Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
538730 | 2ls8 RC | 18415 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2ls8
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 166
_TA_constraint_stats_list.Viol_count 459
_TA_constraint_stats_list.Viol_total 11903.55
_TA_constraint_stats_list.Viol_max 7.97
_TA_constraint_stats_list.Viol_rms 0.63
_TA_constraint_stats_list.Viol_average_all_restraints 0.18
_TA_constraint_stats_list.Viol_average_violations_only 1.30
_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 1 MET C 1 2 VAL N 1 2 VAL CA 1 2 VAL C 173.00 -71.00 -113.66 -164.53 -69.45 1.55 4 0 "[ . 1 . 2]"
2 . 1 2 VAL N 1 2 VAL CA 1 2 VAL C 1 3 CYS N 120.00 -176.00 133.97 131.91 125.22 7.02 19 1 "[ . 1 . +2]"
3 . 1 2 VAL C 1 3 CYS N 1 3 CYS CA 1 3 CYS C -164.00 -108.00 -139.77 -119.65 -132.44 6.46 19 1 "[ . 1 . +2]"
4 . 1 3 CYS N 1 3 CYS CA 1 3 CYS C 1 4 PRO N 95.00 -177.00 154.76 93.06 -178.36 1.94 14 0 "[ . 1 . 2]"
5 . 1 3 CYS C 1 4 PRO N 1 4 PRO CA 1 4 PRO C -84.00 -44.00 -58.75 -70.91 -73.23 2.51 14 0 "[ . 1 . 2]"
6 . 1 4 PRO N 1 4 PRO CA 1 4 PRO C 1 5 ILE N 125.00 169.00 151.19 169.17 163.32 5.58 19 1 "[ . 1 . +2]"
7 . 1 7 TRP C 1 8 ARG N 1 8 ARG CA 1 8 ARG C -146.00 -74.00 -82.75 -115.70 -71.47 2.53 4 0 "[ . 1 . 2]"
8 . 1 8 ARG N 1 8 ARG CA 1 8 ARG C 1 9 ALA N 75.00 175.00 111.62 97.59 136.19 . . 0 "[ . 1 . 2]"
9 . 1 8 ARG C 1 9 ALA N 1 9 ALA CA 1 9 ALA C 169.00 -51.00 -84.39 -76.42 -77.82 . . 0 "[ . 1 . 2]"
10 . 1 9 ALA N 1 9 ALA CA 1 9 ALA C 1 10 PHE N 122.00 178.00 127.41 133.05 129.46 1.15 7 0 "[ . 1 . 2]"
11 . 1 9 ALA C 1 10 PHE N 1 10 PHE CA 1 10 PHE C -176.00 -100.00 -132.66 -136.45 -137.97 . . 0 "[ . 1 . 2]"
12 . 1 10 PHE N 1 10 PHE CA 1 10 PHE C 1 11 GLN N 103.00 159.00 109.96 102.11 133.97 0.89 3 0 "[ . 1 . 2]"
13 . 1 12 SER C 1 13 ASN N 1 13 ASN CA 1 13 ASN C 170.00 -78.00 -109.08 -86.37 -92.65 . . 0 "[ . 1 . 2]"
14 . 1 13 ASN N 1 13 ASN CA 1 13 ASN C 1 14 CYS N 122.00 174.00 164.04 149.90 174.33 0.33 18 0 "[ . 1 . 2]"
15 . 1 13 ASN C 1 14 CYS N 1 14 CYS CA 1 14 CYS C -165.00 -105.00 -131.24 -124.89 -131.97 . . 0 "[ . 1 . 2]"
16 . 1 14 CYS N 1 14 CYS CA 1 14 CYS C 1 15 TYR N 128.00 172.00 130.79 132.70 131.52 1.07 16 0 "[ . 1 . 2]"
17 . 1 14 CYS C 1 15 TYR N 1 15 TYR CA 1 15 TYR C -163.00 -91.00 -121.69 -131.80 -115.03 . . 0 "[ . 1 . 2]"
18 . 1 15 TYR N 1 15 TYR CA 1 15 TYR C 1 16 PHE N 114.00 166.00 133.34 127.25 126.14 . . 0 "[ . 1 . 2]"
