NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
585982 |
2mtg   |
25160 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2mtg
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 192
_TA_constraint_stats_list.Viol_count 1376
_TA_constraint_stats_list.Viol_total 40774.73
_TA_constraint_stats_list.Viol_max 14.63
_TA_constraint_stats_list.Viol_rms 1.63
_TA_constraint_stats_list.Viol_average_all_restraints 0.53
_TA_constraint_stats_list.Viol_average_violations_only 1.48
_TA_constraint_stats_list.Cutoff_violation_report 5.00
_TA_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * ID of the restraint list.
* 3 * Number of restraints in list.
* 4 * Number of violated restraints (each model violation is used).
* 5 * Sum of violations in degrees.
* 6 * Maximum violation of a restraint without averaging in any way.
* 7 * Rms of violations over all restraints.
* 8 * Average violation over all restraints.
* 9 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
Threshold for reporting violations (degrees) in the last columns of the next table.
* 10 * This tag.
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
* 2 * Torsion angle name where available.
* 3 * First atom's:
* 4 * Chain identifier (can be absent if none defined)
* 5 * Residue number
* 6 * Residue name
* 7 * Name of (pseudo-)atom
* 8 * Second thru fourth atom's identifiers occupy columns 7 thru 18.
* 19 * Lower bound (degrees)
* 20 * Upper bound (degrees)
* 21 * Average angle in ensemble of models
* 22 * Minimum angle in ensemble of models (counter clockwise from range)
* 23 * Maximum angle in ensemble of models (clockwise from range)
* 24 * Maximum violation (without any averaging)
* 25 * Model number with the maximum violation
* 26 * Number of models with a violation above cutoff
* 27 * List of models with a violation above cutoff. See description above.
* 28 * Administrative tag
* 29 * Administrative tag
;
loop_
_TA_constraint_stats.Restraint_ID
_TA_constraint_stats.Torsion_angle_name
_TA_constraint_stats.Entity_assembly_ID_1
_TA_constraint_stats.Comp_index_ID_1
_TA_constraint_stats.Comp_ID_1
_TA_constraint_stats.Atom_ID_1
_TA_constraint_stats.Entity_assembly_ID_2
_TA_constraint_stats.Comp_index_ID_2
_TA_constraint_stats.Comp_ID_2
_TA_constraint_stats.Atom_ID_2
_TA_constraint_stats.Entity_assembly_ID_3
_TA_constraint_stats.Comp_index_ID_3
_TA_constraint_stats.Comp_ID_3
_TA_constraint_stats.Atom_ID_3
_TA_constraint_stats.Entity_assembly_ID_4
_TA_constraint_stats.Comp_index_ID_4
_TA_constraint_stats.Comp_ID_4
_TA_constraint_stats.Atom_ID_4
_TA_constraint_stats.Angle_lower_bound_val
_TA_constraint_stats.Angle_upper_bound_val
_TA_constraint_stats.Angle_average
_TA_constraint_stats.Angle_minimum
_TA_constraint_stats.Angle_maximum
_TA_constraint_stats.Max_violation
_TA_constraint_stats.Max_violation_model_number
_TA_constraint_stats.Over_cutoff_violation_count
_TA_constraint_stats.Over_cutoff_violation_per_model
