 . 0 0 "[ ]" 1
293 1 41 LEU MD1 1 42 GLY H 3.850 . 6.000 4.094 4.094 4.094 . 0 0 "[ ]" 1
294 1 39 LYS QD 1 42 GLY H 3.850 . 6.000 5.299 5.299 5.299 . 0 0 "[ ]" 1
295 1 42 GLY H 1 43 LYS QB 3.850 . 6.000 4.381 4.381 4.381 . 0 0 "[ ]" 1
296 1 41 LEU MD2 1 42 GLY H 3.850 . 6.000 4.610 4.610 4.610 . 0 0 "[ ]" 1
297 1 41 LEU QB 1 42 GLY H 3.850 . 6.000 3.127 3.127 3.127 . 0 0 "[ ]" 1
298 1 42 GLY H 1 43 LYS H 3.060 . 4.420 2.591 2.591 2.591 . 0 0 "[ ]" 1
299 1 42 GLY H 1 44 VAL H 3.670 . 5.630 3.895 3.895 3.895 . 0 0 "[ ]" 1
300 1 39 LYS HA 1 42 GLY H 3.850 . 6.000 4.151 4.151 4.151 . 0 0 "[ ]" 1
301 1 43 LYS H 1 46 ARG H 3.850 . 6.000 5.303 5.303 5.303 . 0 0 "[ ]" 1
302 1 43 LYS H 1 43 LYS QG 3.210 . 4.710 2.648 2.648 2.648 . 0 0 "[ ]" 1
303 1 40 GLU HA 1 43 LYS H 2.970 . 4.240 3.908 3.908 3.908 . 0 0 "[ ]" 1
304 1 43 LYS H 1 45 MET H 3.390 . 5.080 4.121 4.121 4.121 . 0 0 "[ ]" 1
305 1 42 GLY QA 1 43 LYS H 2.650 . 3.590 2.792 2.792 2.792 . 0 0 "[ ]" 1
306 1 43 LYS H 1 43 LYS HA 2.890 . 4.080 2.930 2.930 2.930 . 0 0 "[ ]" 1
307 1 43 LYS H 1 44 VAL H 2.570 . 3.440 2.432 2.432 2.432 . 0 0 "[ ]" 1
308 1 43 LYS H 1 43 LYS QE 3.850 . 6.000 4.832 4.832 4.832 . 0 0 "[ ]" 1
309 1 43 LYS H 1 44 VAL MG2 3.850 . 6.000 3.561 3.561 3.561 . 0 0 "[ ]" 1
310 1 44 VAL H 1 45 MET QB 3.410 . 5.120 4.160 4.160 4.160 . 0 0 "[ ]" 1
311 1 44 VAL H 1 44 VAL MG1 3.180 . 4.660 3.728 3.728 3.728 . 0 0 "[ ]" 1
312 1 44 VAL H 1 44 VAL HA 2.620 . 3.540 2.945 2.945 2.945 . 0 0 "[ ]" 1
313 1 44 VAL H 1 44 VAL HB 2.330 . 2.960 2.428 2.428 2.428 . 0 0 "[ ]" 1
314 1 44 VAL H 1 45 MET H 2.480 . 3.260 2.364 2.364 2.364 . 0 0 "[ ]" 1
315 1 41 LEU HA 1 44 VAL H 3.160 . 4.620 3.142 3.142 3.142 . 0 0 "[ ]" 1
316 1 44 VAL H 1 44 VAL MG2 2.730 . 3.770 2.274 2.274 2.274 . 0 0 "[ ]" 1
317 1 41 LEU MD1 1 44 VAL H 3.850 . 6.000 3.362 3.362 3.362 . 0 0 "[ ]" 1
318 1 43 LYS QB 1 44 VAL H 2.840 . 3.980 2.996 2.996 2.996 . 0 0 "[ ]" 1
319 1 43 LYS HA 1 44 VAL H 2.960 . 4.220 3.456 3.456 3.456 . 0 0 "[ ]" 1
320 1 44 VAL H 1 46 ARG H 3.340 . 4.980 4.315 4.315 4.315 . 0 0 "[ ]" 1
321 1 45 MET H 1 47 MET H 3.200 . 4.700 3.825 3.825 3.825 . 0 0 "[ ]" 1
322 1 44 VAL MG2 1 45 MET H 3.410 . 5.120 3.838 3.838 3.838 . 0 0 "[ ]" 1
323 1 41 LEU MD2 1 45 MET H 3.850 . 6.000 4.680 4.680 4.680 . 0 0 "[ ]" 1
324 1 43 LYS HA 1 45 MET H 3.290 . 4.880 4.216 4.216 4.216 . 0 0 "[ ]" 1
325 1 45 MET H 1 45 MET HA 2.860 . 4.020 2.909 2.909 2.909 . 0 0 "[ ]" 1
326 1 42 GLY H 1 45 MET H 3.500 . 5.300 4.977 4.977 4.977 . 0 0 "[ ]" 1
327 1 45 MET H 1 45 MET QB 2.550 . 3.400 2.149 2.149 2.149 . 0 0 "[ ]" 1
328 1 41 LEU MD1 1 45 MET H 3.850 . 6.000 3.080 3.080 3.080 . 0 0 "[ ]" 1
329 1 45 MET H 1 46 ARG H 2.620 . 3.540 2.650 2.650 2.650 . 0 0 "[ ]" 1
330 1 44 VAL MG1 1 45 MET H 3.640 . 5.580 3.796 3.796 3.796 . 0 0 "[ ]" 1
331 1 42 GLY QA 1 45 MET H 2.830 . 3.970 3.512 3.512 3.512 . 0 0 "[ ]" 1
332 1 45 MET HA 1 46 ARG H 3.020 . 4.340 3.585 3.585 3.585 . 0 0 "[ ]" 1
333 1 42 GLY QA 1 46 ARG H 3.310 . 4.920 4.289 4.289 4.289 . 0 0 "[ ]" 1
334 1 46 ARG H 1 52 PRO QD 3.560 . 5.410 4.410 4.410 4.410 . 0 0 "[ ]" 1
335 1 46 ARG H 1 46 ARG HA 2.620 . 3.540 2.852 2.852 2.852 . 0 0 "[ ]" 1
336 1 45 MET QB 1 46 ARG H 3.130 . 4.560 2.341 2.341 2.341 . 0 0 "[ ]" 1
337 1 43 LYS HA 1 46 ARG H 2.810 . 3.930 3.882 3.882 3.882 . 0 0 "[ ]" 1
338 1 46 ARG H 1 48 LEU H 3.110 . 4.520 4.246 4.246 4.246 . 0 0 "[ ]" 1
339 1 46 ARG H 1 46 ARG QD 3.780 . 5.860 4.508 4.508 4.508 . 0 0 "[ ]" 1
340 1 46 ARG HA 1 47 MET H 2.910 . 4.120 3.522 3.522 3.522 . 0 0 "[ ]" 1
341 1 44 VAL HA 1 47 MET H 2.800 . 3.900 3.658 3.658 3.658 . 0 0 "[ ]" 1
342 1 47 MET H 1 47 MET HA 2.810 . 3.910 2.929 2.929 2.929 . 0 0 "[ ]" 1
343 1 47 MET H 1 48 LEU H 2.510 . 3.320 2.456 2.456 2.456 . 0 0 "[ ]" 1
344 1 45 MET HA 1 47 MET H 3.120 . 4.540 4.171 4.171 4.171 . 0 0 "[ ]" 1
345 1 47 MET H 1 47 MET QG 2.570 . 3.440 2.586 2.586 2.586 . 0 0 "[ ]" 1
346 1 46 ARG QD 1 47 MET H 3.850 . 6.000 4.735 4.735 4.735 . 0 0 "[ ]" 1
347 1 48 LEU H 1 50 GLN H 3.080 . 4.460 4.308 4.308 4.308 . 0 0 "[ ]" 1
348 1 47 MET HA 1 48 LEU H 3.180 . 4.660 3.542 3.542 3.542 . 0 0 "[ ]" 1
349 1 48 LEU H 1 48 LEU HA 2.970 . 4.240 2.915 2.915 2.915 . 0 0 "[ ]" 1
350 1 48 LEU H 1 48 LEU MD1 3.390 . 5.080 3.361 3.361 3.361 . 0 0 "[ ]" 1
351 1 48 LEU H 1 48 LEU MD2 3.850 . 6.000 3.763 3.763 3.763 . 0 0 "[ ]" 1
352 1 45 MET HA 1 48 LEU H 2.980 . 4.260 3.463 3.463 3.463 . 0 0 "[ ]" 1
353 1 48 LEU MD1 1 49 GLY H 3.850 . 6.000 3.825 3.825 3.825 . 0 0 "[ ]" 1
354 1 45 MET HA 1 49 GLY H 3.850 . 6.000 3.697 3.697 3.697 . 0 0 "[ ]" 1
355 1 48 LEU H 1 49 GLY H 3.140 . 4.580 3.123 3.123 3.123 . 0 0 "[ ]" 1
356 1 49 GLY H 1 50 GLN H 2.810 . 3.910 2.464 2.464 2.464 . 0 0 "[ ]" 1
357 1 46 ARG HA 1 49 GLY H 3.350 . 5.000 4.879 4.879 4.879 . 0 0 "[ ]" 1
358 1 49 GLY H 1 49 GLY QA 2.550 . 3.400 2.534 2.534 2.534 . 0 0 "[ ]" 1
359 1 48 LEU MD2 1 49 GLY H 3.850 . 6.000 4.173 4.173 4.173 . 0 0 "[ ]" 1
360 1 50 GLN H 1 50 GLN HA 2.520 . 3.340 2.987 2.987 2.987 . 0 0 "[ ]" 1
361 1 46 ARG HA 1 50 GLN H 2.480 . 3.270 3.269 3.269 3.269 . 0 0 "[ ]" 1
362 1 49 GLY QA 1 50 GLN H 2.710 . 3.710 2.605 2.605 2.605 . 0 0 "[ ]" 1
363 1 50 GLN H 1 50 GLN HB2 2.600 . 3.500 2.633 2.633 2.633 . 0 0 "[ ]" 1
364 1 45 MET HA 1 50 GLN H 3.560 . 5.410 4.258 4.258 4.258 . 0 0 "[ ]" 1
365 1 51 ASN H 1 52 PRO QD 2.850 . 4.000 2.359 2.359 2.359 . 0 0 "[ ]" 1
366 1 51 ASN H 1 51 ASN HB3 2.940 . 4.170 3.113 3.113 3.113 . 0 0 "[ ]" 1
367 1 50 GLN HB2 1 51 ASN H 2.980 . 4.250 4.056 4.056 4.056 . 0 0 "[ ]" 1
368 1 50 GLN H 1 51 ASN H 3.220 . 4.740 4.418 4.418 4.418 . 0 0 "[ ]" 1
369 1 51 ASN H 1 51 ASN HB2 2.920 . 4.140 2.506 2.506 2.506 . 0 0 "[ ]" 1
370 1 51 ASN H 1 51 ASN HA 2.900 . 4.100 3.002 3.002 3.002 . 0 0 "[ ]" 1
371 1 50 GLN HA 1 51 ASN H 2.330 . 2.960 2.302 2.302 2.302 . 0 0 "[ ]" 1
372 1 53 THR H 1 57 LEU MD1 3.850 . 6.000 3.974 3.974 3.974 . 0 0 "[ ]" 1
373 1 53 THR H 1 56 GLU QB 2.460 . 3.210 2.861 2.861 2.861 . 0 0 "[ ]" 1
374 1 53 THR H 1 56 GLU H 2.920 . 4.140 3.980 3.980 3.980 . 0 0 "[ ]" 1
375 1 53 THR H 1 54 PRO QD 3.620 . 5.540 4.360 4.360 4.360 . 0 0 "[ ]" 1
376 1 53 THR H 1 53 THR MG 2.860 . 4.020 3.289 3.289 3.289 . 0 0 "[ ]" 1
377 1 53 THR H 1 53 THR HA 2.620 . 3.540 2.985 2.985 2.985 . 0 0 "[ ]" 1
378 1 53 THR H 1 57 LEU H 3.290 . 4.870 3.786 3.786 3.786 . 0 0 "[ ]" 1
379 1 54 PRO QB 1 55 GLU H 3.050 . 4.400 3.125 3.125 3.125 . 0 0 "[ ]" 1
380 1 54 PRO QD 1 55 GLU H 3.120 . 4.540 2.476 2.476 2.476 . 0 0 "[ ]" 1
381 1 55 GLU H 1 55 GLU QB 2.660 . 3.620 1.943 1.943 1.943 . 0 0 "[ ]" 1
382 1 55 GLU H 1 56 GLU H 2.870 . 4.040 2.654 2.654 2.654 . 0 0 "[ ]" 1
383 1 53 THR HB 1 55 GLU H 2.830 . 3.950 2.524 2.524 2.524 . 0 0 "[ ]" 1
384 1 55 GLU H 1 55 GLU HA 2.890 . 4.080 2.886 2.886 2.886 . 0 0 "[ ]" 1
385 1 55 GLU H 1 57 LEU H 3.380 . 5.060 3.950 3.950 3.950 . 0 0 "[ ]" 1
386 1 54 PRO HA 1 55 GLU H 3.150 . 4.600 3.557 3.557 3.557 . 0 0 "[ ]" 1
387 1 55 GLU H 1 57 LEU MD1 3.850 . 6.000 4.819 4.819 4.819 . 0 0 "[ ]" 1
388 1 53 THR MG 1 55 GLU H 3.850 . 6.000 3.894 3.894 3.894 . 0 0 "[ ]" 1
389 1 53 THR MG 1 56 GLU H 3.850 . 6.000 4.314 4.314 4.314 . 0 0 "[ ]" 1
390 1 56 GLU H 1 57 LEU QB 3.850 . 6.000 4.011 4.011 4.011 . 0 0 "[ ]" 1
391 1 53 THR HA 1 56 GLU H 3.850 . 6.000 4.861 4.861 4.861 . 0 0 "[ ]" 1
392 1 54 PRO HA 1 56 GLU H 3.850 . 6.000 4.627 4.627 4.627 . 0 0 "[ ]" 1
393 1 56 GLU H 1 56 GLU QB 3.100 . 4.500 1.950 1.950 1.950 . 0 0 "[ ]" 1
394 1 56 GLU H 1 57 LEU H 3.350 . 5.000 2.498 2.498 2.498 . 0 0 "[ ]" 1
395 1 55 GLU QB 1 56 GLU H 3.160 . 4.620 2.596 2.596 2.596 . 0 0 "[ ]" 1
396 1 53 THR HB 1 57 LEU H 3.850 . 6.000 4.208 4.208 4.208 . 0 0 "[ ]" 1
397 1 54 PRO HA 1 57 LEU H 3.480 . 5.260 3.590 3.590 3.590 . 0 0 "[ ]" 1
398 1 57 LEU H 1 58 GLN H 2.670 . 3.640 3.196 3.196 3.196 . 0 0 "[ ]" 1
399 1 58 GLN H 1 59 GLU H 2.580 . 3.460 2.893 2.893 2.893 . 0 0 "[ ]" 1
400 1 55 GLU H 1 58 GLN H 3.670 . 5.630 5.458 5.458 5.458 . 0 0 "[ ]" 1
401 1 57 LEU QD 1 58 GLN H 3.400 . 5.090 3.567 3.567 3.567 . 0 0 "[ ]" 1
402 1 57 LEU QB 1 58 GLN H 2.840 . 3.980 2.173 2.173 2.173 . 0 0 "[ ]" 1
403 1 54 PRO HA 1 58 GLN H 3.500 . 5.300 4.255 4.255 4.255 . 0 0 "[ ]" 1
404 1 58 GLN H 1 58 GLN HA 2.830 . 3.970 2.783 2.783 2.783 . 0 0 "[ ]" 1
405 1 38 THR MG 1 58 GLN H 3.850 . 6.000 4.494 4.494 4.494 . 0 0 "[ ]" 1
406 1 58 GLN HA 1 59 GLU H 3.360 . 5.020 3.558 3.558 3.558 . 0 0 "[ ]" 1
407 1 59 GLU H 1 59 GLU HA 2.610 . 3.530 2.885 2.885 2.885 . 0 0 "[ ]" 1
408 1 57 LEU H 1 59 GLU H 3.730 . 5.760 4.165 4.165 4.165 . 0 0 "[ ]" 1
409 1 60 MET H 1 60 MET QG 3.410 . 5.120 2.879 2.879 2.879 . 0 0 "[ ]" 1
410 1 60 MET H 1 61 ILE H 2.930 . 4.160 2.952 2.952 2.952 . 0 0 "[ ]" 1
411 1 60 MET H 1 63 GLU H 3.850 . 6.000 4.900 4.900 4.900 . 0 0 "[ ]" 1
412 1 61 ILE H 1 63 GLU H 3.160 . 4.620 3.939 3.939 3.939 . 0 0 "[ ]" 1
413 1 60 MET QB 1 61 ILE H 2.780 . 3.860 2.449 2.449 2.449 . 0 0 "[ ]" 1
414 1 61 ILE H 1 61 ILE QG 2.940 . 4.180 2.937 2.937 2.937 . 0 0 "[ ]" 1
415 1 61 ILE H 1 61 ILE HB 2.390 . 3.080 2.151 2.151 2.151 . 0 0 "[ ]" 1
416 1 60 MET HA 1 61 ILE H 3.000 . 4.300 3.594 3.594 3.594 . 0 0 "[ ]" 1
417 1 61 ILE H 1 61 ILE HA 2.640 . 3.580 2.876 2.876 2.876 . 0 0 "[ ]" 1
418 1 58 GLN HA 1 61 ILE H 3.120 . 4.540 3.892 3.892 3.892 . 0 0 "[ ]" 1
419 1 62 ASP H 1 62 ASP HA 2.630 . 3.560 2.757 2.757 2.757 . 0 0 "[ ]" 1
420 1 58 GLN HA 1 62 ASP H 3.280 . 4.860 3.998 3.998 3.998 . 0 0 "[ ]" 1
421 1 61 ILE MG 1 62 ASP H 3.070 . 4.440 2.544 2.544 2.544 . 0 0 "[ ]" 1
422 1 61 ILE HA 1 62 ASP H 3.210 . 4.710 3.591 3.591 3.591 . 0 0 "[ ]" 1
423 1 59 GLU HA 1 62 ASP H 2.950 . 4.200 3.832 3.832 3.832 . 0 0 "[ ]" 1
424 1 62 ASP H 1 63 GLU H 2.710 . 3.710 2.906 2.906 2.906 . 0 0 "[ ]" 1
425 1 62 ASP H 1 62 ASP QB 2.580 . 3.470 2.194 2.194 2.194 . 0 0 "[ ]" 1
426 1 63 GLU H 1 65 ASP H 3.180 . 4.660 3.530 3.530 3.530 . 0 0 "[ ]" 1
427 1 62 ASP HA 1 63 GLU H 2.980 . 4.260 3.513 3.513 3.513 . 0 0 "[ ]" 1
428 1 63 GLU H 1 63 GLU HA 2.610 . 3.530 2.944 2.944 2.944 . 0 0 "[ ]" 1
429 1 59 GLU HA 1 63 GLU H 3.290 . 4.880 4.171 4.171 4.171 . 0 0 "[ ]" 1
430 1 62 ASP QB 1 63 GLU H 2.920 . 4.140 2.801 2.801 2.801 . 0 0 "[ ]" 1
431 1 60 MET HA 1 63 GLU H 2.950 . 4.200 3.961 3.961 3.961 . 0 0 "[ ]" 1
432 1 63 GLU H 1 63 GLU QG 2.960 . 4.220 3.246 3.246 3.246 . 0 0 "[ ]" 1
433 1 61 ILE HB 1 63 GLU H 3.690 . 5.680 4.649 4.649 4.649 . 0 0 "[ ]" 1
434 1 63 GLU H 1 64 VAL MG2 3.710 . 5.710 3.635 3.635 3.635 . 0 0 "[ ]" 1
435 1 61 ILE HA 1 63 GLU H 3.500 . 5.300 3.822 3.822 3.822 . 0 0 "[ ]" 1
436 1 64 VAL H 1 64 VAL HB 3.480 . 5.260 3.562 3.562 3.562 . 0 0 "[ ]" 1
437 1 64 VAL H 1 65 ASP H 3.850 . 6.000 2.393 2.393 2.393 . 0 0 "[ ]" 1
438 1 64 VAL H 1 64 VAL QG 3.850 . 6.000 1.825 1.825 1.825 . 0 0 "[ ]" 1
439 1 65 ASP H 1 65 ASP HA 2.650 . 3.600 2.870 2.870 2.870 . 0 0 "[ ]" 1
440 1 65 ASP H 1 65 ASP HB2 2.540 . 3.390 2.112 2.112 2.112 . 0 0 "[ ]" 1
441 1 64 VAL MG2 1 65 ASP H 3.400 . 5.090 1.872 1.872 1.872 . 0 0 "[ ]" 1
442 1 61 ILE HA 1 65 ASP H 3.050 . 4.400 3.238 3.238 3.238 . 0 0 "[ ]" 1
443 1 65 ASP H 1 65 ASP HB3 2.440 . 3.190 2.797 2.797 2.797 . 0 0 "[ ]" 1
444 1 66 GLU H 1 68 GLY H 3.310 . 4.910 3.937 3.937 3.937 . 0 0 "[ ]" 1
445 1 66 GLU H 1 66 GLU HA 2.620 . 3.540 2.904 2.904 2.904 . 0 0 "[ ]" 1
446 1 65 ASP H 1 66 GLU H 3.190 . 4.670 4.604 4.604 4.604 . 0 0 "[ ]" 1
447 1 66 GLU H 1 66 GLU QB 2.870 . 4.040 2.418 2.418 2.418 . 0 0 "[ ]" 1
448 1 64 VAL MG2 1 66 GLU H 3.850 . 6.000 4.991 4.991 4.991 . 0 0 "[ ]" 1
449 1 65 ASP HA 1 66 GLU H 2.380 . 3.050 2.219 2.219 2.219 . 0 0 "[ ]" 1
450 1 66 GLU H 1 67 ASP H 2.530 . 3.360 2.580 2.580 2.580 . 0 0 "[ ]" 1
451 1 65 ASP HB3 1 66 GLU H 3.230 . 4.760 3.985 3.985 3.985 . 0 0 "[ ]" 1
452 1 66 GLU H 1 66 GLU QG 2.770 . 3.840 1.858 1.858 1.858 . 0 0 "[ ]" 1
453 1 67 ASP H 1 70 GLY H 3.770 . 5.840 5.799 5.799 5.799 . 0 0 "[ ]" 1
454 1 66 GLU QB 1 67 ASP H 3.190 . 4.670 3.752 3.752 3.752 . 0 0 "[ ]" 1
455 1 67 ASP H 1 69 SER H 3.080 . 4.460 4.291 4.291 4.291 . 0 0 "[ ]" 1
456 1 67 ASP H 1 67 ASP HB2 2.790 . 3.880 3.760 3.760 3.760 . 0 0 "[ ]" 1
457 1 66 GLU HA 1 67 ASP H 2.730 . 3.760 3.387 3.387 3.387 . 0 0 "[ ]" 1
458 1 67 ASP H 1 67 ASP HA 2.710 . 3.710 3.002 3.002 3.002 . 0 0 "[ ]" 1
459 1 65 ASP HA 1 67 ASP H 2.900 . 4.100 3.576 3.576 3.576 . 0 0 "[ ]" 1
460 1 67 ASP H 1 67 ASP HB3 2.910 . 4.120 2.892 2.892 2.892 . 0 0 "[ ]" 1
461 1 67 ASP H 1 68 GLY QA 3.450 . 5.200 3.888 3.888 3.888 . 0 0 "[ ]" 1
462 1 67 ASP H 1 68 GLY H 2.460 . 3.230 1.873 1.873 1.873 . 0 0 "[ ]" 1
463 1 66 GLU QG 1 67 ASP H 3.370 . 5.040 2.634 2.634 2.634 . 0 0 "[ ]" 1
464 1 65 ASP HB2 1 68 GLY H 3.850 . 6.000 3.632 3.632 3.632 . 0 0 "[ ]" 1
465 1 68 GLY H 1 70 GLY H 3.540 . 5.380 4.752 4.752 4.752 . 0 0 "[ ]" 1
466 1 66 GLU HA 1 68 GLY H 3.070 . 4.440 4.345 4.345 4.345 . 0 0 "[ ]" 1
467 1 65 ASP HA 1 68 GLY H 3.600 . 5.500 4.022 4.022 4.022 . 0 0 "[ ]" 1
468 1 66 GLU QB 1 68 GLY H 3.850 . 6.000 5.148 5.148 5.148 . 0 0 "[ ]" 1
469 1 68 GLY H 1 69 SER H 2.710 . 3.720 3.098 3.098 3.098 . 0 0 "[ ]" 1
470 1 67 ASP HA 1 68 GLY H 2.950 . 4.200 3.402 3.402 3.402 . 0 0 "[ ]" 1
471 1 67 ASP HB3 1 68 GLY H 3.750 . 5.790 4.131 4.131 4.131 . 0 0 "[ ]" 1
472 1 67 ASP HB2 1 68 GLY H 3.780 . 5.860 4.248 4.248 4.248 . 0 0 "[ ]" 1
473 1 65 ASP HB3 1 68 GLY H 3.590 . 5.480 1.950 1.950 1.950 . 0 0 "[ ]" 1
474 1 65 ASP HA 1 69 SER H 3.850 . 6.000 5.175 5.175 5.175 . 0 0 "[ ]" 1
475 1 65 ASP HB3 1 69 SER H 3.580 . 5.460 3.003 3.003 3.003 . 0 0 "[ ]" 1
476 1 69 SER H 1 70 GLY H 2.950 . 4.200 1.867 1.867 1.867 . 0 0 "[ ]" 1
477 1 69 SER H 1 69 SER QB 3.350 . 5.000 3.019 3.019 3.019 . 0 0 "[ ]" 1
478 1 69 SER H 1 69 SER HA 2.890 . 4.080 3.002 3.002 3.002 . 0 0 "[ ]" 1
479 1 69 SER H 1 71 THR MG 3.850 . 6.000 4.952 4.952 4.952 . 0 0 "[ ]" 1
480 1 69 SER H 1 70 GLY QA 3.780 . 5.860 3.900 3.900 3.900 . 0 0 "[ ]" 1
481 1 65 ASP HB2 1 69 SER H 3.850 . 6.000 3.559 3.559 3.559 . 0 0 "[ ]" 1
482 1 61 ILE MG 1 70 GLY H 3.850 . 6.000 2.118 2.118 2.118 . 0 0 "[ ]" 1
483 1 38 THR MG 1 70 GLY H 3.850 . 6.000 5.011 5.011 5.011 . 0 0 "[ ]" 1
484 1 70 GLY H 1 71 THR H 2.770 . 3.850 2.309 2.309 2.309 . 0 0 "[ ]" 1
485 1 70 GLY H 1 70 GLY QA 2.490 . 3.280 2.339 2.339 2.339 . 0 0 "[ ]" 1
486 1 69 SER H 1 71 THR H 3.120 . 4.540 3.579 3.579 3.579 . 0 0 "[ ]" 1
487 1 71 THR H 1 71 THR MG 2.970 . 4.240 2.409 2.409 2.409 . 0 0 "[ ]" 1
488 1 70 GLY QA 1 71 THR H 2.690 . 3.670 2.935 2.935 2.935 . 0 0 "[ ]" 1
489 1 71 THR H 1 71 THR HB 3.360 . 5.020 3.567 3.567 3.567 . 0 0 "[ ]" 1
490 1 37 SER HA 1 72 VAL H 2.790 . 3.880 2.581 2.581 2.581 . 0 0 "[ ]" 1
491 1 71 THR HB 1 72 VAL H 2.610 . 3.530 2.825 2.825 2.825 . 0 0 "[ ]" 1
492 1 71 THR MG 1 72 VAL H 3.290 . 4.880 3.869 3.869 3.869 . 0 0 "[ ]" 1
493 1 72 VAL H 1 72 VAL MG2 3.230 . 4.760 3.108 3.108 3.108 . 0 0 "[ ]" 1
494 1 35 SER QB 1 72 VAL H 3.140 . 4.580 3.203 3.203 3.203 . 0 0 "[ ]" 1
495 1 72 VAL H 1 72 VAL MG1 3.560 . 5.420 3.827 3.827 3.827 . 0 0 "[ ]" 1
496 1 72 VAL H 1 72 VAL HB 2.440 . 3.170 2.676 2.676 2.676 . 0 0 "[ ]" 1
497 1 72 VAL H 1 72 VAL HA 2.690 . 3.680 2.973 2.973 2.973 . 0 0 "[ ]" 1
498 1 71 THR HA 1 72 VAL H 2.600 . 3.500 2.352 2.352 2.352 . 0 0 "[ ]" 1
499 1 72 VAL H 1 73 ASP H 3.850 . 6.000 4.157 4.157 4.157 . 0 0 "[ ]" 1
500 1 72 VAL HA 1 73 ASP H 2.540 . 3.380 2.215 2.215 2.215 . 0 0 "[ ]" 1
501 1 72 VAL MG2 1 73 ASP H 3.850 . 6.000 4.001 4.001 4.001 . 0 0 "[ ]" 1
502 1 73 ASP H 1 73 ASP QB 3.440 . 5.180 2.817 2.817 2.817 . 0 0 "[ ]" 1
503 1 73 ASP H 1 76 GLU QG 3.850 . 6.000 2.097 2.097 2.097 . 0 0 "[ ]" 1
504 1 73 ASP H 1 76 GLU HB2 3.460 . 5.210 1.954 1.954 1.954 . 0 0 "[ ]" 1
505 1 73 ASP H 1 76 GLU HB3 3.400 . 5.100 3.510 3.510 3.510 . 0 0 "[ ]" 1
506 1 73 ASP H 1 76 GLU H 3.850 . 6.000 2.815 2.815 2.815 . 0 0 "[ ]" 1
507 1 73 ASP H 1 75 ASP QB 3.850 . 6.000 4.196 4.196 4.196 . 0 0 "[ ]" 1
508 1 72 VAL HB 1 73 ASP H 3.850 . 6.000 4.397 4.397 4.397 . 0 0 "[ ]" 1
509 1 72 VAL MG1 1 73 ASP H 3.310 . 4.920 2.691 2.691 2.691 . 0 0 "[ ]" 1
510 1 35 SER HA 1 73 ASP H 3.850 . 6.000 5.348 5.348 5.348 . 0 0 "[ ]" 1
511 1 24 PHE HZ 1 74 PHE H 2.920 . 4.130 4.051 4.051 4.051 . 0 0 "[ ]" 1
512 1 74 PHE H 1 76 GLU H 3.600 . 5.500 4.973 4.973 4.973 . 0 0 "[ ]" 1
513 1 74 PHE H 1 75 ASP H 2.730 . 3.750 2.812 2.812 2.812 . 0 0 "[ ]" 1
514 1 35 SER HA 1 74 PHE H 3.290 . 4.880 4.626 4.626 4.626 . 0 0 "[ ]" 1
515 1 74 PHE H 1 74 PHE QD 3.330 . 4.960 4.123 4.123 4.123 . 0 0 "[ ]" 1
516 1 74 PHE H 1 74 PHE HB2 2.570 . 3.440 2.607 2.607 2.607 . 0 0 "[ ]" 1
517 1 73 ASP QB 1 74 PHE H 2.620 . 3.540 1.932 1.932 1.932 . 0 0 "[ ]" 1
518 1 74 PHE H 1 74 PHE HA 2.580 . 3.470 2.800 2.800 2.800 . 0 0 "[ ]" 1
519 1 73 ASP HA 1 74 PHE H 2.590 . 3.480 2.780 2.780 2.780 . 0 0 "[ ]" 1
520 1 73 ASP HA 1 75 ASP H 3.850 . 6.000 4.353 4.353 4.353 . 0 0 "[ ]" 1
521 1 74 PHE QD 1 75 ASP H 3.850 . 6.000 3.960 3.960 3.960 . 0 0 "[ ]" 1
522 1 72 VAL MG1 1 75 ASP H 3.850 . 6.000 4.749 4.749 4.749 . 0 0 "[ ]" 1
523 1 76 GLU H 1 76 GLU HA 2.960 . 4.220 2.780 2.780 2.780 . 0 0 "[ ]" 1
524 1 76 GLU H 1 77 PHE H 2.600 . 3.500 2.860 2.860 2.860 . 0 0 "[ ]" 1
525 1 76 GLU H 1 76 GLU QG 2.800 . 3.900 1.883 1.883 1.883 . 0 0 "[ ]" 1
526 1 75 ASP QB 1 76 GLU H 3.080 . 4.460 1.968 1.968 1.968 . 0 0 "[ ]" 1
527 1 72 VAL MG1 1 76 GLU H 3.330 . 4.950 3.663 3.663 3.663 . 0 0 "[ ]" 1
528 1 76 GLU H 1 77 PHE QB 3.800 . 5.900 4.514 4.514 4.514 . 0 0 "[ ]" 1
529 1 76 GLU H 1 76 GLU HB3 2.750 . 3.810 3.524 3.524 3.524 . 0 0 "[ ]" 1
530 1 76 GLU H 1 79 VAL HB 3.230 . 4.760 4.776 4.776 4.776 0.016 1 0 "[ ]" 1
531 1 73 ASP QB 1 76 GLU H 3.620 . 5.540 4.289 4.289 4.289 . 0 0 "[ ]" 1
532 1 72 VAL MG2 1 76 GLU H 3.850 . 6.000 4.965 4.965 4.965 . 0 0 "[ ]" 1
533 1 75 ASP H 1 77 PHE H 3.060 . 4.420 3.623 3.623 3.623 . 0 0 "[ ]" 1