1 . 1 4 ASN C 1 5 LEU N 1 5 LEU CA 1 5 LEU C -89.00 -53.00 -87.13 -89.03 -89.04 0.30 13 0 "[ . 1 . 2]"
2 . 1 5 LEU N 1 5 LEU CA 1 5 LEU C 1 6 PRO N 127.00 147.00 133.21 144.15 139.20 0.49 5 0 "[ . 1 . 2]"
3 . 1 6 PRO C 1 7 SER N 1 7 SER CA 1 7 SER C 176.00 -80.00 -160.25 -151.10 -156.52 . . 0 "[ . 1 . 2]"
4 . 1 7 SER N 1 7 SER CA 1 7 SER C 1 8 LYS N 141.00 -159.00 147.59 150.73 150.71 0.55 10 0 "[ . 1 . 2]"
5 . 1 8 LYS C 1 9 MET N 1 9 MET CA 1 9 MET C -157.30 -114.70 -116.61 -118.92 -127.22 1.48 18 0 "[ . 1 . 2]"
6 . 1 9 MET N 1 9 MET CA 1 9 MET C 1 10 LEU N 115.70 155.30 151.65 120.37 156.60 1.30 5 0 "[ . 1 . 2]"
7 . 1 9 MET C 1 10 LEU N 1 10 LEU CA 1 10 LEU C -152.70 -76.30 -118.42 -136.51 -89.38 . . 0 "[ . 1 . 2]"
8 . 1 10 LEU N 1 10 LEU CA 1 10 LEU C 1 11 LEU N 115.50 141.50 137.08 141.83 141.61 0.71 4 0 "[ . 1 . 2]"
9 . 1 10 LEU C 1 11 LEU N 1 11 LEU CA 1 11 LEU C -124.00 -89.40 -112.07 -115.64 -116.08 . . 0 "[ . 1 . 2]"
10 . 1 11 LEU N 1 11 LEU CA 1 11 LEU C 1 12 VAL N 99.80 145.00 146.20 145.13 147.43 2.43 18 0 "[ . 1 . 2]"
11 . 1 11 LEU C 1 12 VAL N 1 12 VAL CA 1 12 VAL C -137.90 -80.10 -100.37 -89.48 -96.98 . . 0 "[ . 1 . 2]"
12 . 1 12 VAL N 1 12 VAL CA 1 12 VAL C 1 13 TYR N 132.90 172.90 163.84 128.38 175.90 4.52 18 0 "[ . 1 . 2]"
13 . 1 12 VAL C 1 13 TYR N 1 13 TYR CA 1 13 TYR C -160.20 -110.60 -142.26 -129.68 -145.78 9.00 8 4 "[- .* + 1 *. 2]"
14 . 1 13 TYR N 1 13 TYR CA 1 13 TYR C 1 14 ASP N 124.80 180.00 158.91 130.13 -173.00 7.00 7 1 "[ . + 1 . 2]"
15 . 1 14 ASP C 1 15 LEU N 1 15 LEU CA 1 15 LEU C -97.40 -34.60 -96.07 -78.97 -92.03 3.78 11 0 "[ . 1 . 2]"
16 . 1 15 LEU N 1 15 LEU CA 1 15 LEU C 1 16 TYR N -55.70 -15.50 -23.73 -26.66 -28.53 1.54 15 0 "[ . 1 . 2]"
17 . 1 15 LEU C 1 16 TYR N 1 16 TYR CA 1 16 TYR C -81.20 -49.80 -78.19 -85.23 -58.99 4.03 20 0 "[ . 1 . 2]"
18 . 1 16 TYR N 1 16 TYR CA 1 16 TYR C 1 17 LEU N -37.10 -0.50 -18.56 -3.78 -8.04 0.53 11 0 "[ . 1 . 2]"
19 . 1 16 TYR C 1 17 LEU N 1 17 LEU CA 1 17 LEU C -104.40 -69.20 -81.08 -96.39 -69.13 0.07 14 0 "[ . 1 . 2]"
20 . 1 17 LEU N 1 17 LEU CA 1 17 LEU C 1 18 SER N -26.00 9.40 11.57 12.06 11.33 4.44 6 0 "[ . 1 . 2]"
21 . 1 17 LEU C 1 18 SER N 1 18 SER CA 1 18 SER C -174.60 -54.60 -71.39 -72.05 -72.73 . . 0 "[ . 1 . 2]"
22 . 1 18 SER N 1 18 SER CA 1 18 SER C 1 19 PRO N 80.00 175.00 139.21 143.21 140.49 . . 0 "[ . 1 . 2]"
23 . 1 18 SER C 1 19 PRO N 1 19 PRO CA 1 19 PRO C -73.70 -53.70 -52.73 -52.91 -53.01 2.38 19 0 "[ . 1 . 2]"
24 . 1 19 PRO N 1 19 PRO CA 1 19 PRO C 1 20 LYS N -31.50 -11.50 -28.20 -32.38 -23.61 0.88 12 0 "[ . 1 . 2]"
25 . 1 19 PRO C 1 20 LYS N 1 20 LYS CA 1 20 LYS C -77.00 -57.00 -77.98 -77.50 -77.61 1.51 9 0 "[ . 1 . 2]"
26 . 1 20 LYS N 1 20 LYS CA 1 20 LYS C 1 21 LEU N -37.80 -17.80 -32.21 -33.15 -34.73 1.44 15 0 "[ . 1 . 2]"
27 . 1 20 LYS C 1 21 LEU N 1 21 LEU CA 1 21 LEU C -84.10 -64.10 -85.74 -87.56 -84.12 3.46 6 0 "[ . 1 . 2]"
28 . 1 21 LEU N 1 21 LEU CA 1 21 LEU C 1 22 TRP N -57.80 -17.80 -52.16 -58.80 -48.10 1.00 9 0 "[ . 1 . 2]"
29 . 1 21 LEU C 1 22 TRP N 1 22 TRP CA 1 22 TRP C -99.80 -34.60 -92.13 -100.52 -87.09 0.72 9 0 "[ . 1 . 2]"
30 . 1 22 TRP N 1 22 TRP CA 1 22 TRP C 1 23 ALA N -43.50 -20.10 -40.59 -40.45 -40.56 0.83 14 0 "[ . 1 . 2]"
31 . 1 22 TRP C 1 23 ALA N 1 23 ALA CA 1 23 ALA C -78.50 -58.50 -76.66 -75.18 -75.82 2.28 19 0 "[ . 1 . 2]"
32 . 1 23 ALA N 1 23 ALA CA 1 23 ALA C 1 24 LEU N -41.80 -6.40 -25.77 -41.89 -6.35 0.09 8 0 "[ . 1 . 2]"
33 . 1 23 ALA C 1 24 LEU N 1 24 LEU CA 1 24 LEU C -123.90 -48.70 -92.08 -77.22 -85.04 0.06 10 0 "[ . 1 . 2]"
34 . 1 24 LEU N 1 24 LEU CA 1 24 LEU C 1 25 ALA N -47.00 22.60 -34.95 -30.41 -35.65 0.49 12 0 "[ . 1 . 2]"
35 . 1 25 ALA C 1 26 THR N 1 26 THR CA 1 26 THR C -154.60 -37.40 -112.00 -80.35 -101.21 . . 0 "[ . 1 . 2]"
36 . 1 26 THR N 1 26 THR CA 1 26 THR C 1 27 PRO N 57.50 177.50 119.20 116.80 110.64 . . 0 "[ . 1 . 2]"
37 . 1 31 GLY C 1 32 ARG N 1 32 ARG CA 1 32 ARG C -140.70 -35.70 -46.51 -48.39 -48.71 . . 0 "[ . 1 . 2]"
38 . 1 32 ARG N 1 32 ARG CA 1 32 ARG C 1 33 VAL N 127.60 -155.80 -156.40 -160.13 -154.73 1.07 5 0 "[ . 1 . 2]"
39 . 1 32 ARG C 1 33 VAL N 1 33 VAL CA 1 33 VAL C -81.80 -41.80 -41.00 -41.40 -40.67 1.13 1 0 "[ . 1 . 2]"
40 . 1 33 VAL N 1 33 VAL CA 1 33 VAL C 1 34 GLN N -44.90 -24.90 -28.18 -27.93 -28.03 . . 0 "[ . 1 . 2]"
41 . 1 33 VAL C 1 34 GLN N 1 34 GLN CA 1 34 GLN C -73.20 -53.20 -59.97 -59.22 -60.84 . . 0 "[ . 1 . 2]"
42 . 1 34 GLN N 1 34 GLN CA 1 34 GLN C 1 35 GLU N -47.10 -27.10 -46.35 -48.05 -43.00 0.95 14 0 "[ . 1 . 2]"
43 . 1 34 GLN C 1 35 GLU N 1 35 GLU CA 1 35 GLU C -74.80 -54.80 -75.58 -76.22 -75.02 1.42 12 0 "[ . 1 . 2]"
44 . 1 35 GLU N 1 35 GLU CA 1 35 GLU C 1 36 LYS N -52.80 -32.80 -41.98 -46.14 -46.53 0.17 4 0 "[ . 1 . 2]"
45 . 1 35 GLU C 1 36 LYS N 1 36 LYS CA 1 36 LYS C -74.10 -54.10 -58.44 -54.10 -54.92 0.28 12 0 "[ . 1 . 2]"
46 . 1 36 LYS N 1 36 LYS CA 1 36 LYS C 1 37 VAL N -48.60 -28.60 -46.77 -42.98 -44.67 0.49 5 0 "[ . 1 . 2]"
47 . 1 36 LYS C 1 37 VAL N 1 37 VAL CA 1 37 VAL C -74.30 -54.30 -73.29 -74.45 -74.51 0.58 19 0 "[ . 1 . 2]"
48 . 1 37 VAL N 1 37 VAL CA 1 37 VAL C 1 38 MET N -53.90 -33.90 -43.60 -53.88 -33.77 0.13 15 0 "[ . 1 . 2]"
49 . 1 37 VAL C 1 38 MET N 1 38 MET CA 1 38 MET C -71.80 -51.80 -58.71 -71.02 -51.45 0.35 7 0 "[ . 1 . 2]"
50 . 1 38 MET N 1 38 MET CA 1 38 MET C 1 39 GLU N -52.60 -32.60 -44.31 -39.97 -41.83 0.17 13 0 "[ . 1 . 2]"
51 . 1 38 MET C 1 39 GLU N 1 39 GLU CA 1 39 GLU C -69.40 -49.40 -68.67 -69.72 -63.35 0.32 5 0 "[ . 1 . 2]"
52 . 1 39 GLU N 1 39 GLU CA 1 39 GLU C 1 40 HIS N -53.60 -33.60 -53.27 -54.23 -49.91 0.63 5 0 "[ . 1 . 2]"
53 . 1 39 GLU C 1 40 HIS N 1 40 HIS CA 1 40 HIS C -76.20 -56.20 -57.84 -65.07 -55.54 0.66 12 0 "[ . 1 . 2]"
54 . 1 40 HIS N 1 40 HIS CA 1 40 HIS C 1 41 LEU N -54.60 -34.60 -38.59 -50.63 -34.05 0.55 20 0 "[ . 1 . 2]"
55 . 1 40 HIS C 1 41 LEU N 1 41 LEU CA 1 41 LEU C -73.80 -53.80 -67.39 -68.91 -70.70 0.03 16 0 "[ . 1 . 2]"
56 . 1 41 LEU N 1 41 LEU CA 1 41 LEU C 1 42 LEU N -51.40 -31.40 -32.35 -40.83 -30.42 0.98 5 0 "[ . 1 . 2]"