534 1 76 GLU QG 1 77 PHE H 3.040 . 4.370 3.886 3.886 3.886 . 0 0 "[ ]" 1
535 1 77 PHE H 1 78 LEU H 2.690 . 3.670 2.943 2.943 2.943 . 0 0 "[ ]" 1
536 1 72 VAL MG1 1 77 PHE H 2.950 . 4.200 2.322 2.322 2.322 . 0 0 "[ ]" 1
537 1 77 PHE H 1 77 PHE QD 3.400 . 5.090 4.069 4.069 4.069 . 0 0 "[ ]" 1
538 1 75 ASP HA 1 78 LEU H 2.810 . 3.930 3.791 3.791 3.791 . 0 0 "[ ]" 1
539 1 77 PHE QD 1 78 LEU H 3.060 . 4.420 3.439 3.439 3.439 . 0 0 "[ ]" 1
540 1 78 LEU H 1 79 VAL H 2.640 . 3.580 2.735 2.735 2.735 . 0 0 "[ ]" 1
541 1 77 PHE HA 1 78 LEU H 3.330 . 4.960 3.589 3.589 3.589 . 0 0 "[ ]" 1
542 1 77 PHE QB 1 78 LEU H 3.080 . 4.460 1.961 1.961 1.961 . 0 0 "[ ]" 1
543 1 78 LEU H 1 78 LEU HB2 2.620 . 3.540 2.545 2.545 2.545 . 0 0 "[ ]" 1
544 1 77 PHE QB 1 79 VAL H 3.850 . 6.000 4.068 4.068 4.068 . 0 0 "[ ]" 1
545 1 77 PHE HA 1 79 VAL H 3.350 . 5.000 3.867 3.867 3.867 . 0 0 "[ ]" 1
546 1 77 PHE H 1 79 VAL H 3.700 . 5.700 3.687 3.687 3.687 . 0 0 "[ ]" 1
547 1 79 VAL H 1 80 MET H 2.580 . 3.470 2.349 2.349 2.349 . 0 0 "[ ]" 1
548 1 75 ASP HA 1 79 VAL H 3.660 . 5.620 4.546 4.546 4.546 . 0 0 "[ ]" 1
549 1 79 VAL H 1 79 VAL MG1 3.170 . 4.640 3.713 3.713 3.713 . 0 0 "[ ]" 1
550 1 79 VAL H 1 79 VAL HA 2.500 . 3.310 2.942 2.942 2.942 . 0 0 "[ ]" 1
551 1 79 VAL H 1 79 VAL MG2 2.560 . 3.420 2.164 2.164 2.164 . 0 0 "[ ]" 1
552 1 76 GLU HA 1 79 VAL H 3.400 . 5.090 3.572 3.572 3.572 . 0 0 "[ ]" 1
553 1 79 VAL H 1 79 VAL HB 2.440 . 3.170 2.344 2.344 2.344 . 0 0 "[ ]" 1
554 1 78 LEU HB2 1 79 VAL H 2.940 . 4.180 3.022 3.022 3.022 . 0 0 "[ ]" 1
555 1 78 LEU HA 1 79 VAL H 2.980 . 4.250 3.458 3.458 3.458 . 0 0 "[ ]" 1
556 1 78 LEU HA 1 80 MET H 3.540 . 5.370 4.052 4.052 4.052 . 0 0 "[ ]" 1
557 1 79 VAL HA 1 80 MET H 2.910 . 4.120 3.483 3.483 3.483 . 0 0 "[ ]" 1
558 1 77 PHE HA 1 80 MET H 3.200 . 4.700 3.346 3.346 3.346 . 0 0 "[ ]" 1
559 1 79 VAL MG1 1 80 MET H 3.250 . 4.790 3.725 3.725 3.725 . 0 0 "[ ]" 1
560 1 80 MET H 1 80 MET QG 3.280 . 4.860 3.707 3.707 3.707 . 0 0 "[ ]" 1
561 1 80 MET H 1 81 MET H 2.670 . 3.640 2.551 2.551 2.551 . 0 0 "[ ]" 1
562 1 80 MET H 1 80 MET HA 2.600 . 3.500 2.913 2.913 2.913 . 0 0 "[ ]" 1
563 1 79 VAL H 1 81 MET H 3.400 . 5.090 4.005 4.005 4.005 . 0 0 "[ ]" 1
564 1 81 MET H 1 81 MET QG 2.570 . 3.440 1.766 1.766 1.766 . 0 0 "[ ]" 1
565 1 81 MET H 1 81 MET ME 3.640 . 5.580 3.925 3.925 3.925 . 0 0 "[ ]" 1
566 1 78 LEU HA 1 81 MET H 2.760 . 3.820 3.840 3.840 3.840 0.020 1 0 "[ ]" 1
567 1 80 MET QB 1 81 MET H 2.810 . 3.920 3.196 3.196 3.196 . 0 0 "[ ]" 1
568 1 81 MET H 1 81 MET HA 2.620 . 3.540 2.990 2.990 2.990 . 0 0 "[ ]" 1
569 1 80 MET HA 1 81 MET H 2.970 . 4.240 3.401 3.401 3.401 . 0 0 "[ ]" 1
570 1 82 VAL H 1 82 VAL HA 2.610 . 3.530 2.910 2.910 2.910 . 0 0 "[ ]" 1
571 1 82 VAL H 1 82 VAL HB 2.630 . 3.560 2.184 2.184 2.184 . 0 0 "[ ]" 1
572 1 79 VAL HA 1 82 VAL H 3.040 . 4.370 3.245 3.245 3.245 . 0 0 "[ ]" 1
573 1 79 VAL HA 1 83 ARG H 3.250 . 4.800 4.775 4.775 4.775 . 0 0 "[ ]" 1
574 1 80 MET HA 1 83 ARG H 2.980 . 4.260 3.961 3.961 3.961 . 0 0 "[ ]" 1
575 1 83 ARG H 1 83 ARG HA 2.620 . 3.540 2.961 2.961 2.961 . 0 0 "[ ]" 1
576 1 82 VAL MG1 1 83 ARG H 3.560 . 5.410 3.380 3.380 3.380 . 0 0 "[ ]" 1
577 1 83 ARG H 1 83 ARG QB 2.650 . 3.600 2.055 2.055 2.055 . 0 0 "[ ]" 1
578 1 79 VAL MG1 1 83 ARG H 3.850 . 6.000 4.467 4.467 4.467 . 0 0 "[ ]" 1
579 1 5 TYR QD 1 83 ARG H 3.850 . 6.000 4.258 4.258 4.258 . 0 0 "[ ]" 1
580 1 82 VAL HA 1 83 ARG H 2.680 . 3.660 3.525 3.525 3.525 . 0 0 "[ ]" 1
581 1 83 ARG QG 1 84 SER H 3.520 . 5.330 4.495 4.495 4.495 . 0 0 "[ ]" 1
582 1 84 SER H 1 84 SER QB 2.960 . 4.210 2.241 2.241 2.241 . 0 0 "[ ]" 1
583 1 84 SER H 1 85 MET QG 3.290 . 4.880 4.140 4.140 4.140 . 0 0 "[ ]" 1
584 1 83 ARG H 1 84 SER H 2.580 . 3.460 2.267 2.267 2.267 . 0 0 "[ ]" 1
585 1 82 VAL HA 1 84 SER H 3.000 . 4.300 4.295 4.295 4.295 . 0 0 "[ ]" 1
586 1 84 SER H 1 84 SER HA 2.880 . 4.060 2.966 2.966 2.966 . 0 0 "[ ]" 1
587 1 83 ARG QB 1 84 SER H 2.950 . 4.200 2.973 2.973 2.973 . 0 0 "[ ]" 1
588 1 81 MET HA 1 84 SER H 2.870 . 4.040 3.099 3.099 3.099 . 0 0 "[ ]" 1
589 1 80 MET HA 1 84 SER H 3.270 . 4.830 4.764 4.764 4.764 . 0 0 "[ ]" 1
590 1 60 MET ME 1 84 SER H 3.850 . 6.000 4.681 4.681 4.681 . 0 0 "[ ]" 1
591 1 83 ARG H 1 85 MET H 3.840 . 5.980 3.792 3.792 3.792 . 0 0 "[ ]" 1
592 1 85 MET H 1 85 MET QB 2.890 . 4.080 2.174 2.174 2.174 . 0 0 "[ ]" 1
593 1 81 MET HA 1 85 MET H 3.720 . 5.740 4.110 4.110 4.110 . 0 0 "[ ]" 1
594 1 85 MET H 1 85 MET QG 2.890 . 4.080 3.053 3.053 3.053 . 0 0 "[ ]" 1
595 1 85 MET H 1 86 LYS H 3.150 . 4.590 2.539 2.539 2.539 . 0 0 "[ ]" 1
596 1 86 LYS H 1 86 LYS QD 3.850 . 6.000 3.718 3.718 3.718 . 0 0 "[ ]" 1
597 1 83 ARG HA 1 86 LYS H 3.850 . 6.000 4.373 4.373 4.373 . 0 0 "[ ]" 1
598 1 85 MET QB 1 86 LYS H 3.730 . 5.750 2.183 2.183 2.183 . 0 0 "[ ]" 1
599 1 86 LYS H 1 87 ASP H 3.660 . 5.620 4.416 4.416 4.416 . 0 0 "[ ]" 1
600 1 86 LYS H 1 86 LYS QG 3.730 . 5.750 2.053 2.053 2.053 . 0 0 "[ ]" 1
601 1 87 ASP H 1 87 ASP QB 3.440 . 5.180 2.914 2.914 2.914 . 0 0 "[ ]" 1
602 1 86 LYS QB 1 87 ASP H 3.770 . 5.840 2.256 2.256 2.256 . 0 0 "[ ]" 1
603 1 86 LYS QG 1 87 ASP H 3.850 . 6.000 2.727 2.727 2.727 . 0 0 "[ ]" 1
604 1 86 LYS HA 1 87 ASP H 2.880 . 4.060 2.665 2.665 2.665 . 0 0 "[ ]" 1
605 1 86 LYS QD 1 87 ASP H 3.850 . 6.000 4.337 4.337 4.337 . 0 0 "[ ]" 1
606 1 86 LYS QE 1 87 ASP H 3.850 . 6.000 3.985 3.985 3.985 . 0 0 "[ ]" 1
607 1 86 LYS HA 1 88 ASP H 3.850 . 6.000 5.657 5.657 5.657 . 0 0 "[ ]" 1
608 1 88 ASP H 1 88 ASP QB 3.440 . 5.180 2.850 2.850 2.850 . 0 0 "[ ]" 1
609 1 89 SER H 1 89 SER QB 3.220 . 4.740 2.885 2.885 2.885 . 0 0 "[ ]" 1
610 1 89 SER H 1 89 SER HA 2.890 . 4.080 2.876 2.876 2.876 . 0 0 "[ ]" 1
611 1 88 ASP QB 1 89 SER H 3.140 . 4.580 3.959 3.959 3.959 . 0 0 "[ ]" 1
612 1 86 LYS HA 1 89 SER H 3.540 . 5.380 5.077 5.077 5.077 . 0 0 "[ ]" 1
613 1 22 ALA HA 1 22 ALA MB 2.420 . 3.130 2.156 2.156 2.156 . 0 0 "[ ]" 1
614 1 22 ALA HA 1 25 ASP QB 3.120 . 4.540 2.736 2.736 2.736 . 0 0 "[ ]" 1
615 1 23 ALA HA 1 26 ILE MD 3.200 . 4.700 2.010 2.010 2.010 . 0 0 "[ ]" 1
616 1 23 ALA HA 1 23 ALA MB 2.420 . 3.140 2.122 2.122 2.122 . 0 0 "[ ]" 1
617 1 23 ALA MB 1 25 ASP H 3.850 . 6.000 4.531 4.531 4.531 . 0 0 "[ ]" 1
618 1 20 PHE HA 1 23 ALA MB 3.390 . 5.080 2.491 2.491 2.491 . 0 0 "[ ]" 1
619 1 23 ALA MB 1 26 ILE MD 3.850 . 6.000 3.347 3.347 3.347 . 0 0 "[ ]" 1
620 1 23 ALA MB 1 48 LEU MD1 3.680 . 5.660 3.154 3.154 3.154 . 0 0 "[ ]" 1
621 1 23 ALA MB 1 48 LEU MD2 3.440 . 5.170 3.052 3.052 3.052 . 0 0 "[ ]" 1
622 1 23 ALA MB 1 47 MET ME 3.850 . 6.000 1.741 1.741 1.741 . 0 0 "[ ]" 1
623 1 23 ALA MB 1 44 VAL MG2 3.850 . 6.000 3.305 3.305 3.305 . 0 0 "[ ]" 1
624 1 23 ALA MB 1 44 VAL MG1 3.850 . 6.000 2.207 2.207 2.207 . 0 0 "[ ]" 1
625 1 31 ALA HA 1 31 ALA MB 2.420 . 3.130 2.124 2.124 2.124 . 0 0 "[ ]" 1
626 1 31 ALA MB 1 40 GLU QG 3.850 . 6.000 3.062 3.062 3.062 . 0 0 "[ ]" 1
627 1 30 GLY H 1 31 ALA MB 3.850 . 6.000 3.658 3.658 3.658 . 0 0 "[ ]" 1
628 1 31 ALA MB 1 36 ILE MG 3.850 . 6.000 2.913 2.913 2.913 . 0 0 "[ ]" 1
629 1 28 VAL HA 1 31 ALA MB 3.050 . 4.400 1.859 1.859 1.859 . 0 0 "[ ]" 1
630 1 28 VAL HB 1 31 ALA MB 3.250 . 4.790 3.942 3.942 3.942 . 0 0 "[ ]" 1
631 1 28 VAL MG1 1 31 ALA MB 3.850 . 6.000 2.128 2.128 2.128 . 0 0 "[ ]" 1
632 1 28 VAL MG2 1 31 ALA MB 3.850 . 6.000 2.488 2.488 2.488 . 0 0 "[ ]" 1
633 1 7 ALA HA 1 7 ALA MB 2.420 . 3.130 2.150 2.150 2.150 . 0 0 "[ ]" 1
634 1 7 ALA HA 1 10 GLU QB 2.770 . 3.830 3.284 3.284 3.284 . 0 0 "[ ]" 1
635 1 7 ALA HA 1 10 GLU H 2.770 . 3.840 3.800 3.800 3.800 . 0 0 "[ ]" 1
636 1 4 ILE HA 1 7 ALA MB 3.200 . 4.700 3.526 3.526 3.526 . 0 0 "[ ]" 1
637 1 8 ALA MB 1 82 VAL MG2 3.370 . 5.040 1.671 1.671 1.671 0.029 1 0 "[ ]" 1
638 1 5 TYR HA 1 8 ALA MB 3.350 . 5.000 2.798 2.798 2.798 . 0 0 "[ ]" 1
639 1 33 ASP HA 1 33 ASP QB 2.650 . 3.590 2.547 2.547 2.547 . 0 0 "[ ]" 1
640 1 62 ASP HA 1 62 ASP QB 2.660 . 3.620 2.346 2.346 2.346 . 0 0 "[ ]" 1
641 1 61 ILE MG 1 62 ASP HA 3.660 . 5.620 3.039 3.039 3.039 . 0 0 "[ ]" 1
642 1 65 ASP HA 1 65 ASP HB2 2.670 . 3.630 2.657 2.657 2.657 . 0 0 "[ ]" 1
643 1 65 ASP HA 1 65 ASP HB3 2.710 . 3.710 2.998 2.998 2.998 . 0 0 "[ ]" 1
644 1 61 ILE MG 1 65 ASP HB3 3.530 . 5.360 3.166 3.166 3.166 . 0 0 "[ ]" 1
645 1 67 ASP HA 1 67 ASP HB3 2.710 . 3.710 2.535 2.535 2.535 . 0 0 "[ ]" 1
646 1 67 ASP HA 1 67 ASP HB2 2.650 . 3.610 2.420 2.420 2.420 . 0 0 "[ ]" 1
647 1 73 ASP HA 1 73 ASP QB 2.670 . 3.640 2.203 2.203 2.203 . 0 0 "[ ]" 1
648 1 35 SER QB 1 73 ASP HA 3.160 . 4.620 2.653 2.653 2.653 . 0 0 "[ ]" 1
649 1 35 SER HA 1 73 ASP QB 3.080 . 4.460 3.588 3.588 3.588 . 0 0 "[ ]" 1
650 1 75 ASP HA 1 78 LEU MD1 3.500 . 5.300 3.607 3.607 3.607 . 0 0 "[ ]" 1
651 1 14 GLU QG 1 18 ASN HD21 3.850 . 6.000 2.349 2.349 2.349 . 0 0 "[ ]" 1
652 1 14 GLU QG 1 18 ASN HD22 3.850 . 6.000 2.166 2.166 2.166 . 0 0 "[ ]" 1
653 1 15 GLU HA 1 17 LYS H 3.600 . 5.500 5.013 5.013 5.013 . 0 0 "[ ]" 1
654 1 15 GLU HA 1 18 ASN HB3 3.060 . 4.420 4.405 4.405 4.405 . 0 0 "[ ]" 1
655 1 15 GLU HA 1 18 ASN HB2 2.950 . 4.200 3.016 3.016 3.016 . 0 0 "[ ]" 1
656 1 15 GLU HA 1 18 ASN HD21 3.310 . 4.920 3.356 3.356 3.356 . 0 0 "[ ]" 1
657 1 15 GLU HA 1 18 ASN HD22 3.570 . 5.440 5.022 5.022 5.022 . 0 0 "[ ]" 1
658 1 19 GLU HA 1 22 ALA MB 3.350 . 5.000 2.700 2.700 2.700 . 0 0 "[ ]" 1
659 1 19 GLU HA 1 22 ALA H 3.570 . 5.440 3.964 3.964 3.964 . 0 0 "[ ]" 1
660 1 19 GLU HA 1 19 GLU QG 3.200 . 4.700 1.963 1.963 1.963 . 0 0 "[ ]" 1
661 1 16 GLN HA 1 19 GLU QB 3.510 . 5.320 2.829 2.829 2.829 . 0 0 "[ ]" 1
662 1 19 GLU QG 1 48 LEU MD2 3.850 . 6.000 4.213 4.213 4.213 . 0 0 "[ ]" 1
663 1 55 GLU HA 1 55 GLU QG 2.830 . 3.950 2.070 2.070 2.070 . 0 0 "[ ]" 1
664 1 55 GLU HA 1 56 GLU H 3.400 . 5.090 3.574 3.574 3.574 . 0 0 "[ ]" 1
665 1 55 GLU HA 1 58 GLN H 3.450 . 5.200 4.469 4.469 4.469 . 0 0 "[ ]" 1
666 1 55 GLU H 1 55 GLU QG 3.760 . 5.820 3.250 3.250 3.250 . 0 0 "[ ]" 1
667 1 56 GLU HA 1 57 LEU H 3.540 . 5.380 3.551 3.551 3.551 . 0 0 "[ ]" 1
668 1 56 GLU QB 1 57 LEU H 3.770 . 5.830 2.741 2.741 2.741 . 0 0 "[ ]" 1
669 1 59 GLU H 1 59 GLU QG 3.420 . 5.140 3.945 3.945 3.945 . 0 0 "[ ]" 1
670 1 65 ASP HA 1 66 GLU QB 3.850 . 6.000 4.322 4.322 4.322 . 0 0 "[ ]" 1
671 1 72 VAL MG1 1 76 GLU HB3 3.080 . 4.460 2.509 2.509 2.509 . 0 0 "[ ]" 1
672 1 76 GLU HB2 1 76 GLU QG 2.650 . 3.600 2.247 2.247 2.247 . 0 0 "[ ]" 1
673 1 76 GLU H 1 76 GLU HB2 2.980 . 4.250 2.610 2.610 2.610 . 0 0 "[ ]" 1
674 1 72 VAL MG1 1 76 GLU HB2 3.120 . 4.540 1.815 1.815 1.815 . 0 0 "[ ]" 1
675 1 76 GLU HA 1 76 GLU QG 3.210 . 4.710 2.362 2.362 2.362 . 0 0 "[ ]" 1
676 1 17 LYS HA 1 20 PHE QB 3.850 . 6.000 2.463 2.463 2.463 . 0 0 "[ ]" 1
677 1 20 PHE QB 1 78 LEU MD2 3.850 . 6.000 2.248 2.248 2.248 . 0 0 "[ ]" 1
678 1 24 PHE HA 1 27 PHE HB2 3.040 . 4.380 2.678 2.678 2.678 . 0 0 "[ ]" 1
679 1 24 PHE HA 1 27 PHE HB3 3.020 . 4.340 4.342 4.342 4.342 0.002 1 0 "[ ]" 1
680 1 24 PHE HA 1 36 ILE MD 3.770 . 5.830 2.112 2.112 2.112 . 0 0 "[ ]" 1
681 1 24 PHE HA 1 44 VAL MG2 3.590 . 5.480 3.383 3.383 3.383 . 0 0 "[ ]" 1
682 1 21 LYS HA 1 24 PHE QB 3.230 . 4.760 3.006 3.006 3.006 . 0 0 "[ ]" 1
683 1 27 PHE HA 1 27 PHE HB2 2.810 . 3.930 3.033 3.033 3.033 . 0 0 "[ ]" 1
684 1 27 PHE HA 1 27 PHE HB3 2.650 . 3.600 2.538 2.538 2.538 . 0 0 "[ ]" 1
685 1 26 ILE MG 1 27 PHE HA 3.850 . 6.000 3.886 3.886 3.886 . 0 0 "[ ]" 1
686 1 27 PHE HB2 1 36 ILE MD 3.480 . 5.250 2.937 2.937 2.937 . 0 0 "[ ]" 1
687 1 27 PHE HB2 1 36 ILE MG 3.520 . 5.330 2.839 2.839 2.839 . 0 0 "[ ]" 1
688 1 27 PHE HB3 1 36 ILE MD 3.350 . 5.000 3.614 3.614 3.614 . 0 0 "[ ]" 1
689 1 74 PHE HA 1 75 ASP H 3.170 . 4.630 3.520 3.520 3.520 . 0 0 "[ ]" 1
690 1 74 PHE HA 1 74 PHE HB3 2.690 . 3.670 3.023 3.023 3.023 . 0 0 "[ ]" 1
691 1 74 PHE HA 1 77 PHE QB 2.730 . 3.750 2.927 2.927 2.927 . 0 0 "[ ]" 1
692 1 74 PHE H 1 74 PHE HB3 2.520 . 3.340 2.281 2.281 2.281 . 0 0 "[ ]" 1
693 1 77 PHE HA 1 80 MET QB 3.350 . 5.000 2.651 2.651 2.651 . 0 0 "[ ]" 1
694 1 72 VAL MG1 1 77 PHE HA 3.160 . 4.620 2.201 2.201 2.201 . 0 0 "[ ]" 1
695 1 31 ALA MB 1 34 GLY QA 3.850 . 6.000 3.162 3.162 3.162 . 0 0 "[ ]" 1
696 1 28 VAL HB 1 34 GLY QA 3.810 . 5.910 4.732 4.732 4.732 . 0 0 "[ ]" 1
697 1 28 VAL MG1 1 34 GLY QA 3.850 . 6.000 2.245 2.245 2.245 . 0 0 "[ ]" 1
698 1 28 VAL MG2 1 34 GLY QA 3.850 . 6.000 3.057 3.057 3.057 . 0 0 "[ ]" 1
699 1 26 ILE HA 1 26 ILE MD 3.350 . 5.000 3.884 3.884 3.884 . 0 0 "[ ]" 1
700 1 26 ILE HA 1 26 ILE QG 2.760 . 3.820 2.480 2.480 2.480 . 0 0 "[ ]" 1
701 1 26 ILE HA 1 26 ILE MG 3.490 . 5.280 2.374 2.374 2.374 . 0 0 "[ ]" 1
702 1 26 ILE HA 1 29 LEU MD1 3.850 . 6.000 4.852 4.852 4.852 . 0 0 "[ ]" 1
703 1 23 ALA HA 1 26 ILE HB 2.980 . 4.260 2.384 2.384 2.384 . 0 0 "[ ]" 1
704 1 26 ILE HA 1 26 ILE HB 2.710 . 3.720 3.037 3.037 3.037 . 0 0 "[ ]" 1
705 1 23 ALA H 1 26 ILE MD 3.850 . 6.000 3.168 3.168 3.168 . 0 0 "[ ]" 1
706 1 25 ASP QB 1 26 ILE MD 3.600 . 5.500 3.878 3.878 3.878 . 0 0 "[ ]" 1
707 1 25 ASP H 1 26 ILE MD 3.850 . 6.000 4.383 4.383 4.383 . 0 0 "[ ]" 1
708 1 26 ILE HB 1 26 ILE MD 2.630 . 3.570 2.072 2.072 2.072 . 0 0 "[ ]" 1
709 1 26 ILE MD 1 26 ILE MG 3.470 . 5.240 2.361 2.361 2.361 . 0 0 "[ ]" 1
710 1 26 ILE MD 1 47 MET ME 3.830 . 5.950 3.502 3.502 3.502 . 0 0 "[ ]" 1
711 1 23 ALA HA 1 26 ILE QG 2.850 . 4.000 3.491 3.491 3.491 . 0 0 "[ ]" 1
712 1 23 ALA HA 1 26 ILE MG 3.850 . 6.000 3.679 3.679 3.679 . 0 0 "[ ]" 1
713 1 26 ILE MG 1 47 MET ME 3.850 . 6.000 4.133 4.133 4.133 . 0 0 "[ ]" 1
714 1 36 ILE HA 1 36 ILE HB 2.710 . 3.710 2.689 2.689 2.689 . 0 0 "[ ]" 1
715 1 36 ILE HA 1 36 ILE MD 3.340 . 4.980 4.085 4.085 4.085 . 0 0 "[ ]" 1
716 1 36 ILE HA 1 36 ILE QG 2.830 . 3.950 3.236 3.236 3.236 . 0 0 "[ ]" 1
717 1 36 ILE HA 1 36 ILE MG 2.690 . 3.690 2.003 2.003 2.003 . 0 0 "[ ]" 1
718 1 36 ILE H 1 36 ILE HA 2.770 . 3.850 2.994 2.994 2.994 . 0 0 "[ ]" 1
719 1 36 ILE HB 1 36 ILE MD 2.790 . 3.870 2.340 2.340 2.340 . 0 0 "[ ]" 1
720 1 36 ILE MD 1 36 ILE MG 2.770 . 3.830 1.825 1.825 1.825 . 0 0 "[ ]" 1
721 1 36 ILE MD 1 41 LEU HA 3.550 . 5.400 2.918 2.918 2.918 . 0 0 "[ ]" 1
722 1 28 VAL HB 1 36 ILE MD 3.460 . 5.220 4.354 4.354 4.354 . 0 0 "[ ]" 1
723 1 36 ILE MD 1 72 VAL HB 3.830 . 5.960 4.427 4.427 4.427 . 0 0 "[ ]" 1
724 1 36 ILE MD 1 72 VAL MG1 3.850 . 6.000 3.521 3.521 3.521 . 0 0 "[ ]" 1
725 1 36 ILE QG 1 36 ILE MG 3.110 . 4.520 2.332 2.332 2.332 . 0 0 "[ ]" 1
726 1 27 PHE HB3 1 36 ILE MG 3.490 . 5.280 2.657 2.657 2.657 . 0 0 "[ ]" 1
727 1 36 ILE HB 1 36 ILE MG 2.450 . 3.200 2.101 2.101 2.101 . 0 0 "[ ]" 1
728 1 36 ILE MG 1 41 LEU HA 3.180 . 4.660 3.555 3.555 3.555 . 0 0 "[ ]" 1
729 1 28 VAL HA 1 36 ILE MG 2.970 . 4.240 2.455 2.455 2.455 . 0 0 "[ ]" 1
730 1 28 VAL H 1 36 ILE MG 3.650 . 5.590 3.407 3.407 3.407 . 0 0 "[ ]" 1
731 1 4 ILE HA 1 4 ILE HB 2.650 . 3.590 3.030 3.030 3.030 . 0 0 "[ ]" 1
732 1 4 ILE HA 1 4 ILE QG 3.380 . 5.060 2.496 2.496 2.496 . 0 0 "[ ]" 1
733 1 4 ILE HA 1 5 TYR H 2.870 . 4.040 3.591 3.591 3.591 . 0 0 "[ ]" 1
734 1 4 ILE HB 1 6 LYS H 3.210 . 4.710 4.561 4.561 4.561 . 0 0 "[ ]" 1
735 1 4 ILE HA 1 4 ILE MD 3.850 . 6.000 3.815 3.815 3.815 . 0 0 "[ ]" 1
736 1 4 ILE H 1 4 ILE MD 3.850 . 6.000 3.761 3.761 3.761 . 0 0 "[ ]" 1
737 1 4 ILE HB 1 4 ILE MG 2.450 . 3.200 2.112 2.112 2.112 . 0 0 "[ ]" 1
738 1 61 ILE HA 1 61 ILE HB 2.680 . 3.660 3.011 3.011 3.011 . 0 0 "[ ]" 1
739 1 61 ILE HA 1 64 VAL MG1 2.980 . 4.250 3.532 3.532 3.532 . 0 0 "[ ]" 1
740 1 58 GLN HA 1 61 ILE HB 2.720 . 3.740 3.291 3.291 3.291 . 0 0 "[ ]" 1
741 1 61 ILE HA 1 61 ILE MD 2.930 . 4.160 3.493 3.493 3.493 . 0 0 "[ ]" 1
742 1 61 ILE HB 1 61 ILE MD 2.520 . 3.330 1.888 1.888 1.888 . 0 0 "[ ]" 1
743 1 61 ILE H 1 61 ILE MD 2.830 . 3.950 2.436 2.436 2.436 . 0 0 "[ ]" 1
744 1 57 LEU HA 1 61 ILE MD 3.160 . 4.620 3.799 3.799 3.799 . 0 0 "[ ]" 1
745 1 58 GLN HA 1 61 ILE MD 3.050 . 4.400 3.008 3.008 3.008 . 0 0 "[ ]" 1
746 1 58 GLN HE21 1 61 ILE MD 3.850 . 6.000 4.824 4.824 4.824 . 0 0 "[ ]" 1
747 1 58 GLN HE22 1 61 ILE MD 3.850 . 6.000 4.823 4.823 4.823 . 0 0 "[ ]" 1
748 1 38 THR HA 1 61 ILE MD 2.980 . 4.250 2.560 2.560 2.560 . 0 0 "[ ]" 1
749 1 38 THR HB 1 61 ILE MD 2.770 . 3.850 2.139 2.139 2.139 . 0 0 "[ ]" 1
750 1 38 THR MG 1 61 ILE MD 3.190 . 4.670 3.171 3.171 3.171 . 0 0 "[ ]" 1
751 1 61 ILE MD 1 71 THR HA 3.850 . 6.000 5.010 5.010 5.010 . 0 0 "[ ]" 1
752 1 61 ILE HA 1 61 ILE QG 3.640 . 5.580 2.083 2.083 2.083 . 0 0 "[ ]" 1
753 1 61 ILE HA 1 61 ILE MG 3.530 . 5.360 2.538 2.538 2.538 . 0 0 "[ ]" 1
754 1 58 GLN HA 1 61 ILE MG 3.850 . 6.000 4.353 4.353 4.353 . 0 0 "[ ]" 1
755 1 58 GLN HE21 1 61 ILE MG 3.770 . 5.840 3.814 3.814 3.814 . 0 0 "[ ]" 1
756 1 58 GLN HE22 1 61 ILE MG 3.850 . 6.000 3.446 3.446 3.446 . 0 0 "[ ]" 1
757 1 17 LYS HA 1 17 LYS QG 3.710 . 5.710 2.510 2.510 2.510 . 0 0 "[ ]" 1
758 1 17 LYS HA 1 78 LEU MD2 3.850 . 6.000 3.477 3.477 3.477 . 0 0 "[ ]" 1
759 1 17 LYS QD 1 78 LEU MD1 3.850 . 6.000 2.708 2.708 2.708 . 0 0 "[ ]" 1
760 1 21 LYS HA 1 21 LYS QD 3.540 . 5.380 3.768 3.768 3.768 . 0 0 "[ ]" 1
761 1 21 LYS HA 1 21 LYS QG 3.630 . 5.560 2.158 2.158 2.158 . 0 0 "[ ]" 1
762 1 18 ASN HA 1 21 LYS QB 3.450 . 5.200 3.011 3.011 3.011 . 0 0 "[ ]" 1
763 1 21 LYS HA 1 21 LYS QE 3.850 . 6.000 4.618 4.618 4.618 . 0 0 "[ ]" 1
764 1 21 LYS QB 1 21 LYS QE 3.850 . 6.000 3.622 3.622 3.622 . 0 0 "[ ]" 1
765 1 21 LYS QE 1 21 LYS QG 3.270 . 4.840 2.178 2.178 2.178 . 0 0 "[ ]" 1
766 1 21 LYS QE 1 78 LEU MD2 3.850 . 6.000 3.954 3.954 3.954 . 0 0 "[ ]" 1
767 1 39 LYS HA 1 39 LYS QE 3.850 . 6.000 3.863 3.863 3.863 . 0 0 "[ ]" 1
768 1 39 LYS H 1 39 LYS QG 3.850 . 6.000 3.998 3.998 3.998 . 0 0 "[ ]" 1
769 1 43 LYS HA 1 43 LYS QG 3.290 . 4.880 2.303 2.303 2.303 . 0 0 "[ ]" 1
770 1 6 LYS QD 1 8 ALA H 3.850 . 6.000 4.982 4.982 4.982 . 0 0 "[ ]" 1
771 1 86 LYS HA 1 86 LYS QG 3.580 . 5.460 3.295 3.295 3.295 . 0 0 "[ ]" 1