57 . 1 41 LEU C 1 42 LEU N 1 42 LEU CA 1 42 LEU C -73.10 -53.10 -53.80 -62.67 -52.22 0.88 5 0 "[ . 1 . 2]"
58 . 1 42 LEU N 1 42 LEU CA 1 42 LEU C 1 43 LYS N -56.90 -36.90 -51.13 -57.17 -37.37 0.27 2 0 "[ . 1 . 2]"
59 . 1 42 LEU C 1 43 LYS N 1 43 LYS CA 1 43 LYS C -73.10 -53.10 -67.26 -58.53 -62.86 0.26 11 0 "[ . 1 . 2]"
60 . 1 43 LYS N 1 43 LYS CA 1 43 LYS C 1 44 LEU N -48.90 -15.90 -48.58 -49.55 -43.59 0.65 7 0 "[ . 1 . 2]"
61 . 1 43 LYS C 1 44 LEU N 1 44 LEU CA 1 44 LEU C -74.80 -54.80 -62.08 -66.35 -57.16 . . 0 "[ . 1 . 2]"
62 . 1 44 LEU N 1 44 LEU CA 1 44 LEU C 1 45 PHE N -50.50 -30.50 -40.12 -50.98 -30.18 0.48 18 0 "[ . 1 . 2]"
63 . 1 44 LEU C 1 45 PHE N 1 45 PHE CA 1 45 PHE C -91.00 -58.60 -80.63 -76.81 -78.84 . . 0 "[ . 1 . 2]"
64 . 1 45 PHE N 1 45 PHE CA 1 45 PHE C 1 46 GLY N -49.50 -2.90 -30.78 -2.43 -33.27 4.94 18 0 "[ . 1 . 2]"
65 . 1 45 PHE C 1 46 GLY N 1 46 GLY CA 1 46 GLY C -98.30 -43.10 -73.60 -99.96 -56.36 1.66 17 0 "[ . 1 . 2]"
66 . 1 46 GLY N 1 46 GLY CA 1 46 GLY C 1 47 THR N -54.70 -0.70 -28.55 -45.16 -16.28 . . 0 "[ . 1 . 2]"
67 . 1 46 GLY C 1 47 THR N 1 47 THR CA 1 47 THR C -79.80 -59.80 -66.21 -61.28 -62.36 0.49 18 0 "[ . 1 . 2]"
68 . 1 47 THR N 1 47 THR CA 1 47 THR C 1 48 PHE N -47.20 -12.00 -45.20 -42.61 -45.62 1.09 4 0 "[ . 1 . 2]"
69 . 1 47 THR C 1 48 PHE N 1 48 PHE CA 1 48 PHE C -102.30 -68.50 -98.46 -103.82 -89.79 1.52 7 0 "[ . 1 . 2]"
70 . 1 48 PHE N 1 48 PHE CA 1 48 PHE C 1 49 GLY N -50.20 20.60 -16.88 -15.45 -17.01 . . 0 "[ . 1 . 2]"
71 . 1 49 GLY C 1 50 VAL N 1 50 VAL CA 1 50 VAL C -122.40 -52.20 -66.00 -52.09 -53.66 0.75 7 0 "[ . 1 . 2]"
72 . 1 50 VAL N 1 50 VAL CA 1 50 VAL C 1 51 ILE N 102.90 163.30 140.25 157.72 153.48 . . 0 "[ . 1 . 2]"
73 . 1 50 VAL C 1 51 ILE N 1 51 ILE CA 1 51 ILE C -148.90 -47.90 -97.54 -112.25 -84.57 . . 0 "[ . 1 . 2]"
74 . 1 51 ILE N 1 51 ILE CA 1 51 ILE C 1 52 SER N 88.20 154.60 134.04 136.67 135.67 . . 0 "[ . 1 . 2]"
75 . 1 51 ILE C 1 52 SER N 1 52 SER CA 1 52 SER C -117.90 -80.10 -80.22 -79.08 -79.35 1.76 17 0 "[ . 1 . 2]"
76 . 1 52 SER N 1 52 SER CA 1 52 SER C 1 53 SER N -45.50 -13.30 -31.87 -27.41 -28.73 . . 0 "[ . 1 . 2]"
77 . 1 52 SER C 1 53 SER N 1 53 SER CA 1 53 SER C -175.10 -132.10 -167.61 -165.02 -166.18 . . 0 "[ . 1 . 2]"
78 . 1 53 SER N 1 53 SER CA 1 53 SER C 1 54 VAL N 145.40 165.40 143.90 143.13 144.34 2.27 17 0 "[ . 1 . 2]"
79 . 1 53 SER C 1 54 VAL N 1 54 VAL CA 1 54 VAL C -151.10 -128.50 -131.09 -135.91 -128.07 0.43 6 0 "[ . 1 . 2]"
80 . 1 54 VAL N 1 54 VAL CA 1 54 VAL C 1 55 ARG N 109.30 172.90 108.31 107.62 107.48 2.10 11 0 "[ . 1 . 2]"
81 . 1 54 VAL C 1 55 ARG N 1 55 ARG CA 1 55 ARG C -143.30 -105.10 -105.04 -105.91 -105.92 3.06 9 0 "[ . 1 . 2]"
82 . 1 55 ARG N 1 55 ARG CA 1 55 ARG C 1 56 ILE N 109.20 153.40 107.65 108.03 107.76 3.44 5 0 "[ . 1 . 2]"
83 . 1 55 ARG C 1 56 ILE N 1 56 ILE CA 1 56 ILE C -123.30 -97.10 -99.38 -101.33 -103.66 1.86 17 0 "[ . 1 . 2]"
84 . 1 56 ILE N 1 56 ILE CA 1 56 ILE C 1 57 LEU N 111.40 132.20 125.68 117.87 132.69 0.49 20 0 "[ . 1 . 2]"