772 1 86 LYS HA 1 86 LYS QD 3.790 . 5.880 4.289 4.289 4.289 . 0 0 "[ ]" 1
773 1 12 LEU HA 1 12 LEU HB3 2.670 . 3.630 2.718 2.718 2.718 . 0 0 "[ ]" 1
774 1 12 LEU HA 1 12 LEU MD2 2.540 . 3.380 1.812 1.812 1.812 . 0 0 "[ ]" 1
775 1 12 LEU HA 1 12 LEU MD1 3.770 . 5.830 3.690 3.690 3.690 . 0 0 "[ ]" 1
776 1 12 LEU HB3 1 13 THR H 2.990 . 4.280 2.661 2.661 2.661 . 0 0 "[ ]" 1
777 1 12 LEU HA 1 12 LEU HB2 2.820 . 3.940 2.971 2.971 2.971 . 0 0 "[ ]" 1
778 1 12 LEU MD2 1 17 LYS QE 3.850 . 6.000 4.277 4.277 4.277 . 0 0 "[ ]" 1
779 1 12 LEU HB3 1 12 LEU MD2 2.520 . 3.350 2.345 2.345 2.345 . 0 0 "[ ]" 1
780 1 12 LEU HB2 1 12 LEU MD2 2.790 . 3.870 3.193 3.193 3.193 . 0 0 "[ ]" 1
781 1 12 LEU MD2 1 12 LEU HG 2.440 . 3.170 2.140 2.140 2.140 . 0 0 "[ ]" 1
782 1 12 LEU MD2 1 16 GLN HE21 3.410 . 5.120 4.186 4.186 4.186 . 0 0 "[ ]" 1
783 1 12 LEU MD2 1 16 GLN HE22 3.740 . 5.780 4.000 4.000 4.000 . 0 0 "[ ]" 1
784 1 9 VAL HA 1 12 LEU MD2 3.100 . 4.500 3.757 3.757 3.757 . 0 0 "[ ]" 1
785 1 12 LEU MD1 1 17 LYS HA 3.850 . 6.000 3.595 3.595 3.595 . 0 0 "[ ]" 1
786 1 12 LEU HB3 1 12 LEU MD1 2.440 . 3.170 2.274 2.274 2.274 . 0 0 "[ ]" 1
787 1 12 LEU HB2 1 12 LEU MD1 2.440 . 3.170 2.447 2.447 2.447 . 0 0 "[ ]" 1
788 1 12 LEU MD1 1 12 LEU HG 2.490 . 3.280 2.150 2.150 2.150 . 0 0 "[ ]" 1
789 1 9 VAL HA 1 12 LEU MD1 2.530 . 3.360 2.706 2.706 2.706 . 0 0 "[ ]" 1
790 1 12 LEU HA 1 12 LEU HG 3.850 . 6.000 2.724 2.724 2.724 . 0 0 "[ ]" 1
791 1 12 LEU H 1 12 LEU HG 3.460 . 5.220 2.684 2.684 2.684 . 0 0 "[ ]" 1
792 1 9 VAL HA 1 12 LEU HG 3.040 . 4.380 2.063 2.063 2.063 . 0 0 "[ ]" 1
793 1 29 LEU HA 1 29 LEU QB 2.670 . 3.630 2.521 2.521 2.521 . 0 0 "[ ]" 1
794 1 26 ILE HA 1 29 LEU QB 3.310 . 4.910 3.997 3.997 3.997 . 0 0 "[ ]" 1
795 1 26 ILE H 1 29 LEU MD2 3.850 . 6.000 4.059 4.059 4.059 . 0 0 "[ ]" 1
796 1 29 LEU H 1 29 LEU MD2 3.850 . 6.000 2.170 2.170 2.170 . 0 0 "[ ]" 1
797 1 29 LEU MD1 1 30 GLY H 3.850 . 6.000 4.585 4.585 4.585 . 0 0 "[ ]" 1
798 1 29 LEU HA 1 29 LEU MD1 3.850 . 6.000 1.900 1.900 1.900 . 0 0 "[ ]" 1
799 1 29 LEU H 1 29 LEU MD1 3.850 . 6.000 3.854 3.854 3.854 . 0 0 "[ ]" 1
800 1 29 LEU H 1 29 LEU HG 3.580 . 5.460 3.817 3.817 3.817 . 0 0 "[ ]" 1
801 1 40 GLU H 1 41 LEU HA 3.420 . 5.130 4.965 4.965 4.965 . 0 0 "[ ]" 1
802 1 41 LEU HA 1 42 GLY H 3.850 . 6.000 3.416 3.416 3.416 . 0 0 "[ ]" 1
803 1 41 LEU HA 1 41 LEU MD2 3.640 . 5.580 1.856 1.856 1.856 . 0 0 "[ ]" 1
804 1 41 LEU HA 1 45 MET H 3.850 . 6.000 4.416 4.416 4.416 . 0 0 "[ ]" 1
805 1 41 LEU HA 1 44 VAL HB 3.200 . 4.700 2.659 2.659 2.659 . 0 0 "[ ]" 1
806 1 41 LEU HA 1 44 VAL MG2 3.320 . 4.940 2.061 2.061 2.061 . 0 0 "[ ]" 1
807 1 40 GLU H 1 41 LEU QB 3.310 . 4.920 3.861 3.861 3.861 . 0 0 "[ ]" 1
808 1 38 THR HA 1 41 LEU QB 3.660 . 5.620 2.771 2.771 2.771 . 0 0 "[ ]" 1
809 1 38 THR HA 1 41 LEU MD1 3.850 . 6.000 4.561 4.561 4.561 . 0 0 "[ ]" 1
810 1 38 THR HA 1 41 LEU HG 3.680 . 5.660 4.905 4.905 4.905 . 0 0 "[ ]" 1
811 1 48 LEU HA 1 48 LEU MD2 3.210 . 4.720 2.221 2.221 2.221 . 0 0 "[ ]" 1
812 1 20 PHE HA 1 48 LEU MD1 3.850 . 6.000 3.503 3.503 3.503 . 0 0 "[ ]" 1
813 1 48 LEU HA 1 48 LEU MD1 3.850 . 6.000 3.804 3.804 3.804 . 0 0 "[ ]" 1
814 1 45 MET HA 1 48 LEU MD1 3.830 . 5.960 2.940 2.940 2.940 . 0 0 "[ ]" 1
815 1 47 MET H 1 48 LEU MD1 3.850 . 6.000 4.729 4.729 4.729 . 0 0 "[ ]" 1
816 1 48 LEU MD1 1 81 MET ME 3.850 . 6.000 2.580 2.580 2.580 . 0 0 "[ ]" 1
817 1 44 VAL MG1 1 48 LEU MD1 3.850 . 6.000 1.877 1.877 1.877 . 0 0 "[ ]" 1
818 1 48 LEU HA 1 48 LEU HG 3.670 . 5.640 2.697 2.697 2.697 . 0 0 "[ ]" 1
819 1 48 LEU H 1 48 LEU HG 3.440 . 5.180 2.447 2.447 2.447 . 0 0 "[ ]" 1
820 1 57 LEU HA 1 60 MET H 3.650 . 5.600 3.399 3.399 3.399 . 0 0 "[ ]" 1
821 1 57 LEU H 1 57 LEU QB 3.230 . 4.760 1.962 1.962 1.962 . 0 0 "[ ]" 1
822 1 57 LEU HA 1 57 LEU MD1 3.420 . 5.140 3.531 3.531 3.531 . 0 0 "[ ]" 1
823 1 57 LEU H 1 57 LEU MD1 3.850 . 6.000 3.361 3.361 3.361 . 0 0 "[ ]" 1
824 1 54 PRO HA 1 57 LEU MD1 3.580 . 5.460 2.036 2.036 2.036 . 0 0 "[ ]" 1
825 1 57 LEU MD1 1 58 GLN H 3.850 . 6.000 4.281 4.281 4.281 . 0 0 "[ ]" 1
826 1 38 THR HB 1 57 LEU MD1 3.850 . 6.000 4.911 4.911 4.911 . 0 0 "[ ]" 1
827 1 57 LEU H 1 57 LEU HG 3.470 . 5.240 3.422 3.422 3.422 . 0 0 "[ ]" 1
828 1 78 LEU HA 1 78 LEU HB2 2.770 . 3.830 3.037 3.037 3.037 . 0 0 "[ ]" 1
829 1 78 LEU HA 1 78 LEU MD2 2.830 . 3.950 1.953 1.953 1.953 . 0 0 "[ ]" 1
830 1 78 LEU HA 1 81 MET QG 2.560 . 3.420 2.276 2.276 2.276 . 0 0 "[ ]" 1
831 1 78 LEU HA 1 78 LEU HB3 2.670 . 3.640 2.452 2.452 2.452 . 0 0 "[ ]" 1
832 1 78 LEU H 1 78 LEU HB3 2.770 . 3.850 3.531 3.531 3.531 . 0 0 "[ ]" 1
833 1 78 LEU HB3 1 79 VAL H 3.230 . 4.760 4.075 4.075 4.075 . 0 0 "[ ]" 1
834 1 20 PHE QB 1 78 LEU MD1 3.850 . 6.000 3.927 3.927 3.927 . 0 0 "[ ]" 1
835 1 74 PHE HZ 1 78 LEU MD1 3.850 . 6.000 2.896 2.896 2.896 . 0 0 "[ ]" 1
836 1 17 LYS QB 1 78 LEU MD1 3.850 . 6.000 4.431 4.431 4.431 . 0 0 "[ ]" 1
837 1 17 LYS QE 1 78 LEU MD1 3.850 . 6.000 2.855 2.855 2.855 . 0 0 "[ ]" 1
838 1 17 LYS QG 1 78 LEU MD1 3.850 . 6.000 4.324 4.324 4.324 . 0 0 "[ ]" 1
839 1 78 LEU HA 1 78 LEU MD1 3.850 . 6.000 3.697 3.697 3.697 . 0 0 "[ ]" 1
840 1 78 LEU H 1 78 LEU MD1 3.850 . 6.000 3.545 3.545 3.545 . 0 0 "[ ]" 1
841 1 78 LEU MD1 1 79 VAL H 3.850 . 6.000 4.951 4.951 4.951 . 0 0 "[ ]" 1
842 1 77 PHE H 1 78 LEU MD2 3.850 . 6.000 4.887 4.887 4.887 . 0 0 "[ ]" 1
843 1 12 LEU MD1 1 78 LEU MD2 3.850 . 6.000 2.821 2.821 2.821 . 0 0 "[ ]" 1
844 1 78 LEU HB3 1 78 LEU MD2 3.350 . 5.000 2.429 2.429 2.429 . 0 0 "[ ]" 1
845 1 78 LEU H 1 78 LEU MD2 3.850 . 6.000 2.561 2.561 2.561 . 0 0 "[ ]" 1
846 1 78 LEU HA 1 78 LEU HG 2.930 . 4.160 3.289 3.289 3.289 . 0 0 "[ ]" 1
847 1 78 LEU HB2 1 78 LEU HG 2.700 . 3.700 2.387 2.387 2.387 . 0 0 "[ ]" 1
848 1 45 MET QB 1 47 MET H 3.290 . 4.880 4.366 4.366 4.366 . 0 0 "[ ]" 1
849 1 45 MET H 1 45 MET ME 3.850 . 6.000 4.922 4.922 4.922 . 0 0 "[ ]" 1
850 1 45 MET ME 1 52 PRO QD 3.830 . 5.950 3.659 3.659 3.659 . 0 0 "[ ]" 1
851 1 45 MET ME 1 50 GLN HE21 3.850 . 6.000 3.175 3.175 3.175 . 0 0 "[ ]" 1
852 1 45 MET ME 1 50 GLN HE22 3.850 . 6.000 2.646 2.646 2.646 . 0 0 "[ ]" 1
853 1 41 LEU MD1 1 45 MET QG 3.850 . 6.000 1.970 1.970 1.970 . 0 0 "[ ]" 1
854 1 45 MET HA 1 45 MET QG 3.670 . 5.640 2.312 2.312 2.312 . 0 0 "[ ]" 1
855 1 45 MET H 1 45 MET QG 3.370 . 5.040 2.495 2.495 2.495 . 0 0 "[ ]" 1
856 1 44 VAL MG1 1 45 MET QG 3.850 . 6.000 3.809 3.809 3.809 . 0 0 "[ ]" 1
857 1 47 MET HA 1 47 MET QG 2.830 . 3.970 3.441 3.441 3.441 . 0 0 "[ ]" 1
858 1 47 MET QB 1 48 LEU H 3.850 . 6.000 3.392 3.392 3.392 . 0 0 "[ ]" 1
859 1 47 MET H 1 47 MET QB 3.290 . 4.870 2.179 2.179 2.179 . 0 0 "[ ]" 1
860 1 27 PHE HZ 1 47 MET ME 3.850 . 6.000 1.905 1.905 1.905 . 0 0 "[ ]" 1
861 1 47 MET ME 1 48 LEU MD2 3.850 . 6.000 2.491 2.491 2.491 . 0 0 "[ ]" 1
862 1 47 MET H 1 47 MET ME 3.850 . 6.000 4.972 4.972 4.972 . 0 0 "[ ]" 1
863 1 44 VAL HA 1 47 MET ME 3.790 . 5.880 3.429 3.429 3.429 . 0 0 "[ ]" 1
864 1 44 VAL MG2 1 47 MET ME 3.850 . 6.000 4.037 4.037 4.037 . 0 0 "[ ]" 1
865 1 44 VAL MG1 1 47 MET ME 3.850 . 6.000 2.700 2.700 2.700 . 0 0 "[ ]" 1
866 1 47 MET QG 1 48 LEU H 2.920 . 4.130 1.861 1.861 1.861 . 0 0 "[ ]" 1
867 1 44 VAL HA 1 47 MET QG 2.860 . 4.020 2.130 2.130 2.130 . 0 0 "[ ]" 1
868 1 60 MET ME 1 84 SER HA 3.850 . 6.000 3.431 3.431 3.431 . 0 0 "[ ]" 1
869 1 60 MET ME 1 84 SER QB 3.850 . 6.000 3.097 3.097 3.097 . 0 0 "[ ]" 1
870 1 60 MET HA 1 60 MET QG 3.690 . 5.670 1.953 1.953 1.953 . 0 0 "[ ]" 1
871 1 80 MET HA 1 80 MET QG 3.180 . 4.660 1.959 1.959 1.959 . 0 0 "[ ]" 1
872 1 80 MET HA 1 83 ARG QB 2.940 . 4.180 3.743 3.743 3.743 . 0 0 "[ ]" 1
873 1 80 MET HA 1 83 ARG QD 3.740 . 5.780 4.704 4.704 4.704 . 0 0 "[ ]" 1
874 1 64 VAL MG2 1 80 MET HA 3.380 . 5.060 3.704 3.704 3.704 . 0 0 "[ ]" 1
875 1 80 MET H 1 80 MET QB 2.770 . 3.850 1.978 1.978 1.978 . 0 0 "[ ]" 1
876 1 77 PHE HA 1 80 MET ME 3.850 . 6.000 4.065 4.065 4.065 . 0 0 "[ ]" 1
877 1 61 ILE H 1 80 MET ME 3.850 . 6.000 4.959 4.959 4.959 . 0 0 "[ ]" 1
878 1 81 MET HA 1 81 MET HB2 2.840 . 3.980 2.867 2.867 2.867 . 0 0 "[ ]" 1
879 1 81 MET HA 1 81 MET HB3 2.850 . 4.000 2.259 2.259 2.259 . 0 0 "[ ]" 1
880 1 81 MET HA 1 81 MET ME 3.100 . 4.500 3.248 3.248 3.248 . 0 0 "[ ]" 1
881 1 81 MET HA 1 81 MET QG 2.870 . 4.040 3.431 3.431 3.431 . 0 0 "[ ]" 1
882 1 81 MET HA 1 84 SER QB 3.120 . 4.540 2.411 2.411 2.411 . 0 0 "[ ]" 1
883 1 81 MET HB2 1 81 MET QG 2.670 . 3.630 2.194 2.194 2.194 . 0 0 "[ ]" 1
884 1 48 LEU QB 1 81 MET ME 3.440 . 5.170 3.842 3.842 3.842 . 0 0 "[ ]" 1
885 1 45 MET QG 1 81 MET ME 3.850 . 6.000 4.006 4.006 4.006 . 0 0 "[ ]" 1
886 1 81 MET HB2 1 81 MET ME 3.250 . 4.790 3.173 3.173 3.173 . 0 0 "[ ]" 1
887 1 81 MET ME 1 85 MET QG 3.850 . 6.000 4.446 4.446 4.446 . 0 0 "[ ]" 1
888 1 50 GLN HE21 1 81 MET ME 3.850 . 6.000 2.634 2.634 2.634 . 0 0 "[ ]" 1
889 1 50 GLN HE22 1 81 MET ME 3.850 . 6.000 2.801 2.801 2.801 . 0 0 "[ ]" 1
890 1 81 MET ME 1 84 SER QB 3.850 . 6.000 4.319 4.319 4.319 . 0 0 "[ ]" 1
891 1 85 MET HA 1 85 MET QB 2.670 . 3.640 2.482 2.482 2.482 . 0 0 "[ ]" 1
892 1 12 LEU HA 1 85 MET ME 3.850 . 6.000 4.655 4.655 4.655 . 0 0 "[ ]" 1
893 1 12 LEU MD2 1 85 MET ME 3.670 . 5.630 2.029 2.029 2.029 . 0 0 "[ ]" 1
894 1 81 MET HA 1 85 MET ME 3.850 . 6.000 3.663 3.663 3.663 . 0 0 "[ ]" 1
895 1 81 MET ME 1 85 MET ME 3.850 . 6.000 3.365 3.365 3.365 . 0 0 "[ ]" 1
896 1 16 GLN HE21 1 85 MET ME 3.840 . 5.980 4.531 4.531 4.531 . 0 0 "[ ]" 1
897 1 16 GLN HE22 1 85 MET ME 3.850 . 6.000 3.350 3.350 3.350 . 0 0 "[ ]" 1
898 1 85 MET HA 1 85 MET QG 2.380 . 3.050 2.057 2.057 2.057 . 0 0 "[ ]" 1
899 1 18 ASN HA 1 18 ASN HB3 2.650 . 3.590 2.616 2.616 2.616 . 0 0 "[ ]" 1
900 1 18 ASN HB3 1 18 ASN HD21 2.960 . 4.210 3.318 3.318 3.318 . 0 0 "[ ]" 1
901 1 18 ASN HB2 1 18 ASN HD21 2.910 . 4.120 2.249 2.249 2.249 . 0 0 "[ ]" 1
902 1 51 ASN HA 1 51 ASN HB2 2.650 . 3.600 2.785 2.785 2.785 . 0 0 "[ ]" 1
903 1 51 ASN HA 1 51 ASN HB3 2.680 . 3.660 2.929 2.929 2.929 . 0 0 "[ ]" 1
904 1 51 ASN HA 1 52 PRO QD 2.390 . 3.080 2.410 2.410 2.410 . 0 0 "[ ]" 1
905 1 46 ARG QG 1 51 ASN HA 3.140 . 4.580 3.739 3.739 3.739 . 0 0 "[ ]" 1
906 1 51 ASN HB2 1 51 ASN HD21 3.500 . 5.290 2.260 2.260 2.260 . 0 0 "[ ]" 1
907 1 51 ASN HB3 1 51 ASN HD21 3.300 . 4.900 3.242 3.242 3.242 . 0 0 "[ ]" 1
908 1 51 ASN HB3 1 51 ASN HD22 2.970 . 4.240 3.936 3.936 3.936 . 0 0 "[ ]" 1
909 1 52 PRO QB 1 52 PRO QD 3.250 . 4.790 2.819 2.819 2.819 . 0 0 "[ ]" 1
910 1 52 PRO QB 1 53 THR H 3.330 . 4.960 2.730 2.730 2.730 . 0 0 "[ ]" 1
911 1 52 PRO HA 1 52 PRO QD 2.750 . 3.800 3.407 3.407 3.407 . 0 0 "[ ]" 1
912 1 50 GLN HB2 1 52 PRO QD 2.670 . 3.650 2.781 2.781 2.781 . 0 0 "[ ]" 1
913 1 50 GLN HB3 1 52 PRO QD 2.540 . 3.390 1.854 1.854 1.854 . 0 0 "[ ]" 1
914 1 54 PRO HA 1 57 LEU QB 2.910 . 4.120 2.291 2.291 2.291 . 0 0 "[ ]" 1
915 1 54 PRO HA 1 54 PRO QD 3.800 . 5.900 3.417 3.417 3.417 . 0 0 "[ ]" 1
916 1 54 PRO HA 1 54 PRO QG 3.310 . 4.910 3.513 3.513 3.513 . 0 0 "[ ]" 1
917 1 53 THR HA 1 54 PRO QD 3.000 . 4.300 2.197 2.197 2.197 . 0 0 "[ ]" 1
918 1 53 THR HB 1 54 PRO QD 3.120 . 4.540 2.007 2.007 2.007 . 0 0 "[ ]" 1
919 1 53 THR MG 1 54 PRO QD 3.850 . 6.000 2.238 2.238 2.238 . 0 0 "[ ]" 1
920 1 54 PRO QG 1 55 GLU H 3.850 . 6.000 2.303 2.303 2.303 . 0 0 "[ ]" 1
921 1 11 GLN HA 1 11 GLN HB3 2.660 . 3.620 2.516 2.516 2.516 . 0 0 "[ ]" 1
922 1 11 GLN HA 1 11 GLN QG 3.140 . 4.580 2.384 2.384 2.384 . 0 0 "[ ]" 1
923 1 16 GLN HA 1 17 LYS H 3.790 . 5.870 3.591 3.591 3.591 . 0 0 "[ ]" 1
924 1 16 GLN HA 1 16 GLN QG 3.290 . 4.880 2.417 2.417 2.417 . 0 0 "[ ]" 1
925 1 16 GLN HE22 1 16 GLN QG 3.140 . 4.580 3.391 3.391 3.391 . 0 0 "[ ]" 1
926 1 16 GLN H 1 16 GLN QG 3.620 . 5.540 2.643 2.643 2.643 . 0 0 "[ ]" 1
927 1 50 GLN HA 1 50 GLN HB2 2.690 . 3.690 3.034 3.034 3.034 . 0 0 "[ ]" 1
928 1 50 GLN HA 1 50 GLN HB3 2.710 . 3.730 2.524 2.524 2.524 . 0 0 "[ ]" 1
929 1 50 GLN QG 1 81 MET ME 3.780 . 5.860 3.820 3.820 3.820 . 0 0 "[ ]" 1
930 1 50 GLN QG 1 51 ASN H 3.520 . 5.340 4.070 4.070 4.070 . 0 0 "[ ]" 1
931 1 50 GLN QG 1 52 PRO QD 3.600 . 5.500 3.893 3.893 3.893 . 0 0 "[ ]" 1
932 1 50 GLN HA 1 50 GLN QG 2.880 . 4.050 2.219 2.219 2.219 . 0 0 "[ ]" 1
933 1 50 GLN HB2 1 50 GLN QG 2.650 . 3.590 2.231 2.231 2.231 . 0 0 "[ ]" 1
934 1 50 GLN H 1 50 GLN QG 2.870 . 4.040 3.092 3.092 3.092 . 0 0 "[ ]" 1
935 1 58 GLN HA 1 58 GLN HE21 3.700 . 5.700 3.167 3.167 3.167 . 0 0 "[ ]" 1
936 1 58 GLN HA 1 58 GLN QG 3.470 . 5.240 3.052 3.052 3.052 . 0 0 "[ ]" 1
937 1 55 GLU HA 1 58 GLN QB 3.850 . 6.000 3.940 3.940 3.940 . 0 0 "[ ]" 1
938 1 58 GLN QB 1 59 GLU H 3.830 . 5.960 2.613 2.613 2.613 . 0 0 "[ ]" 1
939 1 58 GLN H 1 58 GLN QB 3.380 . 5.060 2.165 2.165 2.165 . 0 0 "[ ]" 1
940 1 58 GLN QG 1 62 ASP H 3.850 . 6.000 4.322 4.322 4.322 . 0 0 "[ ]" 1
941 1 58 GLN QG 1 59 GLU HA 3.850 . 6.000 3.254 3.254 3.254 . 0 0 "[ ]" 1
942 1 58 GLN QG 1 59 GLU H 3.850 . 6.000 3.233 3.233 3.233 . 0 0 "[ ]" 1
943 1 58 GLN H 1 58 GLN QG 3.820 . 5.940 3.942 3.942 3.942 . 0 0 "[ ]" 1
944 1 46 ARG HA 1 46 ARG QG 3.350 . 5.000 2.000 2.000 2.000 . 0 0 "[ ]" 1
945 1 46 ARG QB 1 47 MET H 2.850 . 4.000 2.845 2.845 2.845 . 0 0 "[ ]" 1
946 1 46 ARG HA 1 46 ARG QB 2.650 . 3.610 2.537 2.537 2.537 . 0 0 "[ ]" 1
947 1 46 ARG H 1 46 ARG QB 2.500 . 3.300 1.940 1.940 1.940 . 0 0 "[ ]" 1
948 1 46 ARG HA 1 46 ARG QD 3.830 . 5.960 3.696 3.696 3.696 . 0 0 "[ ]" 1
949 1 46 ARG H 1 46 ARG QG 3.540 . 5.380 3.529 3.529 3.529 . 0 0 "[ ]" 1
950 1 83 ARG HA 1 83 ARG QB 2.670 . 3.650 2.546 2.546 2.546 . 0 0 "[ ]" 1
951 1 83 ARG HA 1 83 ARG QD 3.580 . 5.460 3.803 3.803 3.803 . 0 0 "[ ]" 1
952 1 83 ARG HA 1 83 ARG QG 2.620 . 3.540 2.009 2.009 2.009 . 0 0 "[ ]" 1
953 1 83 ARG H 1 83 ARG QD 3.850 . 6.000 3.908 3.908 3.908 . 0 0 "[ ]" 1
954 1 64 VAL MG2 1 83 ARG QD 3.850 . 6.000 4.105 4.105 4.105 . 0 0 "[ ]" 1
955 1 79 VAL MG1 1 83 ARG QD 3.750 . 5.790 3.734 3.734 3.734 . 0 0 "[ ]" 1
956 1 35 SER HA 1 73 ASP HA 2.670 . 3.630 2.689 2.689 2.689 . 0 0 "[ ]" 1
957 1 24 PHE HZ 1 35 SER HA 2.830 . 3.960 2.973 2.973 2.973 . 0 0 "[ ]" 1
958 1 35 SER HA 1 36 ILE QG 3.150 . 4.600 2.972 2.972 2.972 . 0 0 "[ ]" 1
959 1 35 SER HA 1 36 ILE MG 3.850 . 6.000 4.078 4.078 4.078 . 0 0 "[ ]" 1
960 1 35 SER QB 1 71 THR HB 2.870 . 4.040 3.278 3.278 3.278 . 0 0 "[ ]" 1
961 1 35 SER QB 1 73 ASP H 3.410 . 5.120 4.004 4.004 4.004 . 0 0 "[ ]" 1
962 1 37 SER QB 1 40 GLU QG 3.850 . 6.000 4.191 4.191 4.191 . 0 0 "[ ]" 1
963 1 37 SER QB 1 39 LYS H 3.730 . 5.750 3.263 3.263 3.263 . 0 0 "[ ]" 1
964 1 37 SER QB 1 71 THR MG 3.850 . 6.000 2.076 2.076 2.076 . 0 0 "[ ]" 1
965 1 84 SER HA 1 85 MET H 3.480 . 5.260 3.380 3.380 3.380 . 0 0 "[ ]" 1
966 1 84 SER QB 1 85 MET H 3.560 . 5.420 3.188 3.188 3.188 . 0 0 "[ ]" 1
967 1 86 LYS H 1 89 SER QB 3.850 . 6.000 4.305 4.305 4.305 . 0 0 "[ ]" 1
968 1 13 THR H 1 13 THR MG 3.400 . 5.100 2.817 2.817 2.817 . 0 0 "[ ]" 1
969 1 38 THR HA 1 38 THR HB 2.650 . 3.600 2.359 2.359 2.359 . 0 0 "[ ]" 1
970 1 38 THR HA 1 38 THR MG 2.690 . 3.670 3.146 3.146 3.146 . 0 0 "[ ]" 1
971 1 38 THR HB 1 39 LYS H 3.390 . 5.080 4.182 4.182 4.182 . 0 0 "[ ]" 1
972 1 38 THR H 1 38 THR HB 3.230 . 4.750 2.635 2.635 2.635 . 0 0 "[ ]" 1
973 1 38 THR MG 1 40 GLU H 3.850 . 6.000 4.190 4.190 4.190 . 0 0 "[ ]" 1
974 1 38 THR MG 1 70 GLY QA 3.380 . 5.050 2.458 2.458 2.458 . 0 0 "[ ]" 1
975 1 53 THR HA 1 53 THR MG 3.310 . 4.920 1.939 1.939 1.939 . 0 0 "[ ]" 1
976 1 53 THR HA 1 53 THR HB 2.670 . 3.630 2.757 2.757 2.757 . 0 0 "[ ]" 1
977 1 53 THR H 1 53 THR HB 3.120 . 4.540 3.361 3.361 3.361 . 0 0 "[ ]" 1
978 1 37 SER HA 1 71 THR HA 3.220 . 4.740 1.858 1.858 1.858 . 0 0 "[ ]" 1
979 1 71 THR HA 1 72 VAL MG2 3.850 . 6.000 3.505 3.505 3.505 . 0 0 "[ ]" 1
980 1 71 THR HA 1 71 THR HB 2.650 . 3.600 2.500 2.500 2.500 . 0 0 "[ ]" 1
981 1 35 SER QB 1 71 THR MG 3.610 . 5.520 4.095 4.095 4.095 . 0 0 "[ ]" 1
982 1 71 THR HA 1 71 THR MG 2.470 . 3.240 2.234 2.234 2.234 . 0 0 "[ ]" 1
983 1 28 VAL HA 1 35 SER H 3.450 . 5.200 4.652 4.652 4.652 . 0 0 "[ ]" 1
984 1 28 VAL HA 1 28 VAL HB 2.650 . 3.590 2.966 2.966 2.966 . 0 0 "[ ]" 1
985 1 28 VAL HA 1 28 VAL MG1 2.770 . 3.830 2.753 2.753 2.753 . 0 0 "[ ]" 1
986 1 25 ASP HA 1 28 VAL HB 2.640 . 3.580 2.904 2.904 2.904 . 0 0 "[ ]" 1
987 1 28 VAL HB 1 28 VAL MG2 2.440 . 3.170 2.109 2.109 2.109 . 0 0 "[ ]" 1
988 1 28 VAL MG1 1 35 SER HA 3.680 . 5.660 4.274 4.274 4.274 . 0 0 "[ ]" 1
989 1 28 VAL MG2 1 35 SER HA 3.850 . 6.000 2.654 2.654 2.654 . 0 0 "[ ]" 1
990 1 28 VAL HA 1 28 VAL MG2 3.570 . 5.440 1.930 1.930 1.930 . 0 0 "[ ]" 1
991 1 44 VAL HA 1 45 MET H 2.920 . 4.130 3.515 3.515 3.515 . 0 0 "[ ]" 1
992 1 44 VAL HA 1 47 MET QB 3.040 . 4.380 3.218 3.218 3.218 . 0 0 "[ ]" 1
993 1 44 VAL HA 1 46 ARG H 3.360 . 5.020 4.841 4.841 4.841 . 0 0 "[ ]" 1
994 1 44 VAL HA 1 44 VAL HB 2.670 . 3.640 3.036 3.036 3.036 . 0 0 "[ ]" 1
995 1 44 VAL HB 1 45 MET H 2.400 . 3.110 2.829 2.829 2.829 . 0 0 "[ ]" 1
996 1 27 PHE HA 1 44 VAL MG2 3.810 . 5.910 4.076 4.076 4.076 . 0 0 "[ ]" 1
997 1 27 PHE HB2 1 44 VAL MG2 3.480 . 5.260 2.427 2.427 2.427 . 0 0 "[ ]" 1
998 1 27 PHE HB3 1 44 VAL MG2 3.350 . 5.000 2.390 2.390 2.390 . 0 0 "[ ]" 1
999 1 44 VAL HA 1 44 VAL MG2 2.500 . 3.310 2.318 2.318 2.318 . 0 0 "[ ]" 1
1000 1 44 VAL HB 1 44 VAL MG2 2.420 . 3.150 2.117 2.117 2.117 . 0 0 "[ ]" 1
1001 1 41 LEU HA 1 44 VAL MG1 3.850 . 6.000 3.920 3.920 3.920 . 0 0 "[ ]" 1
1002 1 64 VAL HA 1 64 VAL HB 2.670 . 3.630 2.435 2.435 2.435 . 0 0 "[ ]" 1
1003 1 64 VAL HA 1 64 VAL MG1 3.280 . 4.860 2.354 2.354 2.354 . 0 0 "[ ]" 1
1004 1 64 VAL MG1 1 65 ASP H 3.850 . 6.000 3.794 3.794 3.794 . 0 0 "[ ]" 1
1005 1 61 ILE H 1 64 VAL MG1 3.720 . 5.740 4.769 4.769 4.769 . 0 0 "[ ]" 1
1006 1 64 VAL H 1 64 VAL MG1 3.760 . 5.820 2.071 2.071 2.071 . 0 0 "[ ]" 1
1007 1 64 VAL MG2 1 76 GLU HA 3.850 . 6.000 4.125 4.125 4.125 . 0 0 "[ ]" 1
1008 1 64 VAL MG2 1 80 MET H 3.850 . 6.000 4.874 4.874 4.874 . 0 0 "[ ]" 1
1009 1 72 VAL HA 1 72 VAL HB 2.690 . 3.680 3.029 3.029 3.029 . 0 0 "[ ]" 1
1010 1 72 VAL HA 1 72 VAL MG2 3.060 . 4.420 2.293 2.293 2.293 . 0 0 "[ ]" 1
1011 1 72 VAL HA 1 72 VAL MG1 2.630 . 3.560 2.499 2.499 2.499 . 0 0 "[ ]" 1
1012 1 36 ILE H 1 72 VAL MG2 3.850 . 6.000 5.008 5.008 5.008 . 0 0 "[ ]" 1
1013 1 72 VAL MG1 1 77 PHE QB 3.000 . 4.290 2.455 2.455 2.455 . 0 0 "[ ]" 1
1014 1 72 VAL MG1 1 80 MET H 3.850 . 6.000 4.182 4.182 4.182 . 0 0 "[ ]" 1
1015 1 72 VAL MG1 1 72 VAL MG2 2.580 . 3.470 2.032 2.032 2.032 . 0 0 "[ ]" 1
1016 1 79 VAL HA 1 79 VAL HB 2.710 . 3.720 3.038 3.038 3.038 . 0 0 "[ ]" 1
1017 1 79 VAL HA 1 79 VAL MG1 2.610 . 3.530 2.372 2.372 2.372 . 0 0 "[ ]" 1
1018 1 79 VAL HA 1 82 VAL HB 2.640 . 3.580 2.758 2.758 2.758 . 0 0 "[ ]" 1
1019 1 79 VAL HA 1 82 VAL MG2 2.520 . 3.340 2.573 2.573 2.573 . 0 0 "[ ]" 1
1020 1 76 GLU HA 1 79 VAL HB 2.470 . 3.240 2.304 2.304 2.304 . 0 0 "[ ]" 1
1021 1 79 VAL HB 1 80 MET H 2.440 . 3.170 2.939 2.939 2.939 . 0 0 "[ ]" 1
1022 1 79 VAL HB 1 79 VAL MG2 2.460 . 3.230 2.150 2.150 2.150 . 0 0 "[ ]" 1
1023 1 5 TYR HB2 1 79 VAL MG1 3.130 . 4.560 2.957 2.957 2.957 . 0 0 "[ ]" 1
1024 1 5 TYR HB3 1 79 VAL MG1 3.450 . 5.200 2.175 2.175 2.175 . 0 0 "[ ]" 1
1025 1 79 VAL MG2 1 80 MET H 3.190 . 4.680 3.913 3.913 3.913 . 0 0 "[ ]" 1
1026 1 79 VAL HA 1 79 VAL MG2 2.440 . 3.190 2.376 2.376 2.376 . 0 0 "[ ]" 1
1027 1 5 TYR HB2 1 79 VAL MG2 2.930 . 4.160 2.374 2.374 2.374 . 0 0 "[ ]" 1
1028 1 5 TYR HB3 1 79 VAL MG2 3.110 . 4.520 2.376 2.376 2.376 . 0 0 "[ ]" 1
1029 1 82 VAL HA 1 85 MET H 3.770 . 5.830 3.801 3.801 3.801 . 0 0 "[ ]" 1
1030 1 82 VAL HA 1 82 VAL MG1 3.020 . 4.330 2.468 2.468 2.468 . 0 0 "[ ]" 1
1031 1 82 VAL HA 1 82 VAL MG2 3.580 . 5.460 2.147 2.147 2.147 . 0 0 "[ ]" 1
1032 1 82 VAL HB 1 82 VAL MG2 2.460 . 3.210 2.140 2.140 2.140 . 0 0 "[ ]" 1
1033 1 8 ALA HA 1 82 VAL MG1 3.850 . 6.000 4.208 4.208 4.208 . 0 0 "[ ]" 1
1034 1 8 ALA MB 1 82 VAL MG1 2.910 . 4.120 1.747 1.747 1.747 . 0 0 "[ ]" 1
1035 1 79 VAL HA 1 82 VAL MG1 3.850 . 6.000 4.031 4.031 4.031 . 0 0 "[ ]" 1
1036 1 82 VAL HB 1 82 VAL MG1 2.430 . 3.160 2.117 2.117 2.117 . 0 0 "[ ]" 1
1037 1 9 VAL HA 1 82 VAL MG2 2.930 . 4.160 3.370 3.370 3.370 . 0 0 "[ ]" 1
1038 1 5 TYR HA 1 82 VAL MG2 3.340 . 4.980 2.562 2.562 2.562 . 0 0 "[ ]" 1
1039 1 5 TYR HB2 1 82 VAL MG2 3.690 . 5.680 3.901 3.901 3.901 . 0 0 "[ ]" 1
1040 1 5 TYR HB3 1 82 VAL MG2 3.370 . 5.040 2.718 2.718 2.718 . 0 0 "[ ]" 1
1041 1 8 ALA MB 1 9 VAL HA 3.410 . 5.120 3.914 3.914 3.914 . 0 0 "[ ]" 1
1042 1 9 VAL HA 1 9 VAL HB 2.670 . 3.640 3.033 3.033 3.033 . 0 0 "[ ]" 1
1043 1 9 VAL HB 1 10 GLU H 2.580 . 3.460 2.674 2.674 2.674 . 0 0 "[ ]" 1
1044 1 6 LYS HA 1 9 VAL HB 2.750 . 3.800 2.501 2.501 2.501 . 0 0 "[ ]" 1
1045 1 6 LYS HA 1 9 VAL MG2 2.790 . 3.870 3.211 3.211 3.211 . 0 0 "[ ]" 1
1046 1 9 VAL MG2 1 78 LEU HA 2.720 . 3.740 3.128 3.128 3.128 . 0 0 "[ ]" 1
1047 1 9 VAL MG2 1 79 VAL HA 2.680 . 3.660 3.051 3.051 3.051 . 0 0 "[ ]" 1
1048 1 9 VAL HA 1 9 VAL MG2 2.520 . 3.340 2.243 2.243 2.243 . 0 0 "[ ]" 1
1049 1 9 VAL HB 1 9 VAL MG2 2.430 . 3.160 2.111 2.111 2.111 . 0 0 "[ ]" 1
1050 1 9 VAL H 1 9 VAL MG2 2.290 . 2.890 2.415 2.415 2.415 . 0 0 "[ ]" 1
1051 1 5 TYR HB2 1 9 VAL MG2 3.290 . 4.880 4.064 4.064 4.064 . 0 0 "[ ]" 1
1052 1 5 TYR HB3 1 9 VAL MG2 3.260 . 4.820 3.358 3.358 3.358 . 0 0 "[ ]" 1
1053 1 5 TYR HA 1 82 VAL MG1 3.500 . 5.290 1.831 1.831 1.831 . 0 0 "[ ]" 1
1054 1 5 TYR HA 1 5 TYR HB2 2.660 . 3.620 3.030 3.030 3.030 . 0 0 "[ ]" 1
1055 1 5 TYR QD 1 8 ALA MB 3.850 . 6.000 4.427 4.427 4.427 . 0 0 "[ ]" 1
1056 1 74 PHE QD 1 75 ASP HA 3.850 . 6.000 4.305 4.305 4.305 . 0 0 "[ ]" 1
1057 1 20 PHE HA 1 20 PHE QD 3.530 . 5.360 1.934 1.934 1.934 . 0 0 "[ ]" 1
1058 1 17 LYS HA 1 20 PHE QD 3.850 . 6.000 2.799 2.799 2.799 . 0 0 "[ ]" 1
1059 1 24 PHE HA 1 24 PHE QD 3.850 . 6.000 3.142 3.142 3.142 . 0 0 "[ ]" 1
1060 1 24 PHE HA 1 24 PHE QE 3.850 . 6.000 4.852 4.852 4.852 . 0 0 "[ ]" 1
1061 1 24 PHE QE 1 28 VAL MG1 3.850 . 6.000 3.241 3.241 3.241 . 0 0 "[ ]" 1
1062 1 24 PHE QE 1 28 VAL MG2 3.850 . 6.000 2.652 2.652 2.652 . 0 0 "[ ]" 1
1063 1 27 PHE HA 1 27 PHE QD 3.590 . 5.480 2.239 2.239 2.239 . 0 0 "[ ]" 1
1064 1 27 PHE QD 1 44 VAL MG2 3.850 . 6.000 2.135 2.135 2.135 . 0 0 "[ ]" 1
1065 1 24 PHE QE 1 74 PHE HA 3.850 . 6.000 4.409 4.409 4.409 . 0 0 "[ ]" 1
1066 1 74 PHE HA 1 74 PHE QD 3.530 . 5.360 2.279 2.279 2.279 . 0 0 "[ ]" 1
1067 1 74 PHE HA 1 77 PHE QD 3.850 . 6.000 3.902 3.902 3.902 . 0 0 "[ ]" 1
1068 1 77 PHE HA 1 77 PHE QD 3.690 . 5.670 2.010 2.010 2.010 . 0 0 "[ ]" 1
1069 1 77 PHE QD 1 78 LEU MD2 3.850 . 6.000 2.255 2.255 2.255 . 0 0 "[ ]" 1
1070 1 26 ILE MD 1 27 PHE QE 3.850 . 6.000 4.036 4.036 4.036 . 0 0 "[ ]" 1
1071 1 24 PHE QD 1 36 ILE MD 3.850 . 6.000 1.986 1.986 1.986 . 0 0 "[ ]" 1
1072 1 24 PHE QE 1 36 ILE MD 3.850 . 6.000 3.551 3.551 3.551 . 0 0 "[ ]" 1
1073 1 36 ILE MD 1 77 PHE QD 3.850 . 6.000 3.320 3.320 3.320 . 0 0 "[ ]" 1
1074 1 36 ILE MD 1 77 PHE QE 3.850 . 6.000 3.577 3.577 3.577 . 0 0 "[ ]" 1
1075 1 4 ILE MD 1 5 TYR QD 3.850 . 6.000 4.052 4.052 4.052 . 0 0 "[ ]" 1
1076 1 4 ILE MD 1 5 TYR QE 3.850 . 6.000 3.059 3.059 3.059 . 0 0 "[ ]" 1
1077 1 4 ILE QG 1 5 TYR QE 3.850 . 6.000 4.274 4.274 4.274 . 0 0 "[ ]" 1
1078 1 4 ILE MG 1 5 TYR QD 3.850 . 6.000 3.701 3.701 3.701 . 0 0 "[ ]" 1
1079 1 4 ILE MG 1 5 TYR QE 3.850 . 6.000 3.322 3.322 3.322 . 0 0 "[ ]" 1
1080 1 21 LYS QE 1 74 PHE QD 3.850 . 6.000 4.013 4.013 4.013 . 0 0 "[ ]" 1
1081 1 12 LEU MD2 1 20 PHE QD 3.850 . 6.000 3.923 3.923 3.923 . 0 0 "[ ]" 1
1082 1 12 LEU MD2 1 20 PHE QE 3.850 . 6.000 2.721 2.721 2.721 . 0 0 "[ ]" 1
1083 1 12 LEU MD1 1 20 PHE QD 3.850 . 6.000 2.601 2.601 2.601 . 0 0 "[ ]" 1
1084 1 12 LEU MD1 1 20 PHE QE 3.850 . 6.000 2.810 2.810 2.810 . 0 0 "[ ]" 1
1085 1 41 LEU MD1 1 77 PHE QD 3.850 . 6.000 2.825 2.825 2.825 . 0 0 "[ ]" 1
1086 1 20 PHE QD 1 48 LEU MD2 3.850 . 6.000 2.814 2.814 2.814 . 0 0 "[ ]" 1
1087 1 27 PHE QE 1 48 LEU MD2 3.850 . 6.000 4.249 4.249 4.249 . 0 0 "[ ]" 1
1088 1 48 LEU MD2 1 77 PHE QE 3.850 . 6.000 4.250 4.250 4.250 . 0 0 "[ ]" 1
1089 1 77 PHE QD 1 78 LEU HA 3.850 . 6.000 4.216 4.216 4.216 . 0 0 "[ ]" 1
1090 1 74 PHE QE 1 78 LEU HB3 3.850 . 6.000 5.338 5.338 5.338 . 0 0 "[ ]" 1
1091 1 74 PHE QD 1 78 LEU MD1 3.850 . 6.000 3.271 3.271 3.271 . 0 0 "[ ]" 1
1092 1 74 PHE QD 1 78 LEU MD2 3.850 . 6.000 3.684 3.684 3.684 . 0 0 "[ ]" 1
1093 1 27 PHE QD 1 47 MET ME 3.850 . 6.000 3.651 3.651 3.651 . 0 0 "[ ]" 1
1094 1 27 PHE QE 1 47 MET ME 3.850 . 6.000 1.700 1.700 1.700 0.000 1 0 "[ ]" 1
1095 1 77 PHE QD 1 80 MET ME 3.850 . 6.000 3.499 3.499 3.499 . 0 0 "[ ]" 1
1096 1 77 PHE QE 1 80 MET ME 3.850 . 6.000 3.752 3.752 3.752 . 0 0 "[ ]" 1
1097 1 20 PHE QD 1 81 MET ME 3.850 . 6.000 3.182 3.182 3.182 . 0 0 "[ ]" 1
1098 1 77 PHE QD 1 81 MET ME 3.850 . 6.000 4.292 4.292 4.292 . 0 0 "[ ]" 1
1099 1 5 TYR QE 1 83 ARG QD 3.850 . 6.000 2.450 2.450 2.450 . 0 0 "[ ]" 1
1100 1 24 PHE QE 1 35 SER HA 3.850 . 6.000 1.923 1.923 1.923 . 0 0 "[ ]" 1
1101 1 24 PHE QD 1 28 VAL MG2 3.850 . 6.000 2.975 2.975 2.975 . 0 0 "[ ]" 1
1102 1 27 PHE QE 1 44 VAL HA 3.850 . 6.000 3.120 3.120 3.120 . 0 0 "[ ]" 1
1103 1 44 VAL HA 1 77 PHE QE 3.850 . 6.000 5.311 5.311 5.311 . 0 0 "[ ]" 1
1104 1 72 VAL MG1 1 77 PHE QD 3.850 . 6.000 2.433 2.433 2.433 . 0 0 "[ ]" 1
1105 1 72 VAL MG1 1 77 PHE QE 3.850 . 6.000 4.365 4.365 4.365 . 0 0 "[ ]" 1
1106 1 5 TYR QD 1 82 VAL MG1 3.850 . 6.000 2.168 2.168 2.168 . 0 0 "[ ]" 1
1107 1 5 TYR HA 1 5 TYR QD 3.470 . 5.240 2.791 2.791 2.791 . 0 0 "[ ]" 1
1108 1 5 TYR HA 1 5 TYR QE 3.850 . 6.000 4.674 4.674 4.674 . 0 0 "[ ]" 1
1109 1 5 TYR QD 1 82 VAL MG2 3.850 . 6.000 3.570 3.570 3.570 . 0 0 "[ ]" 1
1110 1 5 TYR QE 1 83 ARG HA 3.850 . 6.000 5.121 5.121 5.121 . 0 0 "[ ]" 1
1111 1 11 GLN HB3 1 11 GLN HE22 3.850 . 6.000 4.751 4.751 4.751 . 0 0 "[ ]" 1
1112 1 8 ALA HA 1 11 GLN HE21 3.850 . 6.000 5.007 5.007 5.007 . 0 0 "[ ]" 1
1113 1 11 GLN HB2 1 11 GLN HE22 3.790 . 5.880 4.344 4.344 4.344 . 0 0 "[ ]" 1
1114 1 7 ALA MB 1 11 GLN HE22 3.850 . 6.000 4.078 4.078 4.078 . 0 0 "[ ]" 1
1115 1 8 ALA HA 1 11 GLN HE22 3.850 . 6.000 3.836 3.836 3.836 . 0 0 "[ ]" 1
1116 1 16 GLN QB 1 16 GLN HE22 3.850 . 6.000 3.675 3.675 3.675 . 0 0 "[ ]" 1
1117 1 18 ASN HD21 1 19 GLU H 3.850 . 6.000 4.608 4.608 4.608 . 0 0 "[ ]" 1
1118 1 14 GLU HA 1 18 ASN HD21 3.850 . 6.000 3.473 3.473 3.473 . 0 0 "[ ]" 1
1119 1 18 ASN HA 1 18 ASN HD21 3.850 . 6.000 4.168 4.168 4.168 . 0 0 "[ ]" 1
1120 1 14 GLU HA 1 18 ASN HD22 3.850 . 6.000 4.023 4.023 4.023 . 0 0 "[ ]" 1
1121 1 18 ASN HA 1 18 ASN HD22 3.850 . 6.000 4.345 4.345 4.345 . 0 0 "[ ]" 1
1122 1 16 GLN H 1 18 ASN HD21 3.850 . 6.000 4.901 4.901 4.901 . 0 0 "[ ]" 1
1123 1 50 GLN HE21 1 84 SER QB 3.850 . 6.000 4.785 4.785 4.785 . 0 0 "[ ]" 1
1124 1 50 GLN HA 1 50 GLN HE22 3.770 . 5.840 5.780 5.780 5.780 . 0 0 "[ ]" 1
1125 1 50 GLN HB2 1 50 GLN HE22 3.850 . 6.000 4.240 4.240 4.240 . 0 0 "[ ]" 1
1126 1 50 GLN HA 1 50 GLN HE21 3.850 . 6.000 5.174 5.174 5.174 . 0 0 "[ ]" 1
1127 1 58 GLN HA 1 58 GLN HE22 3.390 . 5.080 3.535 3.535 3.535 . 0 0 "[ ]" 1
1128 1 58 GLN HE22 1 61 ILE HB 3.640 . 5.580 4.086 4.086 4.086 . 0 0 "[ ]" 1
1129 1 58 GLN HE21 1 61 ILE HB 3.500 . 5.290 3.929 3.929 3.929 . 0 0 "[ ]" 1
1130 1 65 ASP OD2 1 70 GLY H 2.000 . 2.300 2.302 2.302 2.302 0.002 1 0 "[ ]" 1
1131 1 65 ASP OD2 1 70 GLY N 2.900 2.500 3.300 3.223 3.223 3.223 . 0 0 "[ ]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 1008
_Distance_constraint_stats_list.Viol_count 13
_Distance_constraint_stats_list.Viol_total 0.489
_Distance_constraint_stats_list.Viol_max 0.130
_Distance_constraint_stats_list.Viol_rms 0.0061
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0376
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 88 ASP 0.000 0.000 . 0 "[ ]"
1 89 SER 0.000 0.000 . 0 "[ ]"
1 90 LYS 0.000 0.000 . 0 "[ ]"
1 91 GLY 0.000 0.000 . 0 "[ ]"
1 92 LYS 0.000 0.000 . 0 "[ ]"
1 93 THR 0.111 0.111 1 0 "[ ]"
1 94 GLU 0.000 0.000 . 0 "[ ]"
1 95 GLU 0.000 0.000 . 0 "[ ]"
1 96 GLU 0.000 0.000 . 0 "[ ]"
1 97 LEU 0.000 0.000 . 0 "[ ]"
1 98 SER 0.000 0.000 . 0 "[ ]"
1 99 ASP 0.027 0.027 1 0 "[ ]"
1 100 LEU 0.000 0.000 . 0 "[ ]"
1 101 PHE 0.000 0.000 . 0 "[ ]"
1 102 ARG 0.000 0.000 . 0 "[ ]"
1 103 MET 0.027 0.027 1 0 "[ ]"
1 104 PHE 0.000 0.000 . 0 "[ ]"
1 105 ASP 0.010 0.010 1 0 "[ ]"
1 106 LYS 0.000 0.000 . 0 "[ ]"
1 107 ASN 0.033 0.033 1 0 "[ ]"
1 108 ALA 0.033 0.033 1 0 "[ ]"
1 109 ASP 0.000 0.000 . 0 "[ ]"
1 110 GLY 0.010 0.010 1 0 "[ ]"
1 111 TYR 0.000 0.000 . 0 "[ ]"
1 112 ILE 0.074 0.051 1 0 "[ ]"
1 113 ASP 0.004 0.004 1 0 "[ ]"
1 114 LEU 0.000 0.000 . 0 "[ ]"
1 115 GLU 0.000 0.000 . 0 "[ ]"
1 116 GLU 0.051 0.051 1 0 "[ ]"
1 117 LEU 0.059 0.037 1 0 "[ ]"
1 118 LYS 0.037 0.037 1 0 "[ ]"
1 119 ILE 0.000 0.000 . 0 "[ ]"
1 120 MET 0.000 0.000 . 0 "[ ]"
1 121 LEU 0.174 0.130 1 0 "[ ]"
1 122 GLN 0.003 0.003 1 0 "[ ]"
1 123 ALA 0.044 0.044 1 0 "[ ]"
1 124 THR 0.130 0.130 1 0 "[ ]"
1 125 GLY 0.000 0.000 . 0 "[ ]"
1 126 GLU 0.000 0.000 . 0 "[ ]"
1 127 THR 0.000 0.000 . 0 "[ ]"
1 128 ILE 0.000 0.000 . 0 "[ ]"
1 129 THR 0.000 0.000 . 0 "[ ]"
1 130 GLU 0.000 0.000 . 0 "[ ]"
1 131 ASP 0.000 0.000 . 0 "[ ]"
1 132 ASP 0.000 0.000 . 0 "[ ]"
1 133 ILE 0.000 0.000 . 0 "[ ]"
1 134 GLU 0.000 0.000 . 0 "[ ]"
1 135 GLU 0.000 0.000 . 0 "[ ]"
1 136 LEU 0.000 0.000 . 0 "[ ]"
1 137 MET 0.000 0.000 . 0 "[ ]"
1 138 LYS 0.000 0.000 . 0 "[ ]"
1 139 ASP 0.000 0.000 . 0 "[ ]"
1 140 GLY 0.000 0.000 . 0 "[ ]"
1 141 ASP 0.000 0.000 . 0 "[ ]"
1 142 LYS 0.000 0.000 . 0 "[ ]"
1 143 ASN 0.009 0.009 1 0 "[ ]"
1 144 ASN 0.009 0.009 1 0 "[ ]"
1 145 ASP 0.000 0.000 . 0 "[ ]"
1 146 GLY 0.000 0.000 . 0 "[ ]"
1 147 ARG 0.008 0.008 1 0 "[ ]"
1 148 ILE 0.012 0.008 1 0 "[ ]"
1 149 ASP 0.000 0.000 . 0 "[ ]"
1 150 TYR 0.000 0.000 . 0 "[ ]"
1 151 ASP 0.000 0.000 . 0 "[ ]"
1 152 GLU 0.000 0.000 . 0 "[ ]"
1 153 PHE 0.000 0.000 . 0 "[ ]"
1 154 LEU 0.000 0.000 . 0 "[ ]"
1 155 GLU 0.000 0.000 . 0 "[ ]"
1 156 PHE 0.000 0.000 . 0 "[ ]"
1 157 MET 0.000 0.000 . 0 "[ ]"
1 158 LYS 0.000 0.000 . 0 "[ ]"
1 159 GLY 0.000 0.000 . 0 "[ ]"
1 160 VAL 0.000 0.000 . 0 "[ ]"
1 161 GLU 0.000 0.000 . 0 "[ ]"
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 89 SER H 1 90 LYS H 2.740 . 3.780 2.362 2.362 2.362 . 0 0 "[ ]" 2
2 1 90 LYS H 1 90 LYS QD 3.850 . 6.000 3.962 3.962 3.962 . 0 0 "[ ]" 2
3 1 90 LYS H 1 90 LYS QB 3.580 . 5.460 2.419 2.419 2.419 . 0 0 "[ ]" 2
4 1 89 SER QB 1 90 LYS H 3.850 . 6.000 2.212 2.212 2.212 . 0 0 "[ ]" 2
5 1 88 ASP QB 1 90 LYS H 3.850 . 6.000 5.567 5.567 5.567 . 0 0 "[ ]" 2
6 1 90 LYS QB 1 91 GLY H 3.850 . 6.000 2.363 2.363 2.363 . 0 0 "[ ]" 2
7 1 90 LYS HA 1 91 GLY H 2.930 . 4.160 2.534 2.534 2.534 . 0 0 "[ ]" 2
8 1 92 LYS H 1 92 LYS HA 2.850 . 4.000 2.868 2.868 2.868 . 0 0 "[ ]" 2
9 1 93 THR H 1 96 GLU H 3.120 . 4.540 2.278 2.278 2.278 . 0 0 "[ ]" 2
10 1 93 THR H 1 94 GLU H 3.150 . 4.600 3.801 3.801 3.801 . 0 0 "[ ]" 2
11 1 93 THR H 1 93 THR HA 2.620 . 3.540 2.974 2.974 2.974 . 0 0 "[ ]" 2
12 1 93 THR H 1 93 THR HB 2.850 . 4.000 2.885 2.885 2.885 . 0 0 "[ ]" 2
13 1 93 THR H 1 93 THR MG 2.770 . 3.850 3.961 3.961 3.961 0.111 1 0 "[ ]" 2
14 1 92 LYS H 1 93 THR H 2.980 . 4.260 3.525 3.525 3.525 . 0 0 "[ ]" 2
15 1 92 LYS QB 1 93 THR H 3.070 . 4.440 4.020 4.020 4.020 . 0 0 "[ ]" 2
16 1 92 LYS HA 1 93 THR H 2.500 . 3.290 2.262 2.262 2.262 . 0 0 "[ ]" 2
17 1 92 LYS QG 1 93 THR H 3.120 . 4.540 3.408 3.408 3.408 . 0 0 "[ ]" 2
18 1 94 GLU H 1 97 LEU QD 3.850 . 6.000 4.207 4.207 4.207 . 0 0 "[ ]" 2
19 1 94 GLU H 1 94 GLU HA 2.850 . 4.000 2.890 2.890 2.890 . 0 0 "[ ]" 2
20 1 93 THR HB 1 94 GLU H 2.840 . 3.980 1.909 1.909 1.909 . 0 0 "[ ]" 2
21 1 94 GLU H 1 94 GLU QB 2.630 . 3.570 2.390 2.390 2.390 . 0 0 "[ ]" 2
22 1 93 THR HA 1 94 GLU H 2.540 . 3.380 3.262 3.262 3.262 . 0 0 "[ ]" 2
23 1 93 THR MG 1 94 GLU H 3.630 . 5.560 1.857 1.857 1.857 . 0 0 "[ ]" 2
24 1 94 GLU H 1 95 GLU H 2.900 . 4.100 2.567 2.567 2.567 . 0 0 "[ ]" 2
25 1 95 GLU H 1 96 GLU H 2.730 . 3.770 2.509 2.509 2.509 . 0 0 "[ ]" 2
26 1 93 THR HB 1 95 GLU H 2.760 . 3.820 2.892 2.892 2.892 . 0 0 "[ ]" 2
27 1 95 GLU H 1 95 GLU HA 2.810 . 3.920 2.922 2.922 2.922 . 0 0 "[ ]" 2
28 1 93 THR HA 1 95 GLU H 3.450 . 5.200 4.589 4.589 4.589 . 0 0 "[ ]" 2
29 1 93 THR MG 1 95 GLU H 3.850 . 6.000 3.977 3.977 3.977 . 0 0 "[ ]" 2
30 1 94 GLU HA 1 95 GLU H 2.910 . 4.120 3.498 3.498 3.498 . 0 0 "[ ]" 2
31 1 92 LYS HA 1 95 GLU H 3.850 . 6.000 5.246 5.246 5.246 . 0 0 "[ ]" 2
32 1 92 LYS HA 1 96 GLU H 3.780 . 5.860 3.523 3.523 3.523 . 0 0 "[ ]" 2
33 1 93 THR HA 1 96 GLU H 3.260 . 4.820 4.591 4.591 4.591 . 0 0 "[ ]" 2
34 1 96 GLU H 1 96 GLU QG 3.060 . 4.410 3.722 3.722 3.722 . 0 0 "[ ]" 2
35 1 94 GLU HA 1 96 GLU H 3.440 . 5.180 4.557 4.557 4.557 . 0 0 "[ ]" 2
36 1 96 GLU H 1 96 GLU HA 2.610 . 3.530 2.854 2.854 2.854 . 0 0 "[ ]" 2
37 1 96 GLU H 1 97 LEU H 2.510 . 3.320 2.684 2.684 2.684 . 0 0 "[ ]" 2
38 1 96 GLU H 1 98 SER H 3.470 . 5.240 4.418 4.418 4.418 . 0 0 "[ ]" 2
39 1 93 THR HB 1 96 GLU H 3.350 . 5.000 4.181 4.181 4.181 . 0 0 "[ ]" 2
40 1 96 GLU HA 1 97 LEU H 2.800 . 3.900 3.519 3.519 3.519 . 0 0 "[ ]" 2
41 1 97 LEU H 1 97 LEU HA 2.600 . 3.500 2.907 2.907 2.907 . 0 0 "[ ]" 2
42 1 97 LEU H 1 97 LEU HG 2.620 . 3.540 2.663 2.663 2.663 . 0 0 "[ ]" 2
43 1 97 LEU H 1 98 SER H 2.810 . 3.920 2.582 2.582 2.582 . 0 0 "[ ]" 2
44 1 96 GLU HB2 1 97 LEU H 2.680 . 3.660 3.252 3.252 3.252 . 0 0 "[ ]" 2
45 1 97 LEU H 1 97 LEU HB3 2.770 . 3.850 3.476 3.476 3.476 . 0 0 "[ ]" 2
46 1 94 GLU HA 1 97 LEU H 2.870 . 4.040 3.691 3.691 3.691 . 0 0 "[ ]" 2
47 1 98 SER H 1 99 ASP HB2 3.850 . 6.000 4.568 4.568 4.568 . 0 0 "[ ]" 2
48 1 97 LEU HB2 1 98 SER H 3.000 . 4.290 2.600 2.600 2.600 . 0 0 "[ ]" 2
49 1 96 GLU HA 1 98 SER H 3.760 . 5.820 4.594 4.594 4.594 . 0 0 "[ ]" 2
50 1 98 SER H 1 100 LEU H 3.710 . 5.710 4.261 4.261 4.261 . 0 0 "[ ]" 2
51 1 97 LEU HG 1 98 SER H 3.850 . 6.000 4.559 4.559 4.559 . 0 0 "[ ]" 2
52 1 98 SER H 1 99 ASP H 2.880 . 4.050 2.753 2.753 2.753 . 0 0 "[ ]" 2
53 1 97 LEU HB3 1 98 SER H 3.370 . 5.040 3.333 3.333 3.333 . 0 0 "[ ]" 2
54 1 98 SER H 1 150 TYR QE 3.850 . 6.000 2.886 2.886 2.886 . 0 0 "[ ]" 2
55 1 94 GLU HA 1 98 SER H 3.830 . 5.950 4.674 4.674 4.674 . 0 0 "[ ]" 2
56 1 99 ASP H 1 99 ASP HB3 2.810 . 3.920 3.510 3.510 3.510 . 0 0 "[ ]" 2
57 1 99 ASP H 1 99 ASP HB2 2.580 . 3.460 2.255 2.255 2.255 . 0 0 "[ ]" 2
58 1 99 ASP H 1 99 ASP HA 2.610 . 3.530 2.831 2.831 2.831 . 0 0 "[ ]" 2
59 1 99 ASP HB2 1 100 LEU H 2.850 . 4.000 2.478 2.478 2.478 . 0 0 "[ ]" 2
60 1 99 ASP HA 1 100 LEU H 3.030 . 4.360 3.583 3.583 3.583 . 0 0 "[ ]" 2
61 1 99 ASP HB3 1 100 LEU H 2.960 . 4.220 3.301 3.301 3.301 . 0 0 "[ ]" 2
62 1 100 LEU H 1 100 LEU QD 3.270 . 4.840 3.161 3.161 3.161 . 0 0 "[ ]" 2
63 1 100 LEU H 1 100 LEU QB 2.600 . 3.500 2.175 2.175 2.175 . 0 0 "[ ]" 2
64 1 100 LEU H 1 101 PHE H 2.580 . 3.460 2.781 2.781 2.781 . 0 0 "[ ]" 2
65 1 100 LEU H 1 100 LEU HA 2.610 . 3.520 2.825 2.825 2.825 . 0 0 "[ ]" 2
66 1 99 ASP H 1 100 LEU H 2.650 . 3.600 2.854 2.854 2.854 . 0 0 "[ ]" 2
67 1 101 PHE H 1 101 PHE QD 3.270 . 4.840 4.113 4.113 4.113 . 0 0 "[ ]" 2
68 1 101 PHE H 1 153 PHE QE 3.480 . 5.250 4.506 4.506 4.506 . 0 0 "[ ]" 2
69 1 101 PHE H 1 101 PHE QB 2.640 . 3.580 2.167 2.167 2.167 . 0 0 "[ ]" 2
70 1 101 PHE H 1 101 PHE HA 2.670 . 3.630 2.881 2.881 2.881 . 0 0 "[ ]" 2
71 1 101 PHE H 1 102 ARG H 2.710 . 3.710 2.817 2.817 2.817 . 0 0 "[ ]" 2
72 1 101 PHE H 1 104 PHE QD 3.660 . 5.620 4.744 4.744 4.744 . 0 0 "[ ]" 2
73 1 101 PHE H 1 150 TYR QE 3.850 . 6.000 5.315 5.315 5.315 . 0 0 "[ ]" 2
74 1 100 LEU QB 1 101 PHE H 2.890 . 4.080 2.697 2.697 2.697 . 0 0 "[ ]" 2
75 1 101 PHE H 1 153 PHE QD 3.850 . 6.000 5.346 5.346 5.346 . 0 0 "[ ]" 2
76 1 100 LEU QD 1 101 PHE H 3.850 . 6.000 4.141 4.141 4.141 . 0 0 "[ ]" 2
77 1 100 LEU HA 1 101 PHE H 3.400 . 5.100 3.546 3.546 3.546 . 0 0 "[ ]" 2