85 . 1 56 ILE C 1 57 LEU N 1 57 LEU CA 1 57 LEU C -125.30 -87.70 -119.77 -122.37 -125.46 1.13 8 0 "[ . 1 . 2]"
86 . 1 57 LEU N 1 57 LEU CA 1 57 LEU C 1 58 LYS N 111.20 143.80 113.36 120.80 113.72 1.88 10 0 "[ . 1 . 2]"
87 . 1 57 LEU C 1 58 LYS N 1 58 LYS CA 1 58 LYS C -128.30 -63.10 -88.25 -112.16 -75.47 . . 0 "[ . 1 . 2]"
88 . 1 58 LYS N 1 58 LYS CA 1 58 LYS C 1 59 PRO N 72.50 -175.70 160.22 168.67 166.41 . . 0 "[ . 1 . 2]"
89 . 1 58 LYS C 1 59 PRO N 1 59 PRO CA 1 59 PRO C -68.90 -48.90 -57.37 -60.58 -61.07 10.97 18 2 "[ . 1 . + -]"
90 . 1 59 PRO N 1 59 PRO CA 1 59 PRO C 1 60 GLY N 126.30 154.90 162.03 165.14 164.48 11.97 18 13 "[****.-** 1 ***+**]"
91 . 1 59 PRO C 1 60 GLY N 1 60 GLY CA 1 60 GLY C 57.00 109.00 56.60 53.60 61.67 3.40 2 0 "[ . 1 . 2]"
92 . 1 60 GLY N 1 60 GLY CA 1 60 GLY C 1 61 ARG N -36.00 28.00 23.39 13.35 28.64 0.64 7 0 "[ . 1 . 2]"
93 . 1 61 ARG C 1 62 GLU N 1 62 GLU CA 1 62 GLU C -142.60 -22.60 -126.35 -55.35 -103.02 1.14 12 0 "[ . 1 . 2]"
94 . 1 62 GLU N 1 62 GLU CA 1 62 GLU C 1 63 LEU N 109.20 179.20 106.98 97.67 117.09 11.53 2 6 "[*+ . * 1 . ** -]"
95 . 1 62 GLU C 1 63 LEU N 1 63 LEU CA 1 63 LEU C -138.90 -59.30 -117.88 -129.42 -108.11 . . 0 "[ . 1 . 2]"
96 . 1 63 LEU N 1 63 LEU CA 1 63 LEU C 1 64 PRO N 108.00 -173.20 97.36 95.17 94.98 14.52 17 17 "[****.****-* ***+***]"
97 . 1 63 LEU C 1 64 PRO N 1 64 PRO CA 1 64 PRO C -68.40 -48.40 -62.95 -69.01 -54.46 0.61 11 0 "[ . 1 . 2]"
98 . 1 64 PRO N 1 64 PRO CA 1 64 PRO C 1 65 PRO N 132.90 152.90 153.39 148.11 154.86 1.96 17 0 "[ . 1 . 2]"
99 . 1 64 PRO C 1 65 PRO N 1 65 PRO CA 1 65 PRO C -67.00 -47.00 -49.57 -47.37 -48.00 0.56 17 0 "[ . 1 . 2]"
100 . 1 65 PRO N 1 65 PRO CA 1 65 PRO C 1 66 ASP N -48.60 -28.60 -30.21 -28.55 -29.49 5.73 17 2 "[ . 1 . + -]"
101 . 1 65 PRO C 1 66 ASP N 1 66 ASP CA 1 66 ASP C -75.50 -55.50 -60.28 -64.68 -67.39 0.48 7 0 "[ . 1 . 2]"
102 . 1 66 ASP N 1 66 ASP CA 1 66 ASP C 1 67 ILE N -48.30 -12.10 -40.46 -49.56 -28.93 1.26 17 0 "[ . 1 . 2]"
103 . 1 66 ASP C 1 67 ILE N 1 67 ILE CA 1 67 ILE C -96.50 -43.50 -99.76 -102.35 -91.74 5.85 16 6 "[ *- . * 1 .+* *]"
104 . 1 67 ILE N 1 67 ILE CA 1 67 ILE C 1 68 ARG N -41.50 -18.50 -32.18 -42.13 -19.59 0.63 2 0 "[ . 1 . 2]"
105 . 1 67 ILE C 1 68 ARG N 1 68 ARG CA 1 68 ARG C -74.10 -54.10 -55.01 -59.06 -52.83 1.27 9 0 "[ . 1 . 2]"
106 . 1 68 ARG N 1 68 ARG CA 1 68 ARG C 1 69 ARG N -49.40 -29.40 -42.54 -50.12 -32.22 0.72 12 0 "[ . 1 . 2]"
107 . 1 68 ARG C 1 69 ARG N 1 69 ARG CA 1 69 ARG C -83.80 -57.20 -84.08 -84.36 -84.55 1.31 11 0 "[ . 1 . 2]"
108 . 1 69 ARG N 1 69 ARG CA 1 69 ARG C 1 70 ILE N -53.30 -29.30 -42.45 -44.83 -46.02 . . 0 "[ . 1 . 2]"
109 . 1 69 ARG C 1 70 ILE N 1 70 ILE CA 1 70 ILE C -83.10 -56.50 -84.27 -84.18 -84.21 1.56 9 0 "[ . 1 . 2]"
110 . 1 70 ILE N 1 70 ILE CA 1 70 ILE C 1 71 SER N -50.00 -10.20 -46.14 -50.69 -43.05 0.69 10 0 "[ . 1 . 2]"
111 . 1 70 ILE C 1 71 SER N 1 71 SER CA 1 71 SER C -73.80 -53.80 -66.23 -74.54 -53.67 0.74 7 0 "[ . 1 . 2]"