78 1 99 ASP HA 1 101 PHE H 3.540 . 5.370 4.162 4.162 4.162 . 0 0 "[ ]" 2
79 1 102 ARG H 1 104 PHE H 3.680 . 5.660 4.197 4.197 4.197 . 0 0 "[ ]" 2
80 1 98 SER QB 1 102 ARG H 3.850 . 6.000 5.214 5.214 5.214 . 0 0 "[ ]" 2
81 1 102 ARG H 1 102 ARG QG 3.240 . 4.780 3.895 3.895 3.895 . 0 0 "[ ]" 2
82 1 100 LEU H 1 102 ARG H 3.460 . 5.220 4.739 4.739 4.739 . 0 0 "[ ]" 2
83 1 101 PHE HA 1 102 ARG H 3.020 . 4.330 3.593 3.593 3.593 . 0 0 "[ ]" 2
84 1 101 PHE QD 1 102 ARG H 3.370 . 5.040 2.504 2.504 2.504 . 0 0 "[ ]" 2
85 1 99 ASP HA 1 102 ARG H 2.930 . 4.160 3.644 3.644 3.644 . 0 0 "[ ]" 2
86 1 98 SER HA 1 102 ARG H 3.330 . 4.960 4.451 4.451 4.451 . 0 0 "[ ]" 2
87 1 101 PHE QB 1 102 ARG H 2.950 . 4.200 2.178 2.178 2.178 . 0 0 "[ ]" 2
88 1 99 ASP HB3 1 102 ARG H 3.830 . 5.960 5.662 5.662 5.662 . 0 0 "[ ]" 2
89 1 102 ARG H 1 102 ARG HA 2.610 . 3.520 2.886 2.886 2.886 . 0 0 "[ ]" 2
90 1 100 LEU HA 1 102 ARG H 3.480 . 5.260 4.994 4.994 4.994 . 0 0 "[ ]" 2
91 1 103 MET H 1 104 PHE H 2.420 . 3.150 2.248 2.248 2.248 . 0 0 "[ ]" 2
92 1 100 LEU HA 1 104 PHE H 3.320 . 4.940 4.373 4.373 4.373 . 0 0 "[ ]" 2
93 1 104 PHE H 1 104 PHE HB2 2.520 . 3.330 2.229 2.229 2.229 . 0 0 "[ ]" 2
94 1 104 PHE H 1 105 ASP H 2.430 . 3.160 2.030 2.030 2.030 . 0 0 "[ ]" 2
95 1 104 PHE H 1 104 PHE HB3 2.790 . 3.870 3.471 3.471 3.471 . 0 0 "[ ]" 2
96 1 104 PHE H 1 104 PHE HA 2.480 . 3.270 2.999 2.999 2.999 . 0 0 "[ ]" 2
97 1 103 MET QB 1 104 PHE H 2.730 . 3.750 3.103 3.103 3.103 . 0 0 "[ ]" 2
98 1 101 PHE HA 1 104 PHE H 3.080 . 4.460 3.638 3.638 3.638 . 0 0 "[ ]" 2
99 1 104 PHE H 1 112 ILE MD 3.850 . 6.000 3.831 3.831 3.831 . 0 0 "[ ]" 2
100 1 102 ARG HA 1 105 ASP H 3.100 . 4.500 3.518 3.518 3.518 . 0 0 "[ ]" 2
101 1 105 ASP H 1 112 ILE MD 3.670 . 5.640 2.876 2.876 2.876 . 0 0 "[ ]" 2
102 1 105 ASP H 1 105 ASP HA 2.710 . 3.710 2.830 2.830 2.830 . 0 0 "[ ]" 2
103 1 105 ASP QB 1 106 LYS H 3.410 . 5.120 4.045 4.045 4.045 . 0 0 "[ ]" 2
104 1 106 LYS H 1 108 ALA H 3.520 . 5.340 3.802 3.802 3.802 . 0 0 "[ ]" 2
105 1 106 LYS H 1 106 LYS HA 2.810 . 3.920 2.856 2.856 2.856 . 0 0 "[ ]" 2
106 1 106 LYS H 1 116 GLU QB 2.880 . 4.050 2.760 2.760 2.760 . 0 0 "[ ]" 2
107 1 105 ASP HA 1 106 LYS H 2.380 . 3.050 2.361 2.361 2.361 . 0 0 "[ ]" 2
108 1 106 LYS H 1 116 GLU HA 3.650 . 5.600 4.224 4.224 4.224 . 0 0 "[ ]" 2
109 1 106 LYS H 1 116 GLU QG 3.730 . 5.760 3.254 3.254 3.254 . 0 0 "[ ]" 2
110 1 106 LYS H 1 107 ASN H 2.620 . 3.540 2.728 2.728 2.728 . 0 0 "[ ]" 2
111 1 106 LYS H 1 106 LYS QB 2.650 . 3.610 2.109 2.109 2.109 . 0 0 "[ ]" 2
112 1 106 LYS H 1 112 ILE HA 3.790 . 5.870 5.191 5.191 5.191 . 0 0 "[ ]" 2
113 1 106 LYS H 1 106 LYS QD 3.610 . 5.520 4.359 4.359 4.359 . 0 0 "[ ]" 2
114 1 106 LYS H 1 112 ILE MD 3.850 . 6.000 3.148 3.148 3.148 . 0 0 "[ ]" 2
115 1 107 ASN H 1 108 ALA MB 3.850 . 6.000 4.486 4.486 4.486 . 0 0 "[ ]" 2
116 1 107 ASN H 1 107 ASN HB3 2.870 . 4.040 2.208 2.208 2.208 . 0 0 "[ ]" 2
117 1 106 LYS QB 1 107 ASN H 3.380 . 5.050 2.527 2.527 2.527 . 0 0 "[ ]" 2
118 1 106 LYS HA 1 107 ASN H 2.950 . 4.200 3.572 3.572 3.572 . 0 0 "[ ]" 2
119 1 107 ASN H 1 107 ASN HB2 3.100 . 4.500 2.694 2.694 2.694 . 0 0 "[ ]" 2
120 1 106 LYS QD 1 107 ASN H 3.850 . 6.000 4.933 4.933 4.933 . 0 0 "[ ]" 2
121 1 105 ASP HA 1 107 ASN H 3.310 . 4.920 3.716 3.716 3.716 . 0 0 "[ ]" 2
122 1 107 ASN H 1 109 ASP H 3.390 . 5.080 4.886 4.886 4.886 . 0 0 "[ ]" 2
123 1 106 LYS QE 1 107 ASN H 3.850 . 6.000 5.058 5.058 5.058 . 0 0 "[ ]" 2
124 1 105 ASP QB 1 107 ASN H 3.570 . 5.440 4.725 4.725 4.725 . 0 0 "[ ]" 2
125 1 107 ASN H 1 116 GLU QB 3.080 . 4.460 3.495 3.495 3.495 . 0 0 "[ ]" 2
126 1 107 ASN H 1 112 ILE MG 3.230 . 4.760 4.013 4.013 4.013 . 0 0 "[ ]" 2
127 1 106 LYS QG 1 108 ALA H 3.850 . 6.000 5.372 5.372 5.372 . 0 0 "[ ]" 2
128 1 108 ALA H 1 108 ALA MB 3.330 . 4.950 2.699 2.699 2.699 . 0 0 "[ ]" 2
129 1 108 ALA H 1 108 ALA HA 2.350 . 3.000 2.374 2.374 2.374 . 0 0 "[ ]" 2
130 1 108 ALA H 1 109 ASP H 3.130 . 4.560 3.211 3.211 3.211 . 0 0 "[ ]" 2
131 1 108 ALA H 1 110 GLY H 3.850 . 6.000 4.852 4.852 4.852 . 0 0 "[ ]" 2
132 1 107 ASN HB2 1 108 ALA H 3.080 . 4.460 4.223 4.223 4.223 . 0 0 "[ ]" 2
133 1 105 ASP HA 1 108 ALA H 3.850 . 6.000 3.690 3.690 3.690 . 0 0 "[ ]" 2
134 1 108 ALA H 1 116 GLU QG 3.850 . 6.000 4.792 4.792 4.792 . 0 0 "[ ]" 2
135 1 106 LYS QB 1 108 ALA H 3.850 . 6.000 4.292 4.292 4.292 . 0 0 "[ ]" 2
136 1 109 ASP H 1 110 GLY QA 3.850 . 6.000 4.025 4.025 4.025 . 0 0 "[ ]" 2
137 1 109 ASP H 1 111 TYR QD 3.850 . 6.000 4.983 4.983 4.983 . 0 0 "[ ]" 2
138 1 109 ASP H 1 109 ASP QB 3.290 . 4.870 2.860 2.860 2.860 . 0 0 "[ ]" 2
139 1 108 ALA MB 1 109 ASP H 3.850 . 6.000 3.737 3.737 3.737 . 0 0 "[ ]" 2
140 1 109 ASP H 1 110 GLY H 2.600 . 3.500 2.012 2.012 2.012 . 0 0 "[ ]" 2
141 1 108 ALA HA 1 109 ASP H 2.670 . 3.630 2.595 2.595 2.595 . 0 0 "[ ]" 2
142 1 109 ASP H 1 111 TYR HA 3.850 . 6.000 5.582 5.582 5.582 . 0 0 "[ ]" 2
143 1 109 ASP QB 1 110 GLY H 3.400 . 5.090 3.929 3.929 3.929 . 0 0 "[ ]" 2
144 1 101 PHE HZ 1 110 GLY H 3.850 . 6.000 5.051 5.051 5.051 . 0 0 "[ ]" 2
145 1 101 PHE QE 1 110 GLY H 3.770 . 5.830 4.132 4.132 4.132 . 0 0 "[ ]" 2
146 1 109 ASP HA 1 110 GLY H 2.960 . 4.210 3.209 3.209 3.209 . 0 0 "[ ]" 2
147 1 110 GLY H 1 110 GLY QA 2.290 . 2.890 2.325 2.325 2.325 . 0 0 "[ ]" 2
148 1 110 GLY H 1 111 TYR H 2.360 . 3.030 2.758 2.758 2.758 . 0 0 "[ ]" 2
149 1 110 GLY H 1 111 TYR HA 3.790 . 5.870 4.935 4.935 4.935 . 0 0 "[ ]" 2
150 1 108 ALA MB 1 110 GLY H 3.850 . 6.000 4.554 4.554 4.554 . 0 0 "[ ]" 2
151 1 110 GLY H 1 111 TYR QD 3.850 . 6.000 4.136 4.136 4.136 . 0 0 "[ ]" 2
152 1 109 ASP HA 1 111 TYR H 3.340 . 4.980 4.394 4.394 4.394 . 0 0 "[ ]" 2
153 1 111 TYR H 1 111 TYR HA 2.790 . 3.880 3.000 3.000 3.000 . 0 0 "[ ]" 2
154 1 101 PHE HZ 1 111 TYR H 3.030 . 4.360 4.085 4.085 4.085 . 0 0 "[ ]" 2
155 1 110 GLY QA 1 111 TYR H 2.660 . 3.620 2.835 2.835 2.835 . 0 0 "[ ]" 2
156 1 111 TYR H 1 111 TYR QD 3.310 . 4.910 2.162 2.162 2.162 . 0 0 "[ ]" 2
157 1 111 TYR H 1 111 TYR HB3 2.790 . 3.870 3.762 3.762 3.762 . 0 0 "[ ]" 2
158 1 111 TYR H 1 111 TYR HB2 2.620 . 3.540 2.589 2.589 2.589 . 0 0 "[ ]" 2
159 1 109 ASP H 1 111 TYR H 2.830 . 3.950 3.175 3.175 3.175 . 0 0 "[ ]" 2
160 1 101 PHE QE 1 111 TYR H 3.410 . 5.120 4.574 4.574 4.574 . 0 0 "[ ]" 2
161 1 111 TYR H 1 112 ILE H 3.330 . 4.960 4.477 4.477 4.477 . 0 0 "[ ]" 2
162 1 111 TYR H 1 111 TYR QE 3.770 . 5.840 4.435 4.435 4.435 . 0 0 "[ ]" 2
163 1 112 ILE H 1 148 ILE MG 3.410 . 5.120 3.782 3.782 3.782 . 0 0 "[ ]" 2
164 1 112 ILE H 1 112 ILE QG 2.730 . 3.770 2.755 2.755 2.755 . 0 0 "[ ]" 2
165 1 111 TYR HB2 1 112 ILE H 2.770 . 3.840 3.492 3.492 3.492 . 0 0 "[ ]" 2
166 1 112 ILE H 1 147 ARG HB3 2.950 . 4.200 3.498 3.498 3.498 . 0 0 "[ ]" 2
167 1 112 ILE H 1 148 ILE H 2.620 . 3.540 1.869 1.869 1.869 . 0 0 "[ ]" 2
168 1 112 ILE H 1 112 ILE HB 2.400 . 3.090 2.711 2.711 2.711 . 0 0 "[ ]" 2
169 1 112 ILE H 1 148 ILE HB 2.720 . 3.740 3.137 3.137 3.137 . 0 0 "[ ]" 2
170 1 111 TYR HA 1 112 ILE H 2.300 . 2.900 2.543 2.543 2.543 . 0 0 "[ ]" 2
171 1 112 ILE H 1 113 ASP H 3.270 . 4.840 4.382 4.382 4.382 . 0 0 "[ ]" 2
172 1 101 PHE QE 1 112 ILE H 2.980 . 4.260 3.817 3.817 3.817 . 0 0 "[ ]" 2
173 1 111 TYR QD 1 112 ILE H 3.200 . 4.700 4.063 4.063 4.063 . 0 0 "[ ]" 2
174 1 111 TYR HB3 1 112 ILE H 2.640 . 3.580 2.436 2.436 2.436 . 0 0 "[ ]" 2
175 1 112 ILE H 1 112 ILE MD 3.830 . 5.960 4.295 4.295 4.295 . 0 0 "[ ]" 2
176 1 112 ILE H 1 147 ARG HA 3.120 . 4.540 3.619 3.619 3.619 . 0 0 "[ ]" 2
177 1 101 PHE HZ 1 112 ILE H 2.730 . 3.750 3.691 3.691 3.691 . 0 0 "[ ]" 2
178 1 113 ASP H 1 116 GLU HA 3.460 . 5.220 5.147 5.147 5.147 . 0 0 "[ ]" 2
179 1 113 ASP H 1 113 ASP HA 2.770 . 3.840 2.992 2.992 2.992 . 0 0 "[ ]" 2
180 1 112 ILE MD 1 113 ASP H 3.850 . 6.000 4.606 4.606 4.606 . 0 0 "[ ]" 2
181 1 113 ASP H 1 148 ILE H 3.270 . 4.840 4.844 4.844 4.844 0.004 1 0 "[ ]" 2
182 1 113 ASP H 1 116 GLU QB 2.550 . 3.400 2.346 2.346 2.346 . 0 0 "[ ]" 2
183 1 112 ILE HA 1 113 ASP H 2.370 . 3.040 2.225 2.225 2.225 . 0 0 "[ ]" 2
184 1 113 ASP H 1 116 GLU H 2.910 . 4.120 3.462 3.462 3.462 . 0 0 "[ ]" 2
185 1 113 ASP H 1 113 ASP HB2 3.020 . 4.340 3.595 3.595 3.595 . 0 0 "[ ]" 2
186 1 112 ILE QG 1 113 ASP H 3.190 . 4.680 4.256 4.256 4.256 . 0 0 "[ ]" 2
187 1 112 ILE MG 1 113 ASP H 2.860 . 4.020 2.511 2.511 2.511 . 0 0 "[ ]" 2
188 1 112 ILE HB 1 113 ASP H 3.160 . 4.620 4.039 4.039 4.039 . 0 0 "[ ]" 2
189 1 113 ASP H 1 114 LEU H 3.470 . 5.240 4.472 4.472 4.472 . 0 0 "[ ]" 2
190 1 114 LEU H 1 146 GLY QA 3.450 . 5.200 4.601 4.601 4.601 . 0 0 "[ ]" 2
191 1 114 LEU H 1 114 LEU HA 2.620 . 3.540 2.867 2.867 2.867 . 0 0 "[ ]" 2
192 1 113 ASP HA 1 114 LEU H 2.560 . 3.420 2.691 2.691 2.691 . 0 0 "[ ]" 2
193 1 113 ASP HB2 1 114 LEU H 2.560 . 3.430 2.086 2.086 2.086 . 0 0 "[ ]" 2
194 1 113 ASP HB3 1 114 LEU H 2.790 . 3.880 3.522 3.522 3.522 . 0 0 "[ ]" 2
195 1 114 LEU H 1 114 LEU QD 3.410 . 5.120 3.586 3.586 3.586 . 0 0 "[ ]" 2
196 1 115 GLU H 1 116 GLU H 2.440 . 3.190 2.735 2.735 2.735 . 0 0 "[ ]" 2
197 1 115 GLU H 1 117 LEU H 3.140 . 4.580 4.443 4.443 4.443 . 0 0 "[ ]" 2
198 1 114 LEU H 1 115 GLU H 2.760 . 3.820 2.724 2.724 2.724 . 0 0 "[ ]" 2
199 1 113 ASP HA 1 115 GLU H 3.640 . 5.580 4.744 4.744 4.744 . 0 0 "[ ]" 2
200 1 114 LEU QB 1 115 GLU H 2.790 . 3.880 2.536 2.536 2.536 . 0 0 "[ ]" 2
201 1 115 GLU H 1 115 GLU QB 2.580 . 3.470 2.071 2.071 2.071 . 0 0 "[ ]" 2
202 1 114 LEU QD 1 115 GLU H 3.750 . 5.790 3.694 3.694 3.694 . 0 0 "[ ]" 2
203 1 113 ASP HB2 1 115 GLU H 3.480 . 5.250 3.069 3.069 3.069 . 0 0 "[ ]" 2
204 1 115 GLU H 1 115 GLU HA 2.610 . 3.520 2.835 2.835 2.835 . 0 0 "[ ]" 2
205 1 113 ASP HB3 1 115 GLU H 3.490 . 5.280 4.666 4.666 4.666 . 0 0 "[ ]" 2
206 1 116 GLU H 1 118 LYS H 3.280 . 4.860 3.877 3.877 3.877 . 0 0 "[ ]" 2
207 1 116 GLU H 1 119 ILE MD 3.850 . 6.000 5.002 5.002 5.002 . 0 0 "[ ]" 2
208 1 115 GLU HA 1 116 GLU H 2.930 . 4.160 3.515 3.515 3.515 . 0 0 "[ ]" 2
209 1 112 ILE HA 1 116 GLU H 3.640 . 5.580 5.288 5.288 5.288 . 0 0 "[ ]" 2
210 1 112 ILE MG 1 116 GLU H 3.480 . 5.260 3.519 3.519 3.519 . 0 0 "[ ]" 2
211 1 115 GLU QB 1 116 GLU H 2.730 . 3.760 2.845 2.845 2.845 . 0 0 "[ ]" 2
212 1 116 GLU H 1 117 LEU H 2.510 . 3.320 2.464 2.464 2.464 . 0 0 "[ ]" 2
213 1 116 GLU H 1 116 GLU HA 2.830 . 3.970 2.946 2.946 2.946 . 0 0 "[ ]" 2
214 1 116 GLU H 1 116 GLU QB 2.520 . 3.340 2.217 2.217 2.217 . 0 0 "[ ]" 2
215 1 115 GLU QB 1 117 LEU H 3.850 . 6.000 4.927 4.927 4.927 . 0 0 "[ ]" 2
216 1 117 LEU H 1 118 LYS H 2.830 . 3.970 2.733 2.733 2.733 . 0 0 "[ ]" 2
217 1 116 GLU QB 1 117 LEU H 2.810 . 3.910 2.440 2.440 2.440 . 0 0 "[ ]" 2
218 1 117 LEU H 1 117 LEU HB3 2.750 . 3.790 2.505 2.505 2.505 . 0 0 "[ ]" 2
219 1 114 LEU H 1 117 LEU H 3.310 . 4.920 4.853 4.853 4.853 . 0 0 "[ ]" 2
220 1 116 GLU QG 1 117 LEU H 3.610 . 5.520 4.111 4.111 4.111 . 0 0 "[ ]" 2
221 1 116 GLU HA 1 117 LEU H 3.330 . 4.960 3.582 3.582 3.582 . 0 0 "[ ]" 2
222 1 117 LEU H 1 119 ILE H 3.650 . 5.600 4.250 4.250 4.250 . 0 0 "[ ]" 2
223 1 112 ILE HB 1 117 LEU H 3.400 . 5.090 5.112 5.112 5.112 0.022 1 0 "[ ]" 2
224 1 117 LEU H 1 118 LYS HA 3.520 . 5.330 5.367 5.367 5.367 0.037 1 0 "[ ]" 2
225 1 118 LYS H 1 119 ILE H 3.140 . 4.580 2.709 2.709 2.709 . 0 0 "[ ]" 2
226 1 118 LYS H 1 118 LYS QE 3.850 . 6.000 4.757 4.757 4.757 . 0 0 "[ ]" 2
227 1 115 GLU HA 1 119 ILE H 3.850 . 6.000 5.207 5.207 5.207 . 0 0 "[ ]" 2
228 1 119 ILE H 1 119 ILE MD 3.480 . 5.260 3.589 3.589 3.589 . 0 0 "[ ]" 2
229 1 119 ILE H 1 119 ILE QG 2.830 . 3.960 2.080 2.080 2.080 . 0 0 "[ ]" 2
230 1 119 ILE H 1 119 ILE MG 3.850 . 6.000 3.711 3.711 3.711 . 0 0 "[ ]" 2
231 1 119 ILE H 1 120 MET H 2.750 . 3.790 2.472 2.472 2.472 . 0 0 "[ ]" 2
232 1 116 GLU HA 1 119 ILE H 3.450 . 5.200 3.522 3.522 3.522 . 0 0 "[ ]" 2
233 1 120 MET H 1 120 MET HA 2.610 . 3.530 2.840 2.840 2.840 . 0 0 "[ ]" 2
234 1 120 MET H 1 121 LEU H 2.560 . 3.410 2.758 2.758 2.758 . 0 0 "[ ]" 2
235 1 117 LEU HA 1 120 MET H 3.270 . 4.840 3.194 3.194 3.194 . 0 0 "[ ]" 2
236 1 119 ILE MD 1 120 MET H 3.850 . 6.000 4.588 4.588 4.588 . 0 0 "[ ]" 2
237 1 121 LEU H 1 122 GLN H 2.600 . 3.500 2.498 2.498 2.498 . 0 0 "[ ]" 2
238 1 121 LEU H 1 121 LEU QD 2.990 . 4.280 2.878 2.878 2.878 . 0 0 "[ ]" 2
239 1 121 LEU H 1 121 LEU HA 2.610 . 3.530 2.908 2.908 2.908 . 0 0 "[ ]" 2
240 1 121 LEU HB2 1 122 GLN H 2.880 . 4.050 2.686 2.686 2.686 . 0 0 "[ ]" 2
241 1 122 GLN H 1 122 GLN HE22 3.510 . 5.320 5.323 5.323 5.323 0.003 1 0 "[ ]" 2
242 1 122 GLN H 1 122 GLN QG 2.710 . 3.710 3.303 3.303 3.303 . 0 0 "[ ]" 2
243 1 122 GLN H 1 122 GLN HA 2.730 . 3.750 2.876 2.876 2.876 . 0 0 "[ ]" 2
244 1 122 GLN H 1 124 THR H 3.120 . 4.540 3.929 3.929 3.929 . 0 0 "[ ]" 2
245 1 122 GLN H 1 122 GLN QB 2.880 . 4.060 1.930 1.930 1.930 . 0 0 "[ ]" 2
246 1 121 LEU HA 1 123 ALA H 3.600 . 5.500 3.972 3.972 3.972 . 0 0 "[ ]" 2
247 1 121 LEU HB2 1 123 ALA H 3.250 . 4.800 4.844 4.844 4.844 0.044 1 0 "[ ]" 2
248 1 123 ALA H 1 123 ALA MB 2.440 . 3.190 1.944 1.944 1.944 . 0 0 "[ ]" 2
249 1 104 PHE QD 1 123 ALA H 3.850 . 6.000 5.355 5.355 5.355 . 0 0 "[ ]" 2
250 1 123 ALA H 1 124 THR H 2.600 . 3.500 2.458 2.458 2.458 . 0 0 "[ ]" 2
251 1 122 GLN QG 1 123 ALA H 3.570 . 5.440 4.458 4.458 4.458 . 0 0 "[ ]" 2
252 1 122 GLN QB 1 123 ALA H 2.910 . 4.120 2.866 2.866 2.866 . 0 0 "[ ]" 2
253 1 123 ALA H 1 123 ALA HA 2.610 . 3.530 2.917 2.917 2.917 . 0 0 "[ ]" 2
254 1 123 ALA H 1 124 THR MG 3.850 . 6.000 4.459 4.459 4.459 . 0 0 "[ ]" 2
255 1 120 MET HA 1 123 ALA H 3.170 . 4.640 3.654 3.654 3.654 . 0 0 "[ ]" 2
256 1 122 GLN HA 1 123 ALA H 2.760 . 3.820 3.498 3.498 3.498 . 0 0 "[ ]" 2
257 1 119 ILE HA 1 123 ALA H 3.330 . 4.950 4.444 4.444 4.444 . 0 0 "[ ]" 2
258 1 119 ILE MG 1 123 ALA H 3.850 . 6.000 4.111 4.111 4.111 . 0 0 "[ ]" 2
259 1 122 GLN H 1 123 ALA H 2.550 . 3.400 2.552 2.552 2.552 . 0 0 "[ ]" 2
260 1 121 LEU H 1 123 ALA H 3.500 . 5.300 4.004 4.004 4.004 . 0 0 "[ ]" 2
261 1 121 LEU HB2 1 124 THR H 3.370 . 5.040 5.170 5.170 5.170 0.130 1 0 "[ ]" 2
262 1 121 LEU MD2 1 124 THR H 3.850 . 6.000 4.922 4.922 4.922 . 0 0 "[ ]" 2
263 1 123 ALA HA 1 124 THR H 2.790 . 3.870 3.431 3.431 3.431 . 0 0 "[ ]" 2
264 1 123 ALA MB 1 124 THR H 3.100 . 4.500 3.043 3.043 3.043 . 0 0 "[ ]" 2
265 1 121 LEU HA 1 124 THR H 3.230 . 4.760 3.334 3.334 3.334 . 0 0 "[ ]" 2
266 1 124 THR H 1 124 THR MG 3.180 . 4.660 3.233 3.233 3.233 . 0 0 "[ ]" 2
267 1 122 GLN HA 1 124 THR H 3.540 . 5.380 3.728 3.728 3.728 . 0 0 "[ ]" 2
268 1 122 GLN QB 1 125 GLY H 3.850 . 6.000 4.782 4.782 4.782 . 0 0 "[ ]" 2
269 1 123 ALA MB 1 125 GLY H 3.850 . 6.000 4.621 4.621 4.621 . 0 0 "[ ]" 2
270 1 124 THR MG 1 125 GLY H 3.850 . 6.000 4.361 4.361 4.361 . 0 0 "[ ]" 2
271 1 125 GLY H 1 125 GLY QA 2.560 . 3.410 2.500 2.500 2.500 . 0 0 "[ ]" 2
272 1 124 THR HA 1 125 GLY H 3.050 . 4.400 3.128 3.128 3.128 . 0 0 "[ ]" 2
273 1 124 THR H 1 125 GLY H 2.880 . 4.050 2.142 2.142 2.142 . 0 0 "[ ]" 2
274 1 122 GLN QG 1 125 GLY H 3.500 . 5.300 4.786 4.786 4.786 . 0 0 "[ ]" 2
275 1 126 GLU H 1 126 GLU HB3 3.170 . 4.630 3.537 3.537 3.537 . 0 0 "[ ]" 2
276 1 125 GLY QA 1 126 GLU H 2.980 . 4.260 2.315 2.315 2.315 . 0 0 "[ ]" 2
277 1 126 GLU HB3 1 127 THR H 3.450 . 5.200 2.027 2.027 2.027 . 0 0 "[ ]" 2
278 1 127 THR H 1 127 THR MG 3.750 . 5.800 2.751 2.751 2.751 . 0 0 "[ ]" 2
279 1 128 ILE H 1 133 ILE QG 3.850 . 6.000 4.902 4.902 4.902 . 0 0 "[ ]" 2
280 1 126 GLU HB3 1 128 ILE H 3.850 . 6.000 5.494 5.494 5.494 . 0 0 "[ ]" 2
281 1 128 ILE H 1 128 ILE QG 3.410 . 5.120 2.711 2.711 2.711 . 0 0 "[ ]" 2
282 1 127 THR HA 1 128 ILE H 2.790 . 3.890 2.336 2.336 2.336 . 0 0 "[ ]" 2
283 1 128 ILE H 1 128 ILE MG 3.850 . 6.000 3.622 3.622 3.622 . 0 0 "[ ]" 2
284 1 128 ILE H 1 128 ILE HB 3.120 . 4.540 2.165 2.165 2.165 . 0 0 "[ ]" 2
285 1 128 ILE H 1 129 THR H 3.850 . 6.000 4.616 4.616 4.616 . 0 0 "[ ]" 2
286 1 127 THR HB 1 128 ILE H 3.620 . 5.540 4.114 4.114 4.114 . 0 0 "[ ]" 2
287 1 127 THR H 1 128 ILE H 3.850 . 6.000 4.057 4.057 4.057 . 0 0 "[ ]" 2
288 1 122 GLN QG 1 128 ILE H 3.850 . 6.000 3.843 3.843 3.843 . 0 0 "[ ]" 2
289 1 128 ILE HB 1 129 THR H 3.160 . 4.620 3.856 3.856 3.856 . 0 0 "[ ]" 2
290 1 128 ILE QG 1 129 THR H 3.480 . 5.250 4.197 4.197 4.197 . 0 0 "[ ]" 2
291 1 128 ILE MG 1 129 THR H 3.850 . 6.000 1.883 1.883 1.883 . 0 0 "[ ]" 2
292 1 129 THR H 1 132 ASP HB2 3.050 . 4.400 3.021 3.021 3.021 . 0 0 "[ ]" 2
293 1 129 THR H 1 129 THR MG 3.210 . 4.710 2.649 2.649 2.649 . 0 0 "[ ]" 2
294 1 129 THR H 1 133 ILE H 3.820 . 5.940 4.521 4.521 4.521 . 0 0 "[ ]" 2
295 1 129 THR H 1 132 ASP HB3 3.670 . 5.640 4.552 4.552 4.552 . 0 0 "[ ]" 2
296 1 129 THR H 1 132 ASP H 3.700 . 5.700 3.612 3.612 3.612 . 0 0 "[ ]" 2
297 1 130 GLU H 1 134 GLU QG 3.850 . 6.000 5.298 5.298 5.298 . 0 0 "[ ]" 2
298 1 130 GLU H 1 130 GLU HA 2.610 . 3.530 2.835 2.835 2.835 . 0 0 "[ ]" 2
299 1 130 GLU H 1 131 ASP H 2.740 . 3.780 2.723 2.723 2.723 . 0 0 "[ ]" 2
300 1 130 GLU H 1 130 GLU QB 2.610 . 3.530 2.504 2.504 2.504 . 0 0 "[ ]" 2
301 1 129 THR HA 1 130 GLU H 2.550 . 3.400 2.411 2.411 2.411 . 0 0 "[ ]" 2
302 1 130 GLU H 1 130 GLU QG 3.330 . 4.960 1.988 1.988 1.988 . 0 0 "[ ]" 2
303 1 129 THR MG 1 130 GLU H 3.620 . 5.540 3.655 3.655 3.655 . 0 0 "[ ]" 2
304 1 130 GLU H 1 133 ILE MD 3.850 . 6.000 4.268 4.268 4.268 . 0 0 "[ ]" 2
305 1 131 ASP H 1 131 ASP QB 2.660 . 3.620 2.082 2.082 2.082 . 0 0 "[ ]" 2
306 1 129 THR H 1 131 ASP H 3.270 . 4.830 4.427 4.427 4.427 . 0 0 "[ ]" 2
307 1 129 THR HB 1 131 ASP H 2.580 . 3.460 2.535 2.535 2.535 . 0 0 "[ ]" 2
308 1 130 GLU HA 1 131 ASP H 3.170 . 4.630 3.465 3.465 3.465 . 0 0 "[ ]" 2
309 1 131 ASP H 1 131 ASP HA 2.750 . 3.790 2.869 2.869 2.869 . 0 0 "[ ]" 2
310 1 130 GLU QB 1 131 ASP H 3.120 . 4.540 3.603 3.603 3.603 . 0 0 "[ ]" 2
311 1 130 GLU QG 1 131 ASP H 3.620 . 5.540 2.098 2.098 2.098 . 0 0 "[ ]" 2
312 1 129 THR MG 1 131 ASP H 3.590 . 5.480 4.153 4.153 4.153 . 0 0 "[ ]" 2