112 . 1 71 SER N 1 71 SER CA 1 71 SER C 1 72 SER N -47.20 -27.20 -42.87 -40.86 -41.99 0.16 13 0 "[ . 1 . 2]"
113 . 1 71 SER C 1 72 SER N 1 72 SER CA 1 72 SER C -83.70 -63.70 -76.21 -82.82 -62.80 0.90 16 0 "[ . 1 . 2]"
114 . 1 72 SER N 1 72 SER CA 1 72 SER C 1 73 ARG N -43.60 -2.80 -4.12 -1.99 -2.11 0.98 2 0 "[ . 1 . 2]"
115 . 1 72 SER C 1 73 ARG N 1 73 ARG CA 1 73 ARG C -108.40 -79.80 -96.32 -108.86 -86.14 0.46 12 0 "[ . 1 . 2]"
116 . 1 73 ARG N 1 73 ARG CA 1 73 ARG C 1 74 TYR N -40.60 25.80 -33.05 -37.68 -39.03 0.27 14 0 "[ . 1 . 2]"
117 . 1 73 ARG C 1 74 TYR N 1 74 TYR CA 1 74 TYR C -162.50 -78.90 -92.05 -91.02 -91.89 . . 0 "[ . 1 . 2]"
118 . 1 74 TYR N 1 74 TYR CA 1 74 TYR C 1 75 SER N 39.90 159.90 40.69 42.54 39.65 1.57 15 0 "[ . 1 . 2]"
119 . 1 74 TYR C 1 75 SER N 1 75 SER CA 1 75 SER C -66.10 -46.10 -50.67 -48.10 -49.47 1.56 16 0 "[ . 1 . 2]"
120 . 1 76 GLN N 1 76 GLN CA 1 76 GLN C 1 77 VAL N -46.70 -26.70 -27.08 -26.19 -26.36 1.37 10 0 "[ . 1 . 2]"
121 . 1 76 GLN C 1 77 VAL N 1 77 VAL CA 1 77 VAL C -104.20 -68.60 -80.39 -97.54 -71.49 . . 0 "[ . 1 . 2]"
122 . 1 77 VAL N 1 77 VAL CA 1 77 VAL C 1 78 GLY N -29.70 30.30 16.81 29.63 25.80 . . 0 "[ . 1 . 2]"
123 . 1 77 VAL C 1 78 GLY N 1 78 GLY CA 1 78 GLY C 51.60 131.60 49.15 43.70 67.33 7.90 17 10 "[ ***.* * 1 -**+* 2]"
124 . 1 78 GLY N 1 78 GLY CA 1 78 GLY C 1 79 THR N -22.60 40.60 12.30 14.32 9.25 . . 0 "[ . 1 . 2]"
125 . 1 78 GLY C 1 79 THR N 1 79 THR CA 1 79 THR C -167.20 -47.20 -156.99 -168.43 -134.50 1.23 18 0 "[ . 1 . 2]"
126 . 1 79 THR N 1 79 THR CA 1 79 THR C 1 80 GLN N 131.80 171.80 161.35 157.99 148.26 0.62 20 0 "[ . 1 . 2]"
127 . 1 79 THR C 1 80 GLN N 1 80 GLN CA 1 80 GLN C -155.10 -104.70 -128.62 -145.44 -104.58 0.12 1 0 "[ . 1 . 2]"
128 . 1 80 GLN N 1 80 GLN CA 1 80 GLN C 1 81 GLU N 105.50 -173.50 98.70 94.38 109.28 11.12 16 16 "[****** *****-*.+** 2]"
129 . 1 80 GLN C 1 81 GLU N 1 81 GLU CA 1 81 GLU C -140.70 -52.30 -140.57 -145.39 -121.73 4.69 16 0 "[ . 1 . 2]"
130 . 1 81 GLU N 1 81 GLU CA 1 81 GLU C 1 82 CYS N 87.00 167.80 129.16 133.95 127.65 . . 0 "[ . 1 . 2]"
131 . 1 81 GLU C 1 82 CYS N 1 82 CYS CA 1 82 CYS C -161.00 -107.60 -133.09 -154.80 -106.86 0.74 11 0 "[ . 1 . 2]"
132 . 1 82 CYS N 1 82 CYS CA 1 82 CYS C 1 83 ALA N 147.40 167.40 150.52 150.94 148.26 1.65 11 0 "[ . 1 . 2]"
133 . 1 82 CYS C 1 83 ALA N 1 83 ALA CA 1 83 ALA C -158.10 -113.70 -141.11 -127.43 -136.51 . . 0 "[ . 1 . 2]"
134 . 1 83 ALA N 1 83 ALA CA 1 83 ALA C 1 84 ILE N 141.90 161.90 149.09 140.65 163.14 1.25 11 0 "[ . 1 . 2]"
135 . 1 83 ALA C 1 84 ILE N 1 84 ILE CA 1 84 ILE C -145.40 -87.60 -118.27 -107.73 -112.55 . . 0 "[ . 1 . 2]"
136 . 1 84 ILE N 1 84 ILE CA 1 84 ILE C 1 85 VAL N 113.80 138.60 114.48 113.22 113.20 1.48 18 0 "[ . 1 . 2]"
137 . 1 84 ILE C 1 85 VAL N 1 85 VAL CA 1 85 VAL C -141.20 -97.80 -109.27 -139.01 -97.76 0.04 13 0 "[ . 1 . 2]"
138 . 1 85 VAL N 1 85 VAL CA 1 85 VAL C 1 86 GLU N 88.30 133.10 143.60 129.55 147.73 14.63 14 18 "[* ***********+**- **]"
139 . 1 85 VAL C 1 86 GLU N 1 86 GLU CA 1 86 GLU C -143.00 -83.00 -128.23 -125.58 -127.02 . . 0 "[ . 1 . 2]"
140 . 1 86 GLU N 1 86 GLU CA 1 86 GLU C 1 87 PHE N 96.30 156.30 100.53 95.12 112.41 1.18 7 0 "[ . 1 . 2]"
141 . 1 86 GLU C 1 87 PHE N 1 87 PHE CA 1 87 PHE C -125.10 -44.30 -90.48 -90.62 -91.53 . . 0 "[ . 1 . 2]"
142 . 1 87 PHE N 1 87 PHE CA 1 87 PHE C 1 88 GLU N 136.90 179.90 178.01 -179.54 -179.69 0.88 20 0 "[ . 1 . 2]"
143 . 1 87 PHE C 1 88 GLU N 1 88 GLU CA 1 88 GLU C -76.40 -52.20 -67.81 -77.02 -53.16 0.62 15 0 "[ . 1 . 2]"
144 . 1 88 GLU N 1 88 GLU CA 1 88 GLU C 1 89 GLU N -47.10 -14.70 -27.77 -30.04 -33.95 . . 0 "[ . 1 . 2]"
145 . 1 89 GLU C 1 90 VAL N 1 90 VAL CA 1 90 VAL C -67.50 -47.50 -59.04 -67.83 -50.26 0.33 15 0 "[ . 1 . 2]"
146 . 1 90 VAL N 1 90 VAL CA 1 90 VAL C 1 91 GLU N -64.50 -24.50 -23.31 -22.22 -22.50 2.42 2 0 "[ . 1 . 2]"
147 . 1 90 VAL C 1 91 GLU N 1 91 GLU CA 1 91 GLU C -70.30 -50.30 -63.23 -71.08 -53.18 0.78 15 0 "[ . 1 . 2]"
148 . 1 91 GLU N 1 91 GLU CA 1 91 GLU C 1 92 ALA N -58.00 -18.00 -43.03 -29.80 -45.03 2.20 2 0 "[ . 1 . 2]"
149 . 1 91 GLU C 1 92 ALA N 1 92 ALA CA 1 92 ALA C -97.30 -37.30 -59.22 -83.11 -46.45 . . 0 "[ . 1 . 2]"
150 . 1 92 ALA N 1 92 ALA CA 1 92 ALA C 1 93 ALA N -55.70 -15.70 -55.95 -59.66 -60.40 5.17 3 1 "[ + . 1 . 2]"
151 . 1 92 ALA C 1 93 ALA N 1 93 ALA CA 1 93 ALA C -72.20 -52.20 -56.21 -67.46 -49.40 2.80 6 0 "[ . 1 . 2]"
152 . 1 93 ALA N 1 93 ALA CA 1 93 ALA C 1 94 ILE N -44.60 -24.60 -38.39 -34.58 -35.58 0.86 1 0 "[ . 1 . 2]"
153 . 1 93 ALA C 1 94 ILE N 1 94 ILE CA 1 94 ILE C -72.70 -52.70 -58.39 -68.97 -51.76 0.94 12 0 "[ . 1 . 2]"
154 . 1 94 ILE N 1 94 ILE CA 1 94 ILE C 1 95 LYS N -49.80 -29.80 -41.25 -50.13 -29.91 0.33 2 0 "[ . 1 . 2]"
155 . 1 94 ILE C 1 95 LYS N 1 95 LYS CA 1 95 LYS C -78.80 -58.80 -68.79 -61.29 -64.22 1.54 5 0 "[ . 1 . 2]"
156 . 1 95 LYS N 1 95 LYS CA 1 95 LYS C 1 96 ALA N -44.30 -20.70 -38.41 -44.71 -22.86 0.41 19 0 "[ . 1 . 2]"
157 . 1 95 LYS C 1 96 ALA N 1 96 ALA CA 1 96 ALA C -99.40 -36.60 -79.37 -82.14 -84.39 . . 0 "[ . 1 . 2]"
158 . 1 96 ALA N 1 96 ALA CA 1 96 ALA C 1 97 HIS N -50.50 -30.50 -38.61 -51.15 -29.98 0.65 5 0 "[ . 1 . 2]"
159 . 1 96 ALA C 1 97 HIS N 1 97 HIS CA 1 97 HIS C -69.00 -49.00 -53.66 -50.76 -51.30 0.23 16 0 "[ . 1 . 2]"
160 . 1 97 HIS N 1 97 HIS CA 1 97 HIS C 1 98 GLU N -55.00 -35.00 -55.50 -56.05 -56.27 2.35 4 0 "[ . 1 . 2]"
161 . 1 97 HIS C 1 98 GLU N 1 98 GLU CA 1 98 GLU C -72.90 -52.90 -59.63 -54.58 -58.21 1.09 5 0 "[ . 1 . 2]"
162 . 1 98 GLU N 1 98 GLU CA 1 98 GLU C 1 99 PHE N -49.50 -29.50 -42.24 -50.12 -29.36 0.62 16 0 "[ . 1 . 2]"
163 . 1 98 GLU C 1 99 PHE N 1 99 PHE CA 1 99 PHE C -77.40 -57.40 -63.95 -77.57 -56.93 0.47 1 0 "[ . 1 . 2]"
164 . 1 99 PHE N 1 99 PHE CA 1 99 PHE C 1 100 MET N -47.30 -17.10 -39.11 -32.25 -32.53 2.40 4 0 "[ . 1 . 2]"
165 . 1 99 PHE C 1 100 MET N 1 100 MET CA 1 100 MET C -76.40 -56.40 -76.02 -78.41 -73.09 2.01 4 0 "[ . 1 . 2]"
166 . 1 100 MET N 1 100 MET CA 1 100 MET C 1 101 ILE N -61.60 2.60 -48.91 -61.79 -30.94 0.19 9 0 "[ . 1 . 2]"