313 1 132 ASP H 1 133 ILE QG 3.850 . 6.000 3.799 3.799 3.799 . 0 0 "[ ]" 2
314 1 131 ASP QB 1 132 ASP H 2.980 . 4.260 2.489 2.489 2.489 . 0 0 "[ ]" 2
315 1 132 ASP H 1 134 GLU QB 3.730 . 5.760 4.381 4.381 4.381 . 0 0 "[ ]" 2
316 1 132 ASP H 1 133 ILE H 2.790 . 3.870 2.552 2.552 2.552 . 0 0 "[ ]" 2
317 1 128 ILE MG 1 132 ASP H 3.850 . 6.000 3.093 3.093 3.093 . 0 0 "[ ]" 2
318 1 130 GLU H 1 132 ASP H 3.850 . 6.000 4.726 4.726 4.726 . 0 0 "[ ]" 2
319 1 132 ASP H 1 133 ILE HA 3.850 . 6.000 5.253 5.253 5.253 . 0 0 "[ ]" 2
320 1 129 THR HB 1 132 ASP H 3.460 . 5.210 4.136 4.136 4.136 . 0 0 "[ ]" 2
321 1 129 THR MG 1 132 ASP H 3.850 . 6.000 4.807 4.807 4.807 . 0 0 "[ ]" 2
322 1 130 GLU QB 1 132 ASP H 3.850 . 6.000 5.340 5.340 5.340 . 0 0 "[ ]" 2
323 1 131 ASP H 1 132 ASP H 2.820 . 3.940 2.734 2.734 2.734 . 0 0 "[ ]" 2
324 1 132 ASP H 1 132 ASP HB3 3.060 . 4.420 3.416 3.416 3.416 . 0 0 "[ ]" 2
325 1 132 ASP H 1 132 ASP HB2 2.730 . 3.750 2.046 2.046 2.046 . 0 0 "[ ]" 2
326 1 132 ASP H 1 133 ILE HB 3.850 . 6.000 4.737 4.737 4.737 . 0 0 "[ ]" 2
327 1 132 ASP HB2 1 133 ILE H 2.720 . 3.740 2.737 2.737 2.737 . 0 0 "[ ]" 2
328 1 133 ILE H 1 133 ILE HA 2.610 . 3.530 2.915 2.915 2.915 . 0 0 "[ ]" 2
329 1 132 ASP HA 1 133 ILE H 2.880 . 4.050 3.569 3.569 3.569 . 0 0 "[ ]" 2
330 1 133 ILE H 1 133 ILE QG 2.630 . 3.560 1.882 1.882 1.882 . 0 0 "[ ]" 2
331 1 133 ILE H 1 133 ILE MD 3.200 . 4.700 3.312 3.312 3.312 . 0 0 "[ ]" 2
332 1 132 ASP HB3 1 133 ILE H 2.930 . 4.160 3.205 3.205 3.205 . 0 0 "[ ]" 2
333 1 130 GLU HA 1 133 ILE H 3.060 . 4.410 3.409 3.409 3.409 . 0 0 "[ ]" 2
334 1 133 ILE H 1 133 ILE HB 2.460 . 3.210 2.458 2.458 2.458 . 0 0 "[ ]" 2
335 1 131 ASP HA 1 134 GLU H 3.080 . 4.460 3.841 3.841 3.841 . 0 0 "[ ]" 2
336 1 133 ILE HB 1 134 GLU H 2.680 . 3.660 3.408 3.408 3.408 . 0 0 "[ ]" 2
337 1 134 GLU H 1 134 GLU HA 2.750 . 3.800 2.916 2.916 2.916 . 0 0 "[ ]" 2
338 1 133 ILE MD 1 134 GLU H 3.850 . 6.000 4.977 4.977 4.977 . 0 0 "[ ]" 2
339 1 133 ILE QG 1 134 GLU H 3.410 . 5.120 4.090 4.090 4.090 . 0 0 "[ ]" 2
340 1 134 GLU H 1 134 GLU QG 3.000 . 4.290 3.144 3.144 3.144 . 0 0 "[ ]" 2
341 1 134 GLU H 1 135 GLU H 2.570 . 3.440 2.515 2.515 2.515 . 0 0 "[ ]" 2
342 1 133 ILE MG 1 134 GLU H 3.420 . 5.130 4.099 4.099 4.099 . 0 0 "[ ]" 2
343 1 133 ILE HA 1 135 GLU H 3.770 . 5.830 4.206 4.206 4.206 . 0 0 "[ ]" 2
344 1 134 GLU HA 1 135 GLU H 2.970 . 4.240 3.561 3.561 3.561 . 0 0 "[ ]" 2
345 1 132 ASP HA 1 135 GLU H 2.940 . 4.180 4.014 4.014 4.014 . 0 0 "[ ]" 2
346 1 135 GLU H 1 136 LEU H 2.520 . 3.330 2.413 2.413 2.413 . 0 0 "[ ]" 2
347 1 135 GLU H 1 136 LEU QB 3.720 . 5.740 3.997 3.997 3.997 . 0 0 "[ ]" 2
348 1 135 GLU H 1 135 GLU HA 2.610 . 3.520 2.932 2.932 2.932 . 0 0 "[ ]" 2
349 1 136 LEU H 1 136 LEU QB 2.710 . 3.720 1.949 1.949 1.949 . 0 0 "[ ]" 2
350 1 135 GLU QB 1 136 LEU H 3.410 . 5.120 2.898 2.898 2.898 . 0 0 "[ ]" 2
351 1 136 LEU H 1 136 LEU QD 3.780 . 5.860 2.229 2.229 2.229 . 0 0 "[ ]" 2
352 1 136 LEU H 1 137 MET H 3.040 . 4.370 2.704 2.704 2.704 . 0 0 "[ ]" 2
353 1 133 ILE HA 1 136 LEU H 3.500 . 5.300 3.228 3.228 3.228 . 0 0 "[ ]" 2
354 1 134 GLU HA 1 136 LEU H 3.850 . 6.000 4.221 4.221 4.221 . 0 0 "[ ]" 2
355 1 133 ILE HA 1 137 MET H 3.830 . 5.960 4.371 4.371 4.371 . 0 0 "[ ]" 2
356 1 136 LEU QB 1 137 MET H 2.960 . 4.210 2.563 2.563 2.563 . 0 0 "[ ]" 2
357 1 137 MET H 1 137 MET QB 2.710 . 3.710 2.102 2.102 2.102 . 0 0 "[ ]" 2
358 1 134 GLU HA 1 137 MET H 3.280 . 4.860 4.029 4.029 4.029 . 0 0 "[ ]" 2
359 1 138 LYS H 1 138 LYS QG 3.090 . 4.480 3.963 3.963 3.963 . 0 0 "[ ]" 2
360 1 114 LEU QD 1 138 LYS H 3.850 . 6.000 4.023 4.023 4.023 . 0 0 "[ ]" 2
361 1 137 MET QG 1 138 LYS H 3.850 . 6.000 3.371 3.371 3.371 . 0 0 "[ ]" 2
362 1 134 GLU HA 1 138 LYS H 3.850 . 6.000 4.770 4.770 4.770 . 0 0 "[ ]" 2
363 1 137 MET H 1 138 LYS H 3.060 . 4.420 2.548 2.548 2.548 . 0 0 "[ ]" 2
364 1 137 MET QB 1 138 LYS H 3.060 . 4.410 2.743 2.743 2.743 . 0 0 "[ ]" 2
365 1 138 LYS H 1 138 LYS QB 2.950 . 4.200 2.158 2.158 2.158 . 0 0 "[ ]" 2
366 1 139 ASP H 1 139 ASP HA 2.620 . 3.540 2.902 2.902 2.902 . 0 0 "[ ]" 2
367 1 138 LYS QB 1 139 ASP H 2.690 . 3.690 2.123 2.123 2.123 . 0 0 "[ ]" 2
368 1 140 GLY H 1 156 PHE QD 3.850 . 6.000 4.161 4.161 4.161 . 0 0 "[ ]" 2
369 1 140 GLY H 1 156 PHE QE 3.850 . 6.000 4.122 4.122 4.122 . 0 0 "[ ]" 2
370 1 138 LYS H 1 140 GLY H 3.080 . 4.460 3.715 3.715 3.715 . 0 0 "[ ]" 2
371 1 140 GLY H 1 140 GLY QA 2.400 . 3.090 2.270 2.270 2.270 . 0 0 "[ ]" 2
372 1 140 GLY H 1 141 ASP QB 3.370 . 5.040 3.966 3.966 3.966 . 0 0 "[ ]" 2
373 1 139 ASP H 1 140 GLY H 2.470 . 3.240 2.534 2.534 2.534 . 0 0 "[ ]" 2
374 1 139 ASP HA 1 140 GLY H 2.960 . 4.220 3.477 3.477 3.477 . 0 0 "[ ]" 2
375 1 140 GLY H 1 148 ILE MD 3.690 . 5.680 4.338 4.338 4.338 . 0 0 "[ ]" 2
376 1 140 GLY H 1 141 ASP HA 3.560 . 5.420 5.092 5.092 5.092 . 0 0 "[ ]" 2
377 1 141 ASP H 1 141 ASP QB 2.380 . 3.070 2.089 2.089 2.089 . 0 0 "[ ]" 2
378 1 140 GLY QA 1 141 ASP H 2.610 . 3.520 2.915 2.915 2.915 . 0 0 "[ ]" 2
379 1 141 ASP H 1 141 ASP HA 2.620 . 3.540 2.953 2.953 2.953 . 0 0 "[ ]" 2
380 1 139 ASP HA 1 141 ASP H 3.180 . 4.660 3.692 3.692 3.692 . 0 0 "[ ]" 2
381 1 141 ASP H 1 148 ILE MD 3.420 . 5.140 3.904 3.904 3.904 . 0 0 "[ ]" 2
382 1 142 LYS H 1 152 GLU QB 3.170 . 4.630 2.107 2.107 2.107 . 0 0 "[ ]" 2
383 1 141 ASP QB 1 142 LYS H 3.150 . 4.590 3.832 3.832 3.832 . 0 0 "[ ]" 2
384 1 142 LYS H 1 142 LYS QB 2.730 . 3.770 2.117 2.117 2.117 . 0 0 "[ ]" 2
385 1 142 LYS H 1 142 LYS HA 2.610 . 3.530 2.877 2.877 2.877 . 0 0 "[ ]" 2
386 1 142 LYS H 1 143 ASN HA 3.540 . 5.380 5.315 5.315 5.315 . 0 0 "[ ]" 2
387 1 141 ASP HA 1 142 LYS H 2.370 . 3.040 2.222 2.222 2.222 . 0 0 "[ ]" 2
388 1 142 LYS H 1 142 LYS QG 3.030 . 4.360 3.869 3.869 3.869 . 0 0 "[ ]" 2
389 1 143 ASN H 1 143 ASN HB3 2.920 . 4.130 2.946 2.946 2.946 . 0 0 "[ ]" 2
390 1 143 ASN H 1 143 ASN HB2 3.120 . 4.540 3.813 3.813 3.813 . 0 0 "[ ]" 2
391 1 142 LYS QB 1 143 ASN H 2.810 . 3.930 2.940 2.940 2.940 . 0 0 "[ ]" 2
392 1 142 LYS HA 1 143 ASN H 2.730 . 3.760 3.473 3.473 3.473 . 0 0 "[ ]" 2
393 1 143 ASN H 1 144 ASN HA 2.930 . 4.160 4.169 4.169 4.169 0.009 1 0 "[ ]" 2
394 1 141 ASP HA 1 143 ASN H 2.890 . 4.080 3.502 3.502 3.502 . 0 0 "[ ]" 2
395 1 143 ASN H 1 152 GLU QB 3.150 . 4.600 4.101 4.101 4.101 . 0 0 "[ ]" 2
396 1 143 ASN H 1 145 ASP H 3.120 . 4.540 4.133 4.133 4.133 . 0 0 "[ ]" 2
397 1 142 LYS QG 1 143 ASN H 3.580 . 5.460 4.222 4.222 4.222 . 0 0 "[ ]" 2
398 1 143 ASN HB3 1 144 ASN H 3.850 . 6.000 4.297 4.297 4.297 . 0 0 "[ ]" 2
399 1 143 ASN H 1 144 ASN H 2.770 . 3.850 1.960 1.960 1.960 . 0 0 "[ ]" 2
400 1 144 ASN H 1 144 ASN HB2 3.100 . 4.500 3.236 3.236 3.236 . 0 0 "[ ]" 2
401 1 144 ASN H 1 144 ASN HB3 3.240 . 4.780 4.033 4.033 4.033 . 0 0 "[ ]" 2
402 1 145 ASP H 1 148 ILE QG 3.850 . 6.000 5.029 5.029 5.029 . 0 0 "[ ]" 2
403 1 144 ASN HB2 1 145 ASP H 3.850 . 6.000 4.516 4.516 4.516 . 0 0 "[ ]" 2
404 1 145 ASP H 1 146 GLY H 2.580 . 3.470 1.867 1.867 1.867 . 0 0 "[ ]" 2
405 1 145 ASP H 1 146 GLY QA 3.410 . 5.120 3.988 3.988 3.988 . 0 0 "[ ]" 2
406 1 145 ASP H 1 145 ASP QB 3.460 . 5.210 2.775 2.775 2.775 . 0 0 "[ ]" 2
407 1 145 ASP QB 1 146 GLY H 3.180 . 4.660 3.638 3.638 3.638 . 0 0 "[ ]" 2
408 1 145 ASP HA 1 146 GLY H 2.970 . 4.240 3.460 3.460 3.460 . 0 0 "[ ]" 2
409 1 146 GLY H 1 146 GLY QA 2.350 . 3.000 2.381 2.381 2.381 . 0 0 "[ ]" 2
410 1 144 ASN HA 1 146 GLY H 2.700 . 3.700 3.576 3.576 3.576 . 0 0 "[ ]" 2
411 1 146 GLY QA 1 147 ARG H 2.980 . 4.250 2.710 2.710 2.710 . 0 0 "[ ]" 2
412 1 147 ARG H 1 147 ARG HB2 3.160 . 4.620 2.445 2.445 2.445 . 0 0 "[ ]" 2
413 1 147 ARG H 1 148 ILE H 3.730 . 5.760 4.596 4.596 4.596 . 0 0 "[ ]" 2
414 1 147 ARG H 1 148 ILE HA 3.850 . 6.000 5.158 5.158 5.158 . 0 0 "[ ]" 2
415 1 147 ARG H 1 147 ARG HB3 3.290 . 4.870 3.620 3.620 3.620 . 0 0 "[ ]" 2
416 1 147 ARG QG 1 148 ILE H 3.330 . 4.960 4.232 4.232 4.232 . 0 0 "[ ]" 2
417 1 148 ILE H 1 148 ILE HB 2.330 . 2.970 2.375 2.375 2.375 . 0 0 "[ ]" 2
418 1 147 ARG HA 1 148 ILE H 2.250 . 2.790 2.319 2.319 2.319 . 0 0 "[ ]" 2
419 1 111 TYR QD 1 148 ILE H 3.790 . 5.870 3.961 3.961 3.961 . 0 0 "[ ]" 2
420 1 148 ILE H 1 148 ILE MG 3.310 . 4.910 3.616 3.616 3.616 . 0 0 "[ ]" 2
421 1 147 ARG HB3 1 148 ILE H 2.710 . 3.730 2.904 2.904 2.904 . 0 0 "[ ]" 2
422 1 148 ILE H 1 148 ILE QG 2.760 . 3.820 3.235 3.235 3.235 . 0 0 "[ ]" 2
423 1 148 ILE H 1 148 ILE HA 2.620 . 3.540 2.998 2.998 2.998 . 0 0 "[ ]" 2
424 1 112 ILE HB 1 148 ILE H 2.840 . 3.980 3.492 3.492 3.492 . 0 0 "[ ]" 2
425 1 149 ASP H 1 151 ASP HB2 3.850 . 6.000 4.816 4.816 4.816 . 0 0 "[ ]" 2
426 1 149 ASP H 1 152 GLU QG 3.850 . 6.000 3.069 3.069 3.069 . 0 0 "[ ]" 2
427 1 148 ILE QG 1 149 ASP H 3.850 . 6.000 3.879 3.879 3.879 . 0 0 "[ ]" 2
428 1 111 TYR QD 1 149 ASP H 3.850 . 6.000 3.535 3.535 3.535 . 0 0 "[ ]" 2
429 1 148 ILE MD 1 149 ASP H 3.850 . 6.000 4.973 4.973 4.973 . 0 0 "[ ]" 2
430 1 149 ASP H 1 149 ASP HB3 3.450 . 5.200 2.952 2.952 2.952 . 0 0 "[ ]" 2
431 1 149 ASP H 1 152 GLU QB 3.330 . 4.960 2.420 2.420 2.420 . 0 0 "[ ]" 2
432 1 148 ILE MG 1 149 ASP H 3.850 . 6.000 2.832 2.832 2.832 . 0 0 "[ ]" 2
433 1 149 ASP H 1 152 GLU HA 3.850 . 6.000 5.266 5.266 5.266 . 0 0 "[ ]" 2
434 1 149 ASP H 1 149 ASP HB2 3.450 . 5.200 3.585 3.585 3.585 . 0 0 "[ ]" 2
435 1 149 ASP H 1 152 GLU H 3.830 . 5.960 3.407 3.407 3.407 . 0 0 "[ ]" 2
436 1 148 ILE HB 1 149 ASP H 3.850 . 6.000 4.468 4.468 4.468 . 0 0 "[ ]" 2
437 1 149 ASP H 1 150 TYR H 3.670 . 5.640 4.451 4.451 4.451 . 0 0 "[ ]" 2
438 1 111 TYR QE 1 149 ASP H 3.850 . 6.000 4.542 4.542 4.542 . 0 0 "[ ]" 2
439 1 150 TYR H 1 151 ASP H 2.710 . 3.710 2.648 2.648 2.648 . 0 0 "[ ]" 2
440 1 149 ASP HB3 1 150 TYR H 2.730 . 3.750 3.501 3.501 3.501 . 0 0 "[ ]" 2
441 1 150 TYR H 1 150 TYR HB2 2.460 . 3.220 2.456 2.456 2.456 . 0 0 "[ ]" 2
442 1 150 TYR H 1 150 TYR HB3 2.480 . 3.260 2.410 2.410 2.410 . 0 0 "[ ]" 2
443 1 150 TYR H 1 150 TYR QD 3.590 . 5.480 4.123 4.123 4.123 . 0 0 "[ ]" 2
444 1 111 TYR QE 1 150 TYR H 3.850 . 6.000 5.252 5.252 5.252 . 0 0 "[ ]" 2
445 1 101 PHE QE 1 150 TYR H 3.650 . 5.600 3.861 3.861 3.861 . 0 0 "[ ]" 2
446 1 150 TYR H 1 150 TYR HA 2.620 . 3.540 2.870 2.870 2.870 . 0 0 "[ ]" 2
447 1 149 ASP HA 1 150 TYR H 2.530 . 3.360 2.698 2.698 2.698 . 0 0 "[ ]" 2
448 1 149 ASP HB2 1 150 TYR H 2.500 . 3.290 2.026 2.026 2.026 . 0 0 "[ ]" 2
449 1 111 TYR QD 1 150 TYR H 3.850 . 6.000 5.372 5.372 5.372 . 0 0 "[ ]" 2
450 1 101 PHE HZ 1 150 TYR H 3.030 . 4.360 4.056 4.056 4.056 . 0 0 "[ ]" 2
451 1 150 TYR H 1 152 GLU H 3.490 . 5.280 4.852 4.852 4.852 . 0 0 "[ ]" 2
452 1 149 ASP HA 1 151 ASP H 3.670 . 5.630 4.379 4.379 4.379 . 0 0 "[ ]" 2
453 1 151 ASP H 1 152 GLU QG 3.850 . 6.000 4.121 4.121 4.121 . 0 0 "[ ]" 2
454 1 151 ASP H 1 154 LEU QD 3.850 . 6.000 4.446 4.446 4.446 . 0 0 "[ ]" 2
455 1 151 ASP H 1 152 GLU H 2.500 . 3.290 2.767 2.767 2.767 . 0 0 "[ ]" 2
456 1 151 ASP H 1 151 ASP HA 2.610 . 3.530 2.923 2.923 2.923 . 0 0 "[ ]" 2
457 1 151 ASP H 1 152 GLU QB 3.750 . 5.790 4.548 4.548 4.548 . 0 0 "[ ]" 2
458 1 150 TYR QD 1 151 ASP H 3.650 . 5.600 4.326 4.326 4.326 . 0 0 "[ ]" 2
459 1 101 PHE QE 1 151 ASP H 3.850 . 6.000 5.349 5.349 5.349 . 0 0 "[ ]" 2
460 1 151 ASP H 1 151 ASP HB2 2.500 . 3.300 2.593 2.593 2.593 . 0 0 "[ ]" 2
461 1 151 ASP HA 1 152 GLU H 2.870 . 4.040 3.592 3.592 3.592 . 0 0 "[ ]" 2
462 1 151 ASP HB2 1 152 GLU H 2.670 . 3.630 2.006 2.006 2.006 . 0 0 "[ ]" 2
463 1 152 GLU H 1 152 GLU HA 2.610 . 3.530 2.834 2.834 2.834 . 0 0 "[ ]" 2
464 1 152 GLU H 1 154 LEU H 3.700 . 5.700 4.283 4.283 4.283 . 0 0 "[ ]" 2
465 1 152 GLU H 1 152 GLU QB 2.470 . 3.240 2.440 2.440 2.440 . 0 0 "[ ]" 2
466 1 152 GLU H 1 152 GLU QG 3.060 . 4.420 1.933 1.933 1.933 . 0 0 "[ ]" 2
467 1 148 ILE MG 1 152 GLU H 3.640 . 5.580 4.284 4.284 4.284 . 0 0 "[ ]" 2
468 1 148 ILE HA 1 152 GLU H 3.500 . 5.290 5.006 5.006 5.006 . 0 0 "[ ]" 2
469 1 152 GLU QG 1 153 PHE H 3.500 . 5.300 3.887 3.887 3.887 . 0 0 "[ ]" 2
470 1 151 ASP H 1 153 PHE H 3.290 . 4.880 3.819 3.819 3.819 . 0 0 "[ ]" 2
471 1 101 PHE QE 1 153 PHE H 3.850 . 6.000 4.418 4.418 4.418 . 0 0 "[ ]" 2
472 1 148 ILE MG 1 153 PHE H 2.930 . 4.160 2.576 2.576 2.576 . 0 0 "[ ]" 2
473 1 152 GLU QB 1 153 PHE H 2.840 . 3.980 2.496 2.496 2.496 . 0 0 "[ ]" 2
474 1 153 PHE H 1 154 LEU H 2.620 . 3.540 2.737 2.737 2.737 . 0 0 "[ ]" 2
475 1 152 GLU H 1 153 PHE H 2.580 . 3.470 2.787 2.787 2.787 . 0 0 "[ ]" 2
476 1 153 PHE H 1 153 PHE HA 2.850 . 4.000 2.844 2.844 2.844 . 0 0 "[ ]" 2
477 1 153 PHE H 1 153 PHE QD 3.230 . 4.750 4.114 4.114 4.114 . 0 0 "[ ]" 2
478 1 153 PHE HB2 1 154 LEU H 3.020 . 4.340 3.965 3.965 3.965 . 0 0 "[ ]" 2
479 1 151 ASP HA 1 154 LEU H 3.070 . 4.440 3.694 3.694 3.694 . 0 0 "[ ]" 2
480 1 154 LEU H 1 154 LEU HA 2.790 . 3.890 2.809 2.809 2.809 . 0 0 "[ ]" 2
481 1 154 LEU H 1 154 LEU HB2 2.580 . 3.460 1.959 1.959 1.959 . 0 0 "[ ]" 2
482 1 154 LEU H 1 155 GLU H 2.790 . 3.890 2.885 2.885 2.885 . 0 0 "[ ]" 2
483 1 153 PHE HB3 1 154 LEU H 2.810 . 3.920 2.654 2.654 2.654 . 0 0 "[ ]" 2
484 1 151 ASP HB3 1 154 LEU H 3.640 . 5.580 5.516 5.516 5.516 . 0 0 "[ ]" 2
485 1 153 PHE HA 1 154 LEU H 3.200 . 4.700 3.552 3.552 3.552 . 0 0 "[ ]" 2
486 1 153 PHE QD 1 154 LEU H 3.430 . 5.160 3.043 3.043 3.043 . 0 0 "[ ]" 2
487 1 155 GLU H 1 156 PHE H 2.560 . 3.430 2.619 2.619 2.619 . 0 0 "[ ]" 2
488 1 154 LEU HB2 1 155 GLU H 2.770 . 3.830 2.951 2.951 2.951 . 0 0 "[ ]" 2
489 1 155 GLU H 1 155 GLU HA 2.810 . 3.930 2.913 2.913 2.913 . 0 0 "[ ]" 2
490 1 154 LEU HA 1 155 GLU H 3.330 . 4.960 3.579 3.579 3.579 . 0 0 "[ ]" 2
491 1 155 GLU H 1 155 GLU QG 3.230 . 4.760 2.919 2.919 2.919 . 0 0 "[ ]" 2
492 1 152 GLU HA 1 155 GLU H 3.120 . 4.540 3.686 3.686 3.686 . 0 0 "[ ]" 2
493 1 155 GLU H 1 155 GLU QB 2.910 . 4.120 2.006 2.006 2.006 . 0 0 "[ ]" 2
494 1 154 LEU HB3 1 155 GLU H 3.000 . 4.300 2.817 2.817 2.817 . 0 0 "[ ]" 2
495 1 154 LEU QD 1 155 GLU H 3.850 . 6.000 3.793 3.793 3.793 . 0 0 "[ ]" 2
496 1 153 PHE H 1 155 GLU H 3.850 . 6.000 4.514 4.514 4.514 . 0 0 "[ ]" 2
497 1 155 GLU H 1 156 PHE QB 3.520 . 5.330 4.171 4.171 4.171 . 0 0 "[ ]" 2
498 1 155 GLU H 1 156 PHE HA 3.750 . 5.800 5.260 5.260 5.260 . 0 0 "[ ]" 2
499 1 155 GLU QG 1 156 PHE H 3.540 . 5.380 4.265 4.265 4.265 . 0 0 "[ ]" 2
500 1 156 PHE H 1 159 GLY H 3.600 . 5.500 5.115 5.115 5.115 . 0 0 "[ ]" 2
501 1 156 PHE H 1 158 LYS H 3.460 . 5.210 4.214 4.214 4.214 . 0 0 "[ ]" 2
502 1 154 LEU HA 1 156 PHE H 3.370 . 5.040 4.993 4.993 4.993 . 0 0 "[ ]" 2
503 1 156 PHE H 1 156 PHE HA 2.690 . 3.690 2.766 2.766 2.766 . 0 0 "[ ]" 2
504 1 155 GLU QB 1 156 PHE H 2.830 . 3.970 2.480 2.480 2.480 . 0 0 "[ ]" 2
505 1 156 PHE H 1 156 PHE QB 2.500 . 3.290 2.185 2.185 2.185 . 0 0 "[ ]" 2
506 1 156 PHE H 1 156 PHE QD 3.400 . 5.100 4.118 4.118 4.118 . 0 0 "[ ]" 2
507 1 155 GLU QB 1 157 MET H 3.850 . 6.000 4.459 4.459 4.459 . 0 0 "[ ]" 2
508 1 156 PHE HA 1 157 MET H 3.120 . 4.540 3.550 3.550 3.550 . 0 0 "[ ]" 2
509 1 157 MET H 1 157 MET QB 2.540 . 3.370 2.232 2.232 2.232 . 0 0 "[ ]" 2
510 1 153 PHE HA 1 157 MET H 2.920 . 4.140 4.122 4.122 4.122 . 0 0 "[ ]" 2
511 1 156 PHE QB 1 157 MET H 2.790 . 3.890 2.640 2.640 2.640 . 0 0 "[ ]" 2
512 1 157 MET H 1 157 MET HA 2.690 . 3.670 2.963 2.963 2.963 . 0 0 "[ ]" 2
513 1 156 PHE H 1 157 MET H 2.600 . 3.500 2.921 2.921 2.921 . 0 0 "[ ]" 2
514 1 157 MET H 1 158 LYS H 2.580 . 3.460 2.298 2.298 2.298 . 0 0 "[ ]" 2
515 1 154 LEU HA 1 157 MET H 3.020 . 4.330 4.105 4.105 4.105 . 0 0 "[ ]" 2
516 1 156 PHE QD 1 157 MET H 3.560 . 5.410 4.132 4.132 4.132 . 0 0 "[ ]" 2
517 1 157 MET H 1 160 VAL MG1 3.850 . 6.000 4.997 4.997 4.997 . 0 0 "[ ]" 2
518 1 155 GLU QB 1 158 LYS H 3.850 . 6.000 4.561 4.561 4.561 . 0 0 "[ ]" 2
519 1 158 LYS H 1 159 GLY H 2.810 . 3.910 2.699 2.699 2.699 . 0 0 "[ ]" 2
520 1 158 LYS H 1 158 LYS QB 2.740 . 3.780 2.082 2.082 2.082 . 0 0 "[ ]" 2
521 1 158 LYS H 1 158 LYS HA 2.610 . 3.530 2.854 2.854 2.854 . 0 0 "[ ]" 2
522 1 156 PHE HA 1 158 LYS H 3.470 . 5.240 4.682 4.682 4.682 . 0 0 "[ ]" 2
523 1 157 MET HA 1 158 LYS H 3.100 . 4.500 3.541 3.541 3.541 . 0 0 "[ ]" 2
524 1 154 LEU HA 1 158 LYS H 3.610 . 5.520 4.434 4.434 4.434 . 0 0 "[ ]" 2
525 1 157 MET QB 1 158 LYS H 3.190 . 4.680 2.680 2.680 2.680 . 0 0 "[ ]" 2
526 1 156 PHE QB 1 158 LYS H 3.850 . 6.000 4.652 4.652 4.652 . 0 0 "[ ]" 2
527 1 158 LYS H 1 158 LYS QG 3.380 . 5.050 3.857 3.857 3.857 . 0 0 "[ ]" 2
528 1 157 MET H 1 159 GLY H 3.850 . 6.000 3.993 3.993 3.993 . 0 0 "[ ]" 2
529 1 159 GLY H 1 159 GLY QA 2.630 . 3.570 2.535 2.535 2.535 . 0 0 "[ ]" 2
530 1 156 PHE HA 1 159 GLY H 3.850 . 6.000 4.199 4.199 4.199 . 0 0 "[ ]" 2
531 1 157 MET HA 1 159 GLY H 3.850 . 6.000 4.046 4.046 4.046 . 0 0 "[ ]" 2
532 1 158 LYS QB 1 159 GLY H 3.500 . 5.300 2.722 2.722 2.722 . 0 0 "[ ]" 2
533 1 158 LYS QG 1 159 GLY H 3.850 . 6.000 4.124 4.124 4.124 . 0 0 "[ ]" 2
534 1 159 GLY H 1 160 VAL MG2 3.850 . 6.000 2.849 2.849 2.849 . 0 0 "[ ]" 2
535 1 155 GLU QG 1 159 GLY H 3.850 . 6.000 5.170 5.170 5.170 . 0 0 "[ ]" 2
536 1 160 VAL H 1 160 VAL HA 2.750 . 3.800 2.943 2.943 2.943 . 0 0 "[ ]" 2
537 1 159 GLY QA 1 160 VAL H 2.820 . 3.940 2.205 2.205 2.205 . 0 0 "[ ]" 2
538 1 160 VAL H 1 160 VAL HB 2.630 . 3.570 3.508 3.508 3.508 . 0 0 "[ ]" 2
539 1 160 VAL H 1 161 GLU H 3.130 . 4.560 2.247 2.247 2.247 . 0 0 "[ ]" 2
540 1 160 VAL QG 1 161 GLU H 3.470 . 5.240 2.450 2.450 2.450 . 0 0 "[ ]" 2
541 1 161 GLU H 1 161 GLU QB 3.250 . 4.800 2.122 2.122 2.122 . 0 0 "[ ]" 2
542 1 161 GLU H 1 161 GLU QG 3.810 . 5.920 3.922 3.922 3.922 . 0 0 "[ ]" 2
543 1 108 ALA HA 1 108 ALA MB 2.420 . 3.140 2.115 2.115 2.115 . 0 0 "[ ]" 2
544 1 123 ALA HA 1 123 ALA MB 2.420 . 3.130 2.122 2.122 2.122 . 0 0 "[ ]" 2
545 1 119 ILE MG 1 123 ALA MB 3.850 . 6.000 3.703 3.703 3.703 . 0 0 "[ ]" 2
546 1 120 MET HA 1 123 ALA MB 2.900 . 4.100 2.837 2.837 2.837 . 0 0 "[ ]" 2