167 . 1 100 MET C 1 101 ILE N 1 101 ILE CA 1 101 ILE C -70.50 -50.50 -64.15 -66.46 -68.81 0.47 12 0 "[ . 1 . 2]"
168 . 1 101 ILE N 1 101 ILE CA 1 101 ILE C 1 102 THR N -52.80 -32.80 -39.97 -32.68 -32.77 3.48 9 0 "[ . 1 . 2]"
169 . 1 101 ILE C 1 102 THR N 1 102 THR CA 1 102 THR C -76.40 -56.40 -68.65 -66.42 -67.61 0.29 9 0 "[ . 1 . 2]"
170 . 1 102 THR N 1 102 THR CA 1 102 THR C 1 103 GLU N -45.30 -2.90 -44.06 -45.37 -45.44 0.52 5 0 "[ . 1 . 2]"
171 . 1 102 THR C 1 103 GLU N 1 103 GLU CA 1 103 GLU C -112.40 -61.40 -72.25 -93.97 -61.45 . . 0 "[ . 1 . 2]"
172 . 1 103 GLU N 1 103 GLU CA 1 103 GLU C 1 104 SER N -54.50 19.50 -35.99 -29.53 -32.01 . . 0 "[ . 1 . 2]"
173 . 1 104 SER C 1 105 GLN N 1 105 GLN CA 1 105 GLN C -68.50 -48.50 -59.02 -64.20 -68.49 0.36 11 0 "[ . 1 . 2]"
174 . 1 105 GLN N 1 105 GLN CA 1 105 GLN C 1 106 GLY N 125.70 145.70 139.83 145.60 144.03 1.20 12 0 "[ . 1 . 2]"
175 . 1 105 GLN C 1 106 GLY N 1 106 GLY CA 1 106 GLY C 75.80 99.80 86.18 83.09 77.80 1.19 6 0 "[ . 1 . 2]"
176 . 1 106 GLY N 1 106 GLY CA 1 106 GLY C 1 107 LYS N -35.40 36.00 -37.13 -38.37 -36.04 2.97 10 0 "[ . 1 . 2]"
177 . 1 106 GLY C 1 107 LYS N 1 107 LYS CA 1 107 LYS C -104.50 -79.30 -104.49 -107.70 -88.09 3.20 10 0 "[ . 1 . 2]"
178 . 1 107 LYS N 1 107 LYS CA 1 107 LYS C 1 108 GLU N 99.70 -167.10 152.27 179.94 164.28 0.10 8 0 "[ . 1 . 2]"
179 . 1 108 GLU C 1 109 ASN N 1 109 ASN CA 1 109 ASN C -132.60 -96.60 -131.02 -129.10 -131.19 2.27 5 0 "[ . 1 . 2]"
180 . 1 109 ASN N 1 109 ASN CA 1 109 ASN C 1 110 MET N 130.80 -172.80 -173.97 -174.30 -176.91 2.34 8 0 "[ . 1 . 2]"
181 . 1 109 ASN C 1 110 MET N 1 110 MET CA 1 110 MET C -124.30 -28.90 -32.24 -40.44 -26.40 2.50 8 0 "[ . 1 . 2]"
182 . 1 110 MET N 1 110 MET CA 1 110 MET C 1 111 LYS N 100.70 -163.10 123.35 128.44 127.11 . . 0 "[ . 1 . 2]"
183 . 1 110 MET C 1 111 LYS N 1 111 LYS CA 1 111 LYS C -146.40 -104.20 -140.11 -137.12 -140.48 1.55 5 0 "[ . 1 . 2]"
184 . 1 111 LYS N 1 111 LYS CA 1 111 LYS C 1 112 ALA N 147.90 167.90 165.65 168.43 168.04 1.96 17 0 "[ . 1 . 2]"
185 . 1 111 LYS C 1 112 ALA N 1 112 ALA CA 1 112 ALA C -173.60 -95.00 -141.72 -146.60 -149.69 . . 0 "[ . 1 . 2]"
186 . 1 112 ALA N 1 112 ALA CA 1 112 ALA C 1 113 VAL N 144.00 164.00 152.52 143.63 164.10 0.37 11 0 "[ . 1 . 2]"
187 . 1 112 ALA C 1 113 VAL N 1 113 VAL CA 1 113 VAL C -155.60 -115.20 -139.82 -139.68 -140.91 0.77 12 0 "[ . 1 . 2]"
188 . 1 113 VAL N 1 113 VAL CA 1 113 VAL C 1 114 LEU N 122.70 153.50 143.85 136.39 134.64 0.53 7 0 "[ . 1 . 2]"
189 . 1 113 VAL C 1 114 LEU N 1 114 LEU CA 1 114 LEU C -150.80 -60.40 -85.36 -99.78 -65.05 . . 0 "[ . 1 . 2]"
190 . 1 114 LEU N 1 114 LEU CA 1 114 LEU C 1 115 ILE N 113.60 137.00 119.00 123.55 122.46 0.44 9 0 "[ . 1 . 2]"
191 . 1 114 LEU C 1 115 ILE N 1 115 ILE CA 1 115 ILE C -117.40 -38.20 -108.40 -117.95 -118.11 2.16 10 0 "[ . 1 . 2]"
192 . 1 115 ILE N 1 115 ILE CA 1 115 ILE C 1 116 GLY N 101.90 143.10 128.69 133.09 129.55 1.35 13 0 "[ . 1 . 2]"
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