547 1 122 GLN QB 1 123 ALA MB 3.850 . 6.000 3.846 3.846 3.846 . 0 0 "[ ]" 2
548 1 105 ASP HA 1 112 ILE MD 3.310 . 4.910 1.754 1.754 1.754 . 0 0 "[ ]" 2
549 1 105 ASP H 1 105 ASP QB 2.620 . 3.540 2.132 2.132 2.132 . 0 0 "[ ]" 2
550 1 105 ASP QB 1 112 ILE MD 3.560 . 5.420 2.345 2.345 2.345 . 0 0 "[ ]" 2
551 1 102 ARG HA 1 105 ASP QB 2.990 . 4.280 2.733 2.733 2.733 . 0 0 "[ ]" 2
552 1 109 ASP HA 1 109 ASP QB 2.650 . 3.590 2.200 2.200 2.200 . 0 0 "[ ]" 2
553 1 113 ASP HA 1 113 ASP HB3 2.650 . 3.600 2.382 2.382 2.382 . 0 0 "[ ]" 2
554 1 113 ASP H 1 113 ASP HB3 3.090 . 4.480 3.031 3.031 3.031 . 0 0 "[ ]" 2
555 1 113 ASP HA 1 113 ASP HB2 2.650 . 3.590 2.580 2.580 2.580 . 0 0 "[ ]" 2
556 1 132 ASP HA 1 132 ASP HB3 2.650 . 3.590 2.695 2.695 2.695 . 0 0 "[ ]" 2
557 1 132 ASP HA 1 132 ASP HB2 2.850 . 4.000 2.984 2.984 2.984 . 0 0 "[ ]" 2
558 1 132 ASP H 1 132 ASP HA 2.710 . 3.730 2.912 2.912 2.912 . 0 0 "[ ]" 2
559 1 132 ASP HA 1 135 GLU QB 3.290 . 4.880 4.351 4.351 4.351 . 0 0 "[ ]" 2
560 1 128 ILE MG 1 132 ASP HB3 3.730 . 5.750 2.316 2.316 2.316 . 0 0 "[ ]" 2
561 1 128 ILE MG 1 132 ASP HB2 3.350 . 5.000 1.818 1.818 1.818 . 0 0 "[ ]" 2
562 1 141 ASP HA 1 148 ILE MD 3.500 . 5.290 3.306 3.306 3.306 . 0 0 "[ ]" 2
563 1 141 ASP QB 1 148 ILE MD 3.830 . 5.960 3.819 3.819 3.819 . 0 0 "[ ]" 2
564 1 138 LYS HA 1 141 ASP QB 3.080 . 4.460 3.146 3.146 3.146 . 0 0 "[ ]" 2
565 1 145 ASP HA 1 145 ASP QB 2.650 . 3.590 2.201 2.201 2.201 . 0 0 "[ ]" 2
566 1 149 ASP HA 1 149 ASP HB3 2.690 . 3.680 2.392 2.392 2.392 . 0 0 "[ ]" 2
567 1 149 ASP HA 1 149 ASP HB2 2.650 . 3.590 2.560 2.560 2.560 . 0 0 "[ ]" 2
568 1 149 ASP H 1 149 ASP HA 2.880 . 4.050 2.983 2.983 2.983 . 0 0 "[ ]" 2
569 1 101 PHE HZ 1 149 ASP HA 3.020 . 4.330 2.397 2.397 2.397 . 0 0 "[ ]" 2
570 1 112 ILE H 1 149 ASP HA 3.160 . 4.620 4.161 4.161 4.161 . 0 0 "[ ]" 2
571 1 149 ASP HA 1 150 TYR HA 3.310 . 4.920 4.402 4.402 4.402 . 0 0 "[ ]" 2
572 1 149 ASP HB2 1 151 ASP H 3.170 . 4.630 2.889 2.889 2.889 . 0 0 "[ ]" 2
573 1 151 ASP HA 1 151 ASP HB3 2.650 . 3.600 2.388 2.388 2.388 . 0 0 "[ ]" 2
574 1 151 ASP HA 1 151 ASP HB2 2.830 . 3.960 3.027 3.027 3.027 . 0 0 "[ ]" 2
575 1 151 ASP HA 1 154 LEU HB3 3.260 . 4.820 4.419 4.419 4.419 . 0 0 "[ ]" 2
576 1 151 ASP HA 1 154 LEU QD 3.500 . 5.300 3.197 3.197 3.197 . 0 0 "[ ]" 2
577 1 151 ASP HB3 1 152 GLU H 2.670 . 3.650 3.376 3.376 3.376 . 0 0 "[ ]" 2
578 1 99 ASP HA 1 99 ASP HB2 2.650 . 3.590 3.023 3.023 3.023 . 0 0 "[ ]" 2
579 1 99 ASP HA 1 103 MET H 2.970 . 4.240 4.267 4.267 4.267 0.027 1 0 "[ ]" 2
580 1 99 ASP HA 1 102 ARG QD 3.790 . 5.880 4.405 4.405 4.405 . 0 0 "[ ]" 2
581 1 96 GLU HA 1 99 ASP HB2 2.810 . 3.910 2.830 2.830 2.830 . 0 0 "[ ]" 2
582 1 112 ILE MG 1 116 GLU QB 2.830 . 3.960 1.649 1.649 1.649 0.051 1 0 "[ ]" 2
583 1 116 GLU H 1 116 GLU QG 3.540 . 5.370 2.455 2.455 2.455 . 0 0 "[ ]" 2
584 1 126 GLU HA 1 126 GLU HB3 2.650 . 3.600 2.416 2.416 2.416 . 0 0 "[ ]" 2
585 1 126 GLU HA 1 126 GLU QG 3.380 . 5.060 2.495 2.495 2.495 . 0 0 "[ ]" 2
586 1 126 GLU H 1 126 GLU HA 2.810 . 3.920 2.908 2.908 2.908 . 0 0 "[ ]" 2
587 1 126 GLU HA 1 127 THR H 2.530 . 3.360 2.905 2.905 2.905 . 0 0 "[ ]" 2
588 1 126 GLU HA 1 126 GLU HB2 2.750 . 3.790 3.031 3.031 3.031 . 0 0 "[ ]" 2
589 1 126 GLU H 1 126 GLU HB2 2.690 . 3.670 2.525 2.525 2.525 . 0 0 "[ ]" 2
590 1 126 GLU HB2 1 127 THR H 3.180 . 4.660 2.614 2.614 2.614 . 0 0 "[ ]" 2
591 1 130 GLU HA 1 133 ILE MD 3.020 . 4.330 2.967 2.967 2.967 . 0 0 "[ ]" 2
592 1 130 GLU HA 1 133 ILE QG 3.460 . 5.210 3.832 3.832 3.832 . 0 0 "[ ]" 2
593 1 130 GLU HA 1 133 ILE MG 3.330 . 4.960 3.942 3.942 3.942 . 0 0 "[ ]" 2
594 1 134 GLU HA 1 134 GLU QG 3.250 . 4.790 2.008 2.008 2.008 . 0 0 "[ ]" 2
595 1 152 GLU HA 1 153 PHE H 3.650 . 5.600 3.564 3.564 3.564 . 0 0 "[ ]" 2
596 1 148 ILE HA 1 152 GLU QB 2.790 . 3.890 2.857 2.857 2.857 . 0 0 "[ ]" 2
597 1 148 ILE MG 1 152 GLU QB 2.850 . 4.000 2.556 2.556 2.556 . 0 0 "[ ]" 2
598 1 152 GLU HA 1 152 GLU QG 3.560 . 5.420 2.335 2.335 2.335 . 0 0 "[ ]" 2
599 1 155 GLU HA 1 158 LYS H 3.640 . 5.580 3.006 3.006 3.006 . 0 0 "[ ]" 2
600 1 142 LYS QE 1 155 GLU QG 3.850 . 6.000 4.040 4.040 4.040 . 0 0 "[ ]" 2
601 1 161 GLU H 1 161 GLU HA 2.750 . 3.790 2.984 2.984 2.984 . 0 0 "[ ]" 2
602 1 161 GLU HA 1 161 GLU QG 3.660 . 5.620 1.935 1.935 1.935 . 0 0 "[ ]" 2
603 1 94 GLU HA 1 154 LEU QD 3.850 . 6.000 3.357 3.357 3.357 . 0 0 "[ ]" 2
604 1 94 GLU HA 1 97 LEU QD 3.540 . 5.380 2.414 2.414 2.414 . 0 0 "[ ]" 2
605 1 94 GLU QB 1 154 LEU QD 3.850 . 6.000 3.752 3.752 3.752 . 0 0 "[ ]" 2
606 1 96 GLU HA 1 96 GLU HB3 2.650 . 3.600 2.838 2.838 2.838 . 0 0 "[ ]" 2
607 1 96 GLU HA 1 96 GLU HB2 2.650 . 3.610 2.884 2.884 2.884 . 0 0 "[ ]" 2
608 1 96 GLU HA 1 96 GLU QG 3.180 . 4.660 2.426 2.426 2.426 . 0 0 "[ ]" 2
609 1 101 PHE HA 1 105 ASP H 3.730 . 5.760 4.381 4.381 4.381 . 0 0 "[ ]" 2
610 1 101 PHE HA 1 101 PHE QB 2.670 . 3.630 2.349 2.349 2.349 . 0 0 "[ ]" 2
611 1 101 PHE HA 1 104 PHE HB2 3.480 . 5.250 3.247 3.247 3.247 . 0 0 "[ ]" 2
612 1 101 PHE HA 1 112 ILE MD 3.120 . 4.540 3.212 3.212 3.212 . 0 0 "[ ]" 2
613 1 98 SER HA 1 101 PHE QB 3.450 . 5.200 2.847 2.847 2.847 . 0 0 "[ ]" 2
614 1 104 PHE HA 1 104 PHE HB2 2.660 . 3.620 2.975 2.975 2.975 . 0 0 "[ ]" 2
615 1 104 PHE HB2 1 105 ASP H 3.040 . 4.380 3.360 3.360 3.360 . 0 0 "[ ]" 2
616 1 104 PHE HB2 1 112 ILE MD 3.090 . 4.480 3.519 3.519 3.519 . 0 0 "[ ]" 2
617 1 104 PHE HB3 1 112 ILE MD 3.200 . 4.700 3.306 3.306 3.306 . 0 0 "[ ]" 2
618 1 104 PHE HB3 1 112 ILE MG 3.370 . 5.040 4.185 4.185 4.185 . 0 0 "[ ]" 2
619 1 153 PHE HA 1 156 PHE QB 2.830 . 3.970 2.232 2.232 2.232 . 0 0 "[ ]" 2
620 1 153 PHE HA 1 156 PHE H 3.330 . 4.960 3.413 3.413 3.413 . 0 0 "[ ]" 2
621 1 148 ILE MD 1 153 PHE HA 3.850 . 6.000 3.284 3.284 3.284 . 0 0 "[ ]" 2
622 1 148 ILE MG 1 153 PHE HA 2.880 . 4.050 2.585 2.585 2.585 . 0 0 "[ ]" 2
623 1 153 PHE H 1 153 PHE HB2 2.580 . 3.460 2.516 2.516 2.516 . 0 0 "[ ]" 2
624 1 148 ILE MG 1 153 PHE HB2 3.080 . 4.460 1.991 1.991 1.991 . 0 0 "[ ]" 2
625 1 153 PHE HA 1 153 PHE HB3 2.670 . 3.640 3.033 3.033 3.033 . 0 0 "[ ]" 2
626 1 153 PHE H 1 153 PHE HB3 2.570 . 3.440 2.353 2.353 2.353 . 0 0 "[ ]" 2
627 1 148 ILE MG 1 153 PHE HB3 2.960 . 4.210 3.287 3.287 3.287 . 0 0 "[ ]" 2
628 1 140 GLY QA 1 148 ILE MD 2.860 . 4.020 2.940 2.940 2.940 . 0 0 "[ ]" 2
629 1 112 ILE HA 1 112 ILE MD 3.330 . 4.960 3.392 3.392 3.392 . 0 0 "[ ]" 2
630 1 112 ILE HA 1 112 ILE QG 2.840 . 3.980 2.309 2.309 2.309 . 0 0 "[ ]" 2
631 1 112 ILE HB 1 112 ILE MD 2.960 . 4.220 2.733 2.733 2.733 . 0 0 "[ ]" 2
632 1 112 ILE HB 1 148 ILE MG 3.000 . 4.300 3.291 3.291 3.291 . 0 0 "[ ]" 2
633 1 112 ILE MD 1 112 ILE MG 2.800 . 3.900 1.743 1.743 1.743 . 0 0 "[ ]" 2
634 1 112 ILE MD 1 148 ILE MG 3.850 . 6.000 4.167 4.167 4.167 . 0 0 "[ ]" 2
635 1 112 ILE HA 1 112 ILE MG 2.650 . 3.610 2.287 2.287 2.287 . 0 0 "[ ]" 2
636 1 112 ILE HB 1 112 ILE MG 2.420 . 3.140 2.159 2.159 2.159 . 0 0 "[ ]" 2
637 1 112 ILE H 1 112 ILE MG 3.380 . 5.050 3.896 3.896 3.896 . 0 0 "[ ]" 2
638 1 112 ILE MG 1 148 ILE H 3.850 . 6.000 4.552 4.552 4.552 . 0 0 "[ ]" 2
639 1 112 ILE MG 1 117 LEU HA 2.780 . 3.860 3.221 3.221 3.221 . 0 0 "[ ]" 2
640 1 112 ILE MG 1 117 LEU HB2 2.700 . 3.700 3.026 3.026 3.026 . 0 0 "[ ]" 2
641 1 112 ILE MG 1 117 LEU H 2.710 . 3.730 2.677 2.677 2.677 . 0 0 "[ ]" 2
642 1 119 ILE HA 1 119 ILE HB 2.670 . 3.650 3.034 3.034 3.034 . 0 0 "[ ]" 2
643 1 119 ILE HA 1 119 ILE MD 3.080 . 4.460 3.747 3.747 3.747 . 0 0 "[ ]" 2
644 1 119 ILE HA 1 119 ILE QG 2.540 . 3.370 2.359 2.359 2.359 . 0 0 "[ ]" 2
645 1 119 ILE HA 1 119 ILE MG 2.610 . 3.520 2.381 2.381 2.381 . 0 0 "[ ]" 2
646 1 119 ILE H 1 119 ILE HA 2.560 . 3.430 2.924 2.924 2.924 . 0 0 "[ ]" 2
647 1 119 ILE HA 1 122 GLN QB 3.230 . 4.760 2.232 2.232 2.232 . 0 0 "[ ]" 2
648 1 119 ILE HA 1 122 GLN HE21 3.310 . 4.920 2.323 2.323 2.323 . 0 0 "[ ]" 2
649 1 119 ILE HA 1 122 GLN HE22 3.370 . 5.040 3.351 3.351 3.351 . 0 0 "[ ]" 2
650 1 119 ILE HA 1 122 GLN QG 3.120 . 4.540 4.058 4.058 4.058 . 0 0 "[ ]" 2
651 1 119 ILE HA 1 122 GLN H 2.810 . 3.930 3.234 3.234 3.234 . 0 0 "[ ]" 2
652 1 116 GLU HA 1 119 ILE HB 2.730 . 3.760 3.343 3.343 3.343 . 0 0 "[ ]" 2
653 1 119 ILE HB 1 119 ILE MD 2.790 . 3.890 2.428 2.428 2.428 . 0 0 "[ ]" 2
654 1 119 ILE H 1 119 ILE HB 2.400 . 3.110 2.376 2.376 2.376 . 0 0 "[ ]" 2
655 1 119 ILE HB 1 120 MET H 2.650 . 3.600 2.582 2.582 2.582 . 0 0 "[ ]" 2
656 1 116 GLU HA 1 119 ILE MD 2.890 . 4.080 2.724 2.724 2.724 . 0 0 "[ ]" 2
657 1 119 ILE MD 1 119 ILE MG 2.490 . 3.280 1.881 1.881 1.881 . 0 0 "[ ]" 2
658 1 106 LYS QE 1 119 ILE MD 3.850 . 6.000 3.752 3.752 3.752 . 0 0 "[ ]" 2
659 1 119 ILE QG 1 119 ILE MG 2.900 . 4.100 2.288 2.288 2.288 . 0 0 "[ ]" 2
660 1 116 GLU HA 1 119 ILE MG 3.570 . 5.440 4.530 4.530 4.530 . 0 0 "[ ]" 2
661 1 106 LYS QE 1 119 ILE MG 3.520 . 5.330 3.221 3.221 3.221 . 0 0 "[ ]" 2
662 1 119 ILE MG 1 121 LEU H 3.850 . 6.000 4.976 4.976 4.976 . 0 0 "[ ]" 2
663 1 119 ILE MG 1 120 MET HA 3.250 . 4.790 3.768 3.768 3.768 . 0 0 "[ ]" 2
664 1 128 ILE HA 1 128 ILE QG 3.150 . 4.590 2.630 2.630 2.630 . 0 0 "[ ]" 2
665 1 128 ILE HA 1 129 THR H 2.600 . 3.500 2.462 2.462 2.462 . 0 0 "[ ]" 2
666 1 128 ILE HB 1 132 ASP HB2 3.250 . 4.800 4.585 4.585 4.585 . 0 0 "[ ]" 2
667 1 128 ILE HA 1 128 ILE HB 2.650 . 3.600 3.017 3.017 3.017 . 0 0 "[ ]" 2
668 1 128 ILE HB 1 128 ILE MD 2.880 . 4.060 3.176 3.176 3.176 . 0 0 "[ ]" 2
669 1 128 ILE MD 1 132 ASP HB3 3.000 . 4.290 3.256 3.256 3.256 . 0 0 "[ ]" 2
670 1 128 ILE MD 1 132 ASP HB2 3.170 . 4.630 3.098 3.098 3.098 . 0 0 "[ ]" 2
671 1 128 ILE HA 1 128 ILE MD 2.810 . 3.930 1.986 1.986 1.986 . 0 0 "[ ]" 2
672 1 128 ILE H 1 128 ILE MD 3.240 . 4.780 3.884 3.884 3.884 . 0 0 "[ ]" 2
673 1 128 ILE MD 1 129 THR H 3.660 . 5.620 2.688 2.688 2.688 . 0 0 "[ ]" 2
674 1 128 ILE QG 1 132 ASP HB2 3.270 . 4.840 4.320 4.320 4.320 . 0 0 "[ ]" 2
675 1 128 ILE QG 1 132 ASP HB3 3.350 . 5.000 4.069 4.069 4.069 . 0 0 "[ ]" 2
676 1 133 ILE HA 1 134 GLU H 3.410 . 5.120 3.341 3.341 3.341 . 0 0 "[ ]" 2
677 1 133 ILE HA 1 133 ILE QG 2.940 . 4.180 2.472 2.472 2.472 . 0 0 "[ ]" 2
678 1 133 ILE HA 1 136 LEU QB 3.040 . 4.370 2.202 2.202 2.202 . 0 0 "[ ]" 2
679 1 130 GLU HA 1 133 ILE HB 2.730 . 3.750 2.507 2.507 2.507 . 0 0 "[ ]" 2
680 1 133 ILE HA 1 133 ILE HB 2.790 . 3.870 3.036 3.036 3.036 . 0 0 "[ ]" 2
681 1 133 ILE HB 1 133 ILE QG 2.660 . 3.620 2.405 2.405 2.405 . 0 0 "[ ]" 2
682 1 118 LYS HA 1 133 ILE MD 2.720 . 3.740 2.211 2.211 2.211 . 0 0 "[ ]" 2
683 1 121 LEU H 1 133 ILE MD 3.850 . 6.000 4.958 4.958 4.958 . 0 0 "[ ]" 2
684 1 133 ILE HA 1 133 ILE MG 2.520 . 3.350 2.218 2.218 2.218 . 0 0 "[ ]" 2
685 1 118 LYS HA 1 133 ILE MG 2.850 . 4.000 2.294 2.294 2.294 . 0 0 "[ ]" 2
686 1 133 ILE MG 1 137 MET H 3.300 . 4.900 3.842 3.842 3.842 . 0 0 "[ ]" 2
687 1 148 ILE HA 1 148 ILE HB 2.790 . 3.890 3.006 3.006 3.006 . 0 0 "[ ]" 2
688 1 148 ILE HA 1 148 ILE QG 2.610 . 3.520 2.178 2.178 2.178 . 0 0 "[ ]" 2
689 1 148 ILE HA 1 148 ILE MG 2.580 . 3.470 2.586 2.586 2.586 . 0 0 "[ ]" 2
690 1 112 ILE HB 1 148 ILE HB 2.390 . 3.080 2.723 2.723 2.723 . 0 0 "[ ]" 2
691 1 148 ILE HB 1 148 ILE MD 2.980 . 4.250 2.405 2.405 2.405 . 0 0 "[ ]" 2
692 1 147 ARG HA 1 148 ILE HB 3.250 . 4.800 4.156 4.156 4.156 . 0 0 "[ ]" 2
693 1 148 ILE MD 1 156 PHE QB 3.850 . 6.000 3.022 3.022 3.022 . 0 0 "[ ]" 2
694 1 148 ILE MD 1 156 PHE H 3.850 . 6.000 5.002 5.002 5.002 . 0 0 "[ ]" 2
695 1 112 ILE HB 1 148 ILE MD 3.340 . 4.980 4.031 4.031 4.031 . 0 0 "[ ]" 2
696 1 148 ILE HA 1 148 ILE MD 3.120 . 4.540 3.689 3.689 3.689 . 0 0 "[ ]" 2
697 1 148 ILE MD 1 148 ILE MG 2.850 . 4.000 1.713 1.713 1.713 . 0 0 "[ ]" 2
698 1 148 ILE QG 1 148 ILE MG 2.870 . 4.040 2.409 2.409 2.409 . 0 0 "[ ]" 2
699 1 148 ILE MG 1 154 LEU H 3.850 . 6.000 4.656 4.656 4.656 . 0 0 "[ ]" 2
700 1 106 LYS QB 1 106 LYS QE 3.850 . 6.000 3.136 3.136 3.136 . 0 0 "[ ]" 2
701 1 106 LYS HA 1 106 LYS QD 3.370 . 5.040 2.847 2.847 2.847 . 0 0 "[ ]" 2
702 1 106 LYS HA 1 106 LYS QG 3.490 . 5.280 2.379 2.379 2.379 . 0 0 "[ ]" 2
703 1 118 LYS HA 1 119 ILE H 3.510 . 5.320 3.532 3.532 3.532 . 0 0 "[ ]" 2
704 1 118 LYS HA 1 133 ILE QG 3.850 . 6.000 3.968 3.968 3.968 . 0 0 "[ ]" 2
705 1 118 LYS HA 1 118 LYS QG 3.270 . 4.840 2.294 2.294 2.294 . 0 0 "[ ]" 2
706 1 118 LYS H 1 118 LYS HA 2.880 . 4.060 2.839 2.839 2.839 . 0 0 "[ ]" 2
707 1 118 LYS HA 1 121 LEU HB3 3.390 . 5.080 5.014 5.014 5.014 . 0 0 "[ ]" 2
708 1 118 LYS HA 1 121 LEU HB2 3.120 . 4.540 3.492 3.492 3.492 . 0 0 "[ ]" 2
709 1 118 LYS HA 1 121 LEU H 3.330 . 4.960 3.846 3.846 3.846 . 0 0 "[ ]" 2
710 1 118 LYS H 1 118 LYS QG 3.380 . 5.060 2.274 2.274 2.274 . 0 0 "[ ]" 2
711 1 138 LYS QB 1 138 LYS QG 2.310 . 2.930 2.051 2.051 2.051 . 0 0 "[ ]" 2
712 1 138 LYS QE 1 138 LYS QG 3.170 . 4.640 2.042 2.042 2.042 . 0 0 "[ ]" 2
713 1 142 LYS HA 1 142 LYS QE 3.850 . 6.000 4.489 4.489 4.489 . 0 0 "[ ]" 2
714 1 142 LYS HA 1 142 LYS QG 3.250 . 4.800 2.283 2.283 2.283 . 0 0 "[ ]" 2
715 1 142 LYS QE 1 155 GLU QB 3.850 . 6.000 4.492 4.492 4.492 . 0 0 "[ ]" 2
716 1 142 LYS QB 1 142 LYS QE 3.850 . 6.000 3.555 3.555 3.555 . 0 0 "[ ]" 2
717 1 158 LYS HA 1 158 LYS QG 2.950 . 4.200 2.139 2.139 2.139 . 0 0 "[ ]" 2
718 1 158 LYS H 1 158 LYS QD 3.850 . 6.000 4.218 4.218 4.218 . 0 0 "[ ]" 2
719 1 92 LYS HA 1 92 LYS QB 2.660 . 3.620 2.295 2.295 2.295 . 0 0 "[ ]" 2
720 1 92 LYS H 1 92 LYS QB 2.710 . 3.720 2.866 2.866 2.866 . 0 0 "[ ]" 2
721 1 100 LEU HA 1 100 LEU MD1 3.140 . 4.580 3.707 3.707 3.707 . 0 0 "[ ]" 2
722 1 100 LEU QB 1 100 LEU MD1 3.060 . 4.420 2.109 2.109 2.109 . 0 0 "[ ]" 2
723 1 97 LEU HA 1 100 LEU QB 2.810 . 3.920 2.779 2.779 2.779 . 0 0 "[ ]" 2
724 1 100 LEU MD1 1 101 PHE H 3.850 . 6.000 4.758 4.758 4.758 . 0 0 "[ ]" 2
725 1 92 LYS QE 1 100 LEU MD1 3.850 . 6.000 4.675 4.675 4.675 . 0 0 "[ ]" 2
726 1 100 LEU H 1 100 LEU MD1 3.850 . 6.000 3.655 3.655 3.655 . 0 0 "[ ]" 2
727 1 97 LEU HA 1 100 LEU MD1 3.450 . 5.200 2.858 2.858 2.858 . 0 0 "[ ]" 2
728 1 100 LEU HA 1 100 LEU HG 3.440 . 5.180 2.858 2.858 2.858 . 0 0 "[ ]" 2
729 1 100 LEU QB 1 100 LEU HG 2.640 . 3.580 2.342 2.342 2.342 . 0 0 "[ ]" 2
730 1 100 LEU H 1 100 LEU HG 3.300 . 4.900 2.411 2.411 2.411 . 0 0 "[ ]" 2
731 1 97 LEU HA 1 100 LEU HG 3.830 . 5.960 4.075 4.075 4.075 . 0 0 "[ ]" 2
732 1 114 LEU HA 1 117 LEU H 3.440 . 5.180 3.357 3.357 3.357 . 0 0 "[ ]" 2
733 1 114 LEU MD2 1 116 GLU H 3.850 . 6.000 4.957 4.957 4.957 . 0 0 "[ ]" 2
734 1 114 LEU MD2 1 134 GLU HA 3.850 . 6.000 2.707 2.707 2.707 . 0 0 "[ ]" 2
735 1 114 LEU MD2 1 134 GLU QG 3.850 . 6.000 3.013 3.013 3.013 . 0 0 "[ ]" 2
736 1 114 LEU MD2 1 118 LYS QE 3.850 . 6.000 2.151 2.151 2.151 . 0 0 "[ ]" 2
737 1 114 LEU HA 1 114 LEU MD2 3.850 . 6.000 2.643 2.643 2.643 . 0 0 "[ ]" 2
738 1 114 LEU H 1 114 LEU MD2 3.850 . 6.000 4.299 4.299 4.299 . 0 0 "[ ]" 2
739 1 114 LEU MD2 1 137 MET ME 3.850 . 6.000 3.984 3.984 3.984 . 0 0 "[ ]" 2
740 1 114 LEU MD2 1 137 MET QG 3.850 . 6.000 3.945 3.945 3.945 . 0 0 "[ ]" 2
741 1 114 LEU MD1 1 134 GLU H 3.850 . 6.000 4.858 4.858 4.858 . 0 0 "[ ]" 2
742 1 114 LEU MD1 1 118 LYS QE 3.850 . 6.000 3.950 3.950 3.950 . 0 0 "[ ]" 2
743 1 114 LEU HA 1 114 LEU MD1 3.120 . 4.540 3.600 3.600 3.600 . 0 0 "[ ]" 2
744 1 114 LEU H 1 114 LEU MD1 3.850 . 6.000 3.840 3.840 3.840 . 0 0 "[ ]" 2
745 1 114 LEU MD1 1 137 MET ME 3.850 . 6.000 3.930 3.930 3.930 . 0 0 "[ ]" 2
746 1 114 LEU MD1 1 137 MET QG 3.730 . 5.760 2.509 2.509 2.509 . 0 0 "[ ]" 2
747 1 114 LEU MD1 1 137 MET H 3.850 . 6.000 3.874 3.874 3.874 . 0 0 "[ ]" 2
748 1 114 LEU HG 1 115 GLU H 3.850 . 6.000 4.906 4.906 4.906 . 0 0 "[ ]" 2
749 1 114 LEU HA 1 114 LEU HG 3.350 . 5.000 2.115 2.115 2.115 . 0 0 "[ ]" 2
750 1 114 LEU H 1 114 LEU HG 3.400 . 5.100 3.904 3.904 3.904 . 0 0 "[ ]" 2
751 1 117 LEU HA 1 118 LYS H 3.690 . 5.670 3.545 3.545 3.545 . 0 0 "[ ]" 2
752 1 117 LEU HA 1 121 LEU H 3.850 . 6.000 4.327 4.327 4.327 . 0 0 "[ ]" 2
753 1 117 LEU HB2 1 118 LYS H 3.540 . 5.380 3.880 3.880 3.880 . 0 0 "[ ]" 2
754 1 117 LEU H 1 117 LEU HB2 3.120 . 4.540 2.370 2.370 2.370 . 0 0 "[ ]" 2
755 1 117 LEU HB3 1 118 LYS H 3.260 . 4.820 2.646 2.646 2.646 . 0 0 "[ ]" 2
756 1 117 LEU MD2 1 156 PHE HZ 3.850 . 6.000 2.523 2.523 2.523 . 0 0 "[ ]" 2
757 1 117 LEU MD2 1 118 LYS H 3.850 . 6.000 4.058 4.058 4.058 . 0 0 "[ ]" 2
758 1 117 LEU H 1 117 LEU MD2 3.850 . 6.000 4.173 4.173 4.173 . 0 0 "[ ]" 2
759 1 117 LEU MD2 1 137 MET H 3.850 . 6.000 3.373 3.373 3.373 . 0 0 "[ ]" 2
760 1 117 LEU MD1 1 156 PHE HZ 3.850 . 6.000 3.354 3.354 3.354 . 0 0 "[ ]" 2
761 1 117 LEU HA 1 117 LEU MD1 3.100 . 4.500 2.181 2.181 2.181 . 0 0 "[ ]" 2
762 1 117 LEU H 1 117 LEU MD1 3.850 . 6.000 3.944 3.944 3.944 . 0 0 "[ ]" 2
763 1 117 LEU H 1 117 LEU HG 3.850 . 6.000 4.384 4.384 4.384 . 0 0 "[ ]" 2
764 1 121 LEU HA 1 121 LEU HB3 2.650 . 3.590 2.430 2.430 2.430 . 0 0 "[ ]" 2
765 1 121 LEU HA 1 121 LEU MD2 2.880 . 4.060 2.164 2.164 2.164 . 0 0 "[ ]" 2
766 1 121 LEU HA 1 122 GLN H 3.060 . 4.420 3.532 3.532 3.532 . 0 0 "[ ]" 2
767 1 121 LEU HA 1 124 THR MG 3.620 . 5.540 4.614 4.614 4.614 . 0 0 "[ ]" 2
768 1 121 LEU H 1 121 LEU HB3 2.760 . 3.820 3.542 3.542 3.542 . 0 0 "[ ]" 2
769 1 121 LEU HB3 1 122 GLN H 3.400 . 5.100 3.877 3.877 3.877 . 0 0 "[ ]" 2
770 1 121 LEU H 1 121 LEU HB2 2.610 . 3.520 2.482 2.482 2.482 . 0 0 "[ ]" 2
771 1 121 LEU HB3 1 121 LEU MD2 3.400 . 5.100 2.216 2.216 2.216 . 0 0 "[ ]" 2
772 1 121 LEU H 1 121 LEU MD2 3.850 . 6.000 3.126 3.126 3.126 . 0 0 "[ ]" 2
773 1 121 LEU MD2 1 122 GLN H 3.850 . 6.000 4.583 4.583 4.583 . 0 0 "[ ]" 2
774 1 121 LEU MD1 1 156 PHE HZ 3.850 . 6.000 4.185 4.185 4.185 . 0 0 "[ ]" 2
775 1 121 LEU MD1 1 133 ILE HA 3.850 . 6.000 3.679 3.679 3.679 . 0 0 "[ ]" 2
776 1 118 LYS HA 1 121 LEU MD1 3.850 . 6.000 2.695 2.695 2.695 . 0 0 "[ ]" 2
777 1 121 LEU HA 1 121 LEU MD1 3.850 . 6.000 3.850 3.850 3.850 . 0 0 "[ ]" 2
778 1 121 LEU HB3 1 121 LEU MD1 3.480 . 5.260 2.309 2.309 2.309 . 0 0 "[ ]" 2
779 1 121 LEU H 1 121 LEU MD1 3.850 . 6.000 3.364 3.364 3.364 . 0 0 "[ ]" 2
780 1 121 LEU HA 1 121 LEU HG 3.690 . 5.680 3.105 3.105 3.105 . 0 0 "[ ]" 2
781 1 121 LEU H 1 121 LEU HG 3.170 . 4.630 1.857 1.857 1.857 . 0 0 "[ ]" 2
782 1 136 LEU HA 1 136 LEU QB 2.650 . 3.600 2.539 2.539 2.539 . 0 0 "[ ]" 2
783 1 136 LEU MD1 1 156 PHE HZ 3.850 . 6.000 1.853 1.853 1.853 . 0 0 "[ ]" 2
784 1 133 ILE HA 1 136 LEU MD1 3.680 . 5.660 4.605 4.605 4.605 . 0 0 "[ ]" 2
785 1 136 LEU H 1 136 LEU MD1 3.850 . 6.000 4.061 4.061 4.061 . 0 0 "[ ]" 2
786 1 136 LEU MD2 1 156 PHE HZ 3.850 . 6.000 4.385 4.385 4.385 . 0 0 "[ ]" 2
787 1 136 LEU H 1 136 LEU MD2 3.850 . 6.000 2.239 2.239 2.239 . 0 0 "[ ]" 2
788 1 136 LEU HA 1 136 LEU HG 3.660 . 5.620 3.528 3.528 3.528 . 0 0 "[ ]" 2
789 1 136 LEU H 1 136 LEU HG 3.120 . 4.540 3.960 3.960 3.960 . 0 0 "[ ]" 2
790 1 136 LEU HG 1 137 MET H 3.850 . 6.000 5.021 5.021 5.021 . 0 0 "[ ]" 2
791 1 154 LEU HA 1 154 LEU QD 3.350 . 5.000 1.826 1.826 1.826 . 0 0 "[ ]" 2
792 1 97 LEU QD 1 154 LEU HA 3.590 . 5.480 2.873 2.873 2.873 . 0 0 "[ ]" 2
793 1 154 LEU HA 1 154 LEU HB3 2.650 . 3.610 2.830 2.830 2.830 . 0 0 "[ ]" 2
794 1 154 LEU H 1 154 LEU HB3 2.720 . 3.740 3.305 3.305 3.305 . 0 0 "[ ]" 2
795 1 154 LEU HA 1 154 LEU HB2 2.740 . 3.780 2.892 2.892 2.892 . 0 0 "[ ]" 2
796 1 94 GLU QG 1 154 LEU QD 3.850 . 6.000 3.706 3.706 3.706 . 0 0 "[ ]" 2
797 1 154 LEU H 1 154 LEU QD 3.850 . 6.000 2.355 2.355 2.355 . 0 0 "[ ]" 2
798 1 154 LEU QD 1 155 GLU HA 3.850 . 6.000 4.330 4.330 4.330 . 0 0 "[ ]" 2
799 1 154 LEU QD 1 158 LYS QE 3.850 . 6.000 3.543 3.543 3.543 . 0 0 "[ ]" 2
800 1 98 SER QB 1 154 LEU QD 3.850 . 6.000 3.685 3.685 3.685 . 0 0 "[ ]" 2
801 1 98 SER H 1 154 LEU QD 3.850 . 6.000 3.895 3.895 3.895 . 0 0 "[ ]" 2
802 1 94 GLU QG 1 154 LEU MD2 3.770 . 5.840 5.383 5.383 5.383 . 0 0 "[ ]" 2
803 1 151 ASP HA 1 154 LEU HG 3.850 . 6.000 4.122 4.122 4.122 . 0 0 "[ ]" 2
804 1 154 LEU HA 1 154 LEU HG 3.710 . 5.720 3.504 3.504 3.504 . 0 0 "[ ]" 2
805 1 154 LEU H 1 154 LEU HG 3.100 . 4.500 4.161 4.161 4.161 . 0 0 "[ ]" 2
806 1 97 LEU HA 1 100 LEU H 2.950 . 4.200 3.845 3.845 3.845 . 0 0 "[ ]" 2
807 1 97 LEU HA 1 97 LEU HB3 2.650 . 3.600 2.618 2.618 2.618 . 0 0 "[ ]" 2
808 1 97 LEU HA 1 97 LEU HG 2.940 . 4.170 2.498 2.498 2.498 . 0 0 "[ ]" 2
809 1 97 LEU HA 1 98 SER H 3.070 . 4.440 3.572 3.572 3.572 . 0 0 "[ ]" 2
810 1 94 GLU HA 1 97 LEU HB2 2.650 . 3.600 2.991 2.991 2.991 . 0 0 "[ ]" 2
811 1 97 LEU HA 1 97 LEU HB2 2.660 . 3.620 3.014 3.014 3.014 . 0 0 "[ ]" 2
812 1 97 LEU H 1 97 LEU HB2 2.500 . 3.290 2.139 2.139 2.139 . 0 0 "[ ]" 2
813 1 97 LEU HA 1 97 LEU QD 3.060 . 4.420 2.222 2.222 2.222 . 0 0 "[ ]" 2
814 1 97 LEU H 1 97 LEU QD 3.850 . 6.000 3.113 3.113 3.113 . 0 0 "[ ]" 2
815 1 97 LEU HB3 1 97 LEU HG 2.650 . 3.600 3.006 3.006 3.006 . 0 0 "[ ]" 2
816 1 97 LEU HB2 1 97 LEU HG 2.820 . 3.940 2.624 2.624 2.624 . 0 0 "[ ]" 2
817 1 103 MET HA 1 104 PHE H 2.980 . 4.260 3.428 3.428 3.428 . 0 0 "[ ]" 2
818 1 103 MET HA 1 103 MET QB 2.650 . 3.590 2.496 2.496 2.496 . 0 0 "[ ]" 2
819 1 103 MET HA 1 103 MET QG 2.810 . 3.920 2.034 2.034 2.034 . 0 0 "[ ]" 2
820 1 103 MET H 1 103 MET HA 2.520 . 3.350 2.974 2.974 2.974 . 0 0 "[ ]" 2
821 1 100 LEU HA 1 103 MET ME 3.670 . 5.640 2.787 2.787 2.787 . 0 0 "[ ]" 2
822 1 100 LEU QD 1 103 MET ME 3.850 . 6.000 2.505 2.505 2.505 . 0 0 "[ ]" 2
823 1 100 LEU H 1 103 MET ME 3.850 . 6.000 4.389 4.389 4.389 . 0 0 "[ ]" 2
824 1 103 MET HA 1 103 MET ME 3.850 . 6.000 4.058 4.058 4.058 . 0 0 "[ ]" 2
825 1 103 MET H 1 103 MET ME 3.850 . 6.000 4.188 4.188 4.188 . 0 0 "[ ]" 2
826 1 120 MET HA 1 121 LEU H 2.950 . 4.200 3.561 3.561 3.561 . 0 0 "[ ]" 2
827 1 117 LEU HA 1 120 MET QB 3.000 . 4.290 2.425 2.425 2.425 . 0 0 "[ ]" 2
828 1 120 MET QB 1 121 LEU H 2.760 . 3.820 2.592 2.592 2.592 . 0 0 "[ ]" 2
829 1 120 MET H 1 120 MET QB 2.480 . 3.270 2.126 2.126 2.126 . 0 0 "[ ]" 2
830 1 120 MET HA 1 120 MET QG 2.400 . 3.110 2.588 2.588 2.588 . 0 0 "[ ]" 2
831 1 120 MET QG 1 121 LEU H 2.650 . 3.610 3.196 3.196 3.196 . 0 0 "[ ]" 2
832 1 137 MET HA 1 140 GLY QA 3.250 . 4.790 3.344 3.344 3.344 . 0 0 "[ ]" 2
833 1 137 MET HA 1 148 ILE MD 3.050 . 4.400 3.037 3.037 3.037 . 0 0 "[ ]" 2
834 1 137 MET HA 1 138 LYS H 3.000 . 4.300 3.535 3.535 3.535 . 0 0 "[ ]" 2
835 1 137 MET HA 1 137 MET QB 2.660 . 3.620 2.293 2.293 2.293 . 0 0 "[ ]" 2
836 1 137 MET HA 1 137 MET QG 2.850 . 4.000 3.154 3.154 3.154 . 0 0 "[ ]" 2
837 1 137 MET H 1 137 MET HA 2.570 . 3.440 2.897 2.897 2.897 . 0 0 "[ ]" 2
838 1 133 ILE MG 1 137 MET QB 3.420 . 5.140 3.736 3.736 3.736 . 0 0 "[ ]" 2
839 1 115 GLU H 1 137 MET ME 3.850 . 6.000 4.929 4.929 4.929 . 0 0 "[ ]" 2
840 1 137 MET ME 1 156 PHE HZ 3.850 . 6.000 4.982 4.982 4.982 . 0 0 "[ ]" 2
841 1 137 MET ME 1 148 ILE HA 3.850 . 6.000 4.997 4.997 4.997 . 0 0 "[ ]" 2
842 1 137 MET ME 1 148 ILE MD 3.800 . 5.900 1.826 1.826 1.826 . 0 0 "[ ]" 2
843 1 137 MET ME 1 148 ILE QG 3.310 . 4.920 2.720 2.720 2.720 . 0 0 "[ ]" 2
844 1 137 MET ME 1 148 ILE MG 3.850 . 6.000 3.734 3.734 3.734 . 0 0 "[ ]" 2
845 1 137 MET ME 1 148 ILE H 3.450 . 5.200 4.206 4.206 4.206 . 0 0 "[ ]" 2
846 1 114 LEU HA 1 137 MET ME 3.020 . 4.340 2.498 2.498 2.498 . 0 0 "[ ]" 2
847 1 114 LEU H 1 137 MET ME 3.250 . 4.790 3.127 3.127 3.127 . 0 0 "[ ]" 2
848 1 117 LEU QD 1 137 MET ME 2.940 . 4.170 2.380 2.380 2.380 . 0 0 "[ ]" 2
849 1 137 MET ME 1 137 MET QG 3.290 . 4.870 2.332 2.332 2.332 . 0 0 "[ ]" 2
850 1 137 MET H 1 137 MET ME 3.850 . 6.000 4.321 4.321 4.321 . 0 0 "[ ]" 2
851 1 137 MET H 1 137 MET QG 3.020 . 4.340 3.869 3.869 3.869 . 0 0 "[ ]" 2
852 1 157 MET HA 1 157 MET QB 2.650 . 3.610 2.462 2.462 2.462 . 0 0 "[ ]" 2
853 1 157 MET HA 1 160 VAL MG2 3.460 . 5.220 3.366 3.366 3.366 . 0 0 "[ ]" 2
854 1 153 PHE HZ 1 157 MET ME 3.580 . 5.460 1.983 1.983 1.983 . 0 0 "[ ]" 2
855 1 156 PHE QB 1 157 MET ME 3.850 . 6.000 4.389 4.389 4.389 . 0 0 "[ ]" 2
856 1 100 LEU MD1 1 157 MET ME 3.430 . 5.160 3.348 3.348 3.348 . 0 0 "[ ]" 2
857 1 97 LEU HA 1 157 MET ME 3.850 . 6.000 4.348 4.348 4.348 . 0 0 "[ ]" 2
858 1 157 MET HA 1 157 MET ME 3.470 . 5.240 3.445 3.445 3.445 . 0 0 "[ ]" 2
859 1 157 MET H 1 157 MET ME 3.850 . 6.000 4.307 4.307 4.307 . 0 0 "[ ]" 2
860 1 107 ASN HB3 1 108 ALA H 2.380 . 3.070 3.103 3.103 3.103 0.033 1 0 "[ ]" 2
861 1 107 ASN HB3 1 107 ASN HD21 2.730 . 3.770 3.588 3.588 3.588 . 0 0 "[ ]" 2
862 1 107 ASN HB2 1 107 ASN HD21 2.810 . 3.920 2.888 2.888 2.888 . 0 0 "[ ]" 2
863 1 143 ASN HA 1 143 ASN HD21 3.850 . 6.000 4.585 4.585 4.585 . 0 0 "[ ]" 2
864 1 143 ASN HA 1 144 ASN HD22 3.830 . 5.960 5.090 5.090 5.090 . 0 0 "[ ]" 2
865 1 143 ASN HA 1 143 ASN HB3 2.650 . 3.590 2.550 2.550 2.550 . 0 0 "[ ]" 2
866 1 143 ASN HB3 1 143 ASN HD21 3.390 . 5.080 3.042 3.042 3.042 . 0 0 "[ ]" 2
867 1 143 ASN HA 1 143 ASN HB2 2.650 . 3.600 2.405 2.405 2.405 . 0 0 "[ ]" 2
868 1 143 ASN HB2 1 143 ASN HD21 3.330 . 4.960 2.347 2.347 2.347 . 0 0 "[ ]" 2
869 1 144 ASN HA 1 145 ASP H 2.790 . 3.880 2.520 2.520 2.520 . 0 0 "[ ]" 2
870 1 144 ASN HA 1 144 ASN HB2 2.700 . 3.700 3.018 3.018 3.018 . 0 0 "[ ]" 2
871 1 144 ASN HA 1 144 ASN HB3 2.650 . 3.590 2.605 2.605 2.605 . 0 0 "[ ]" 2
872 1 143 ASN HA 1 144 ASN HB2 3.520 . 5.330 3.906 3.906 3.906 . 0 0 "[ ]" 2
873 1 144 ASN HB2 1 144 ASN HD21 3.320 . 4.940 2.423 2.423 2.423 . 0 0 "[ ]" 2
874 1 144 ASN HB3 1 144 ASN HD21 3.450 . 5.200 3.578 3.578 3.578 . 0 0 "[ ]" 2
875 1 121 LEU HB2 1 122 GLN HA 3.850 . 6.000 4.179 4.179 4.179 . 0 0 "[ ]" 2
876 1 122 GLN HA 1 122 GLN QG 2.730 . 3.770 2.141 2.141 2.141 . 0 0 "[ ]" 2
877 1 122 GLN QB 1 122 GLN HE22 3.850 . 6.000 3.352 3.352 3.352 . 0 0 "[ ]" 2
878 1 102 ARG HA 1 102 ARG QD 3.820 . 5.940 4.031 4.031 4.031 . 0 0 "[ ]" 2
879 1 102 ARG H 1 102 ARG QD 3.850 . 6.000 4.345 4.345 4.345 . 0 0 "[ ]" 2
880 1 102 ARG HA 1 102 ARG QG 3.270 . 4.830 2.346 2.346 2.346 . 0 0 "[ ]" 2
881 1 147 ARG HB2 1 148 ILE H 2.770 . 3.850 3.858 3.858 3.858 0.008 1 0 "[ ]" 2
882 1 147 ARG HA 1 147 ARG HB2 2.670 . 3.630 3.035 3.035 3.035 . 0 0 "[ ]" 2
883 1 147 ARG HB2 1 147 ARG QD 2.990 . 4.280 3.073 3.073 3.073 . 0 0 "[ ]" 2
884 1 111 TYR HB2 1 147 ARG HB2 3.020 . 4.340 4.218 4.218 4.218 . 0 0 "[ ]" 2
885 1 147 ARG HA 1 147 ARG HB3 2.660 . 3.620 2.454 2.454 2.454 . 0 0 "[ ]" 2
886 1 147 ARG HB3 1 147 ARG QD 2.730 . 3.760 2.007 2.007 2.007 . 0 0 "[ ]" 2
887 1 111 TYR HB2 1 147 ARG HB3 2.950 . 4.200 2.683 2.683 2.683 . 0 0 "[ ]" 2
888 1 147 ARG HA 1 147 ARG QG 2.850 . 4.000 2.343 2.343 2.343 . 0 0 "[ ]" 2
889 1 147 ARG H 1 147 ARG QG 2.790 . 3.880 2.454 2.454 2.454 . 0 0 "[ ]" 2
890 1 89 SER HA 1 90 LYS H 3.060 . 4.410 3.591 3.591 3.591 . 0 0 "[ ]" 2
891 1 98 SER HA 1 99 ASP H 3.770 . 5.840 3.586 3.586 3.586 . 0 0 "[ ]" 2
892 1 98 SER HA 1 101 PHE H 3.720 . 5.740 3.577 3.577 3.577 . 0 0 "[ ]" 2
893 1 98 SER QB 1 99 ASP H 3.370 . 5.040 3.166 3.166 3.166 . 0 0 "[ ]" 2
894 1 98 SER H 1 98 SER QB 3.040 . 4.380 2.083 2.083 2.083 . 0 0 "[ ]" 2
895 1 124 THR HA 1 124 THR MG 3.120 . 4.540 2.094 2.094 2.094 . 0 0 "[ ]" 2
896 1 124 THR H 1 124 THR HA 2.830 . 3.960 2.992 2.992 2.992 . 0 0 "[ ]" 2
897 1 124 THR HB 1 124 THR MG 2.420 . 3.130 2.110 2.110 2.110 . 0 0 "[ ]" 2
898 1 124 THR H 1 124 THR HB 2.920 . 4.140 3.739 3.739 3.739 . 0 0 "[ ]" 2
899 1 127 THR HA 1 127 THR HB 2.640 . 3.580 2.598 2.598 2.598 . 0 0 "[ ]" 2
900 1 127 THR HA 1 127 THR MG 3.070 . 4.440 2.284 2.284 2.284 . 0 0 "[ ]" 2
901 1 127 THR H 1 127 THR HB 3.160 . 4.620 3.535 3.535 3.535 . 0 0 "[ ]" 2
902 1 127 THR HB 1 127 THR MG 2.410 . 3.120 2.142 2.142 2.142 . 0 0 "[ ]" 2
903 1 129 THR HA 1 131 ASP H 3.730 . 5.750 3.988 3.988 3.988 . 0 0 "[ ]" 2
904 1 129 THR HA 1 129 THR MG 3.200 . 4.700 2.265 2.265 2.265 . 0 0 "[ ]" 2
905 1 129 THR HB 1 130 GLU H 2.320 . 2.940 2.674 2.674 2.674 . 0 0 "[ ]" 2
906 1 129 THR HB 1 129 THR MG 2.420 . 3.150 2.147 2.147 2.147 . 0 0 "[ ]" 2
907 1 93 THR HA 1 93 THR HB 2.640 . 3.580 3.028 3.028 3.028 . 0 0 "[ ]" 2
908 1 160 VAL HA 1 160 VAL HB 2.640 . 3.580 2.870 2.870 2.870 . 0 0 "[ ]" 2
909 1 160 VAL HA 1 160 VAL MG2 3.210 . 4.710 2.971 2.971 2.971 . 0 0 "[ ]" 2
910 1 160 VAL MG2 1 161 GLU H 3.850 . 6.000 2.473 2.473 2.473 . 0 0 "[ ]" 2
911 1 156 PHE HZ 1 160 VAL MG2 3.850 . 6.000 4.736 4.736 4.736 . 0 0 "[ ]" 2
912 1 160 VAL H 1 160 VAL MG2 3.270 . 4.830 2.274 2.274 2.274 . 0 0 "[ ]" 2
913 1 160 VAL MG1 1 161 GLU H 3.850 . 6.000 3.964 3.964 3.964 . 0 0 "[ ]" 2
914 1 157 MET HA 1 160 VAL MG1 3.850 . 6.000 4.895 4.895 4.895 . 0 0 "[ ]" 2
915 1 160 VAL HA 1 160 VAL MG1 3.380 . 5.050 2.031 2.031 2.031 . 0 0 "[ ]" 2
916 1 160 VAL H 1 160 VAL MG1 3.850 . 6.000 3.899 3.899 3.899 . 0 0 "[ ]" 2
917 1 101 PHE HZ 1 111 TYR HA 2.720 . 3.740 1.857 1.857 1.857 . 0 0 "[ ]" 2
918 1 111 TYR HA 1 111 TYR HB3 2.650 . 3.610 2.473 2.473 2.473 . 0 0 "[ ]" 2
919 1 111 TYR HA 1 111 TYR HB2 2.730 . 3.750 3.036 3.036 3.036 . 0 0 "[ ]" 2
920 1 111 TYR HA 1 150 TYR H 3.480 . 5.260 5.061 5.061 5.061 . 0 0 "[ ]" 2
921 1 111 TYR HB2 1 147 ARG QD 2.920 . 4.140 2.237 2.237 2.237 . 0 0 "[ ]" 2
922 1 150 TYR HA 1 151 ASP H 3.270 . 4.830 3.502 3.502 3.502 . 0 0 "[ ]" 2
923 1 150 TYR HA 1 152 GLU H 3.560 . 5.410 5.234 5.234 5.234 . 0 0 "[ ]" 2
924 1 150 TYR HA 1 153 PHE H 2.870 . 4.040 3.991 3.991 3.991 . 0 0 "[ ]" 2
925 1 148 ILE MG 1 150 TYR HA 3.850 . 6.000 4.605 4.605 4.605 . 0 0 "[ ]" 2
926 1 150 TYR HA 1 154 LEU H 3.250 . 4.790 4.259 4.259 4.259 . 0 0 "[ ]" 2
927 1 150 TYR HA 1 150 TYR HB2 2.650 . 3.610 2.466 2.466 2.466 . 0 0 "[ ]" 2
928 1 150 TYR HB2 1 151 ASP H 2.950 . 4.200 4.057 4.057 4.057 . 0 0 "[ ]" 2
929 1 150 TYR HB3 1 151 ASP H 2.730 . 3.760 2.908 2.908 2.908 . 0 0 "[ ]" 2
930 1 104 PHE QD 1 123 ALA MB 3.850 . 6.000 3.746 3.746 3.746 . 0 0 "[ ]" 2
931 1 109 ASP QB 1 111 TYR QD 3.850 . 6.000 4.331 4.331 4.331 . 0 0 "[ ]" 2
932 1 101 PHE QE 1 149 ASP HA 3.850 . 6.000 2.527 2.527 2.527 . 0 0 "[ ]" 2
933 1 111 TYR QD 1 149 ASP HA 3.370 . 5.040 3.405 3.405 3.405 . 0 0 "[ ]" 2
934 1 111 TYR QE 1 149 ASP HA 3.850 . 6.000 4.326 4.326 4.326 . 0 0 "[ ]" 2
935 1 111 TYR QD 1 149 ASP HB3 3.770 . 5.840 2.384 2.384 2.384 . 0 0 "[ ]" 2
936 1 111 TYR QD 1 149 ASP HB2 3.850 . 6.000 4.065 4.065 4.065 . 0 0 "[ ]" 2
937 1 111 TYR QE 1 149 ASP HB2 3.830 . 5.950 3.494 3.494 3.494 . 0 0 "[ ]" 2
938 1 150 TYR QD 1 151 ASP HA 3.850 . 6.000 4.575 4.575 4.575 . 0 0 "[ ]" 2
939 1 101 PHE HA 1 101 PHE QD 3.610 . 5.520 3.145 3.145 3.145 . 0 0 "[ ]" 2
940 1 101 PHE HA 1 104 PHE QD 3.850 . 6.000 4.256 4.256 4.256 . 0 0 "[ ]" 2
941 1 101 PHE QB 1 153 PHE QD 3.850 . 6.000 3.692 3.692 3.692 . 0 0 "[ ]" 2
942 1 101 PHE QB 1 150 TYR QE 3.850 . 6.000 4.223 4.223 4.223 . 0 0 "[ ]" 2
943 1 101 PHE QD 1 112 ILE MD 3.850 . 6.000 3.643 3.643 3.643 . 0 0 "[ ]" 2
944 1 104 PHE HA 1 104 PHE QD 3.850 . 6.000 2.402 2.402 2.402 . 0 0 "[ ]" 2
945 1 153 PHE HA 1 153 PHE QD 3.650 . 5.590 3.115 3.115 3.115 . 0 0 "[ ]" 2
946 1 112 ILE MD 1 153 PHE QD 3.850 . 6.000 4.240 4.240 4.240 . 0 0 "[ ]" 2
947 1 148 ILE MG 1 153 PHE QD 3.850 . 6.000 2.518 2.518 2.518 . 0 0 "[ ]" 2
948 1 153 PHE QD 1 154 LEU HA 3.850 . 6.000 2.645 2.645 2.645 . 0 0 "[ ]" 2
949 1 153 PHE QD 1 154 LEU QD 3.850 . 6.000 2.419 2.419 2.419 . 0 0 "[ ]" 2
950 1 97 LEU HB3 1 153 PHE QD 3.850 . 6.000 3.278 3.278 3.278 . 0 0 "[ ]" 2
951 1 97 LEU QD 1 153 PHE QD 3.850 . 6.000 3.061 3.061 3.061 . 0 0 "[ ]" 2
952 1 112 ILE MD 1 153 PHE QE 3.850 . 6.000 4.426 4.426 4.426 . 0 0 "[ ]" 2
953 1 100 LEU MD1 1 153 PHE QE 3.850 . 6.000 4.099 4.099 4.099 . 0 0 "[ ]" 2
954 1 153 PHE QE 1 154 LEU QD 3.850 . 6.000 3.633 3.633 3.633 . 0 0 "[ ]" 2
955 1 97 LEU QD 1 153 PHE QE 3.850 . 6.000 1.876 1.876 1.876 . 0 0 "[ ]" 2
956 1 156 PHE HA 1 156 PHE QD 3.620 . 5.540 1.915 1.915 1.915 . 0 0 "[ ]" 2
957 1 101 PHE QE 1 110 GLY QA 3.850 . 6.000 3.209 3.209 3.209 . 0 0 "[ ]" 2
958 1 140 GLY QA 1 156 PHE QD 3.850 . 6.000 2.275 2.275 2.275 . 0 0 "[ ]" 2
959 1 101 PHE QE 1 112 ILE MD 3.850 . 6.000 3.676 3.676 3.676 . 0 0 "[ ]" 2
960 1 104 PHE QE 1 119 ILE MG 3.850 . 6.000 4.352 4.352 4.352 . 0 0 "[ ]" 2
961 1 148 ILE MD 1 156 PHE QE 3.850 . 6.000 3.238 3.238 3.238 . 0 0 "[ ]" 2
962 1 101 PHE QD 1 148 ILE MG 3.850 . 6.000 3.237 3.237 3.237 . 0 0 "[ ]" 2
963 1 101 PHE QE 1 148 ILE MG 3.850 . 6.000 2.333 2.333 2.333 . 0 0 "[ ]" 2
964 1 100 LEU HA 1 104 PHE QD 3.850 . 6.000 2.800 2.800 2.800 . 0 0 "[ ]" 2
965 1 100 LEU QB 1 104 PHE QD 3.830 . 5.950 2.778 2.778 2.778 . 0 0 "[ ]" 2
966 1 100 LEU MD1 1 104 PHE QD 3.640 . 5.580 4.111 4.111 4.111 . 0 0 "[ ]" 2
967 1 100 LEU HG 1 104 PHE QD 3.850 . 6.000 4.888 4.888 4.888 . 0 0 "[ ]" 2
968 1 136 LEU MD1 1 156 PHE QD 3.850 . 6.000 3.841 3.841 3.841 . 0 0 "[ ]" 2
969 1 136 LEU MD1 1 156 PHE QE 3.850 . 6.000 1.884 1.884 1.884 . 0 0 "[ ]" 2
970 1 136 LEU MD2 1 156 PHE QE 3.850 . 6.000 3.941 3.941 3.941 . 0 0 "[ ]" 2
971 1 150 TYR QD 1 154 LEU QD 3.850 . 6.000 2.791 2.791 2.791 . 0 0 "[ ]" 2
972 1 150 TYR QE 1 154 LEU QD 3.850 . 6.000 2.246 2.246 2.246 . 0 0 "[ ]" 2
973 1 97 LEU HA 1 153 PHE QE 3.850 . 6.000 2.725 2.725 2.725 . 0 0 "[ ]" 2
974 1 97 LEU HB3 1 153 PHE QE 3.850 . 6.000 2.516 2.516 2.516 . 0 0 "[ ]" 2
975 1 97 LEU HB2 1 153 PHE QE 3.850 . 6.000 4.112 4.112 4.112 . 0 0 "[ ]" 2
976 1 103 MET ME 1 104 PHE QD 3.850 . 6.000 4.228 4.228 4.228 . 0 0 "[ ]" 2
977 1 104 PHE QD 1 120 MET HA 3.850 . 6.000 2.149 2.149 2.149 . 0 0 "[ ]" 2
978 1 104 PHE QE 1 120 MET HA 3.850 . 6.000 2.227 2.227 2.227 . 0 0 "[ ]" 2
979 1 120 MET ME 1 153 PHE QE 3.850 . 6.000 2.453 2.453 2.453 . 0 0 "[ ]" 2
980 1 104 PHE QE 1 120 MET QG 3.850 . 6.000 3.084 3.084 3.084 . 0 0 "[ ]" 2
981 1 137 MET ME 1 156 PHE QD 3.850 . 6.000 4.454 4.454 4.454 . 0 0 "[ ]" 2
982 1 137 MET ME 1 156 PHE QE 3.850 . 6.000 3.814 3.814 3.814 . 0 0 "[ ]" 2
983 1 156 PHE QD 1 157 MET HA 3.850 . 6.000 4.309 4.309 4.309 . 0 0 "[ ]" 2
984 1 156 PHE QD 1 157 MET ME 3.850 . 6.000 4.158 4.158 4.158 . 0 0 "[ ]" 2
985 1 156 PHE QE 1 157 MET ME 3.850 . 6.000 4.359 4.359 4.359 . 0 0 "[ ]" 2
986 1 101 PHE QD 1 102 ARG HA 3.850 . 6.000 2.477 2.477 2.477 . 0 0 "[ ]" 2
987 1 111 TYR QD 1 147 ARG HB2 3.850 . 6.000 3.382 3.382 3.382 . 0 0 "[ ]" 2
988 1 111 TYR QD 1 147 ARG HB3 3.850 . 6.000 3.068 3.068 3.068 . 0 0 "[ ]" 2
989 1 111 TYR QD 1 147 ARG QD 3.850 . 6.000 3.888 3.888 3.888 . 0 0 "[ ]" 2
990 1 111 TYR QD 1 147 ARG QG 3.850 . 6.000 4.797 4.797 4.797 . 0 0 "[ ]" 2
991 1 98 SER HA 1 150 TYR QE 3.580 . 5.460 2.051 2.051 2.051 . 0 0 "[ ]" 2
992 1 98 SER QB 1 150 TYR QE 3.850 . 6.000 2.276 2.276 2.276 . 0 0 "[ ]" 2
993 1 156 PHE QD 1 160 VAL MG2 3.850 . 6.000 2.575 2.575 2.575 . 0 0 "[ ]" 2
994 1 156 PHE QE 1 160 VAL MG2 3.850 . 6.000 2.808 2.808 2.808 . 0 0 "[ ]" 2
995 1 101 PHE QE 1 111 TYR HA 3.850 . 6.000 3.265 3.265 3.265 . 0 0 "[ ]" 2
996 1 111 TYR HA 1 111 TYR QD 3.680 . 5.660 3.155 3.155 3.155 . 0 0 "[ ]" 2
997 1 111 TYR HA 1 111 TYR QE 3.850 . 6.000 4.700 4.700 4.700 . 0 0 "[ ]" 2
998 1 111 TYR QE 1 149 ASP HB3 3.560 . 5.420 2.191 2.191 2.191 . 0 0 "[ ]" 2
999 1 101 PHE QE 1 150 TYR HA 3.720 . 5.740 3.825 3.825 3.825 . 0 0 "[ ]" 2
1000 1 150 TYR HA 1 153 PHE QD 3.850 . 6.000 4.087 4.087 4.087 . 0 0 "[ ]" 2
1001 1 150 TYR HA 1 150 TYR QD 3.380 . 5.050 1.970 1.970 1.970 . 0 0 "[ ]" 2
1002 1 101 PHE QB 1 150 TYR QD 3.850 . 6.000 3.194 3.194 3.194 . 0 0 "[ ]" 2
1003 1 150 TYR QE 1 154 LEU HG 3.850 . 6.000 4.599 4.599 4.599 . 0 0 "[ ]" 2
1004 1 150 TYR HA 1 150 TYR QE 3.850 . 6.000 4.285 4.285 4.285 . 0 0 "[ ]" 2
1005 1 105 ASP OD2 1 110 GLY H 2.000 . 2.300 2.310 2.310 2.310 0.010 1 0 "[ ]" 2
1006 1 105 ASP OD2 1 110 GLY N 2.900 2.500 3.300 3.211 3.211 3.211 . 0 0 "[ ]" 2
1007 1 141 ASP OD2 1 146 GLY H 2.000 . 2.300 2.115 2.115 2.115 . 0 0 "[ ]" 2
1008 1 141 ASP OD2 1 146 GLY N 2.900 2.500 3.300 3.051 3.051 3.051 . 0 0 "[ ]" 2
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