19 . 1 15 TYR C 1 16 PHE N 1 16 PHE CA 1 16 PHE C -168.00 -76.00 -123.49 -140.34 -104.11 . . 0 "[ . 1 . 2]"
20 . 1 16 PHE N 1 16 PHE CA 1 16 PHE C 1 17 PRO N 116.00 176.00 115.52 117.79 117.35 3.19 11 0 "[ . 1 . 2]"
21 . 1 16 PHE C 1 17 PRO N 1 17 PRO CA 1 17 PRO C -88.00 -48.00 -87.47 -89.96 -82.57 1.96 12 0 "[ . 1 . 2]"
22 . 1 17 PRO N 1 17 PRO CA 1 17 PRO C 1 18 LEU N 118.00 166.00 127.34 136.33 135.33 0.61 13 0 "[ . 1 . 2]"
23 . 1 17 PRO C 1 18 LEU N 1 18 LEU CA 1 18 LEU C -147.00 -47.00 -116.40 -119.36 -122.48 . . 0 "[ . 1 . 2]"
24 . 1 18 LEU N 1 18 LEU CA 1 18 LEU C 1 19 THR N 140.00 180.00 140.21 137.81 149.66 2.19 2 0 "[ . 1 . 2]"
25 . 1 21 ASN C 1 22 LYS N 1 22 LYS CA 1 22 LYS C -172.00 -88.00 -145.78 -168.22 -127.24 . . 0 "[ . 1 . 2]"
26 . 1 22 LYS N 1 22 LYS CA 1 22 LYS C 1 23 THR N 142.00 -178.00 149.01 148.23 146.91 0.90 14 0 "[ . 1 . 2]"
27 . 1 22 LYS C 1 23 THR N 1 23 THR CA 1 23 THR C -94.00 -54.00 -74.21 -70.74 -72.63 . . 0 "[ . 1 . 2]"
28 . 1 23 THR N 1 23 THR CA 1 23 THR C 1 24 TRP N 141.00 -179.00 168.82 171.55 170.44 . . 0 "[ . 1 . 2]"
29 . 1 23 THR C 1 24 TRP N 1 24 TRP CA 1 24 TRP C -80.00 -40.00 -59.91 -62.60 -64.91 . . 0 "[ . 1 . 2]"
30 . 1 24 TRP N 1 24 TRP CA 1 24 TRP C 1 25 ALA N -62.00 -22.00 -40.94 -52.70 -34.78 . . 0 "[ . 1 . 2]"
31 . 1 24 TRP C 1 25 ALA N 1 25 ALA CA 1 25 ALA C -80.00 -40.00 -62.59 -61.68 -62.30 . . 0 "[ . 1 . 2]"
32 . 1 25 ALA N 1 25 ALA CA 1 25 ALA C 1 26 GLU N -62.00 -22.00 -48.67 -58.14 -42.54 . . 0 "[ . 1 . 2]"
33 . 1 25 ALA C 1 26 GLU N 1 26 GLU CA 1 26 GLU C -85.00 -45.00 -66.26 -64.84 -66.97 . . 0 "[ . 1 . 2]"
34 . 1 26 GLU N 1 26 GLU CA 1 26 GLU C 1 27 SER N -59.00 -19.00 -35.22 -44.11 -26.92 . . 0 "[ . 1 . 2]"
35 . 1 26 GLU C 1 27 SER N 1 27 SER CA 1 27 SER C -80.00 -40.00 -59.30 -62.52 -64.90 . . 0 "[ . 1 . 2]"
36 . 1 27 SER N 1 27 SER CA 1 27 SER C 1 28 GLU N -66.00 -26.00 -45.20 -51.28 -33.10 . . 0 "[ . 1 . 2]"
37 . 1 27 SER C 1 28 GLU N 1 28 GLU CA 1 28 GLU C -82.00 -42.00 -71.80 -81.11 -56.83 . . 0 "[ . 1 . 2]"
38 . 1 28 GLU N 1 28 GLU CA 1 28 GLU C 1 29 ARG N -63.00 -23.00 -26.20 -27.02 -30.98 4.23 7 0 "[ . 1 . 2]"
39 . 1 28 GLU C 1 29 ARG N 1 29 ARG CA 1 29 ARG C -84.00 -44.00 -74.42 -84.49 -65.67 0.49 6 0 "[ . 1 . 2]"
40 . 1 29 ARG N 1 29 ARG CA 1 29 ARG C 1 30 ASN N -62.00 -22.00 -39.32 -51.43 -25.59 . . 0 "[ . 1 . 2]"
41 . 1 29 ARG C 1 30 ASN N 1 30 ASN CA 1 30 ASN C -92.00 -52.00 -75.82 -63.10 -68.32 . . 0 "[ . 1 . 2]"
42 . 1 30 ASN N 1 30 ASN CA 1 30 ASN C 1 31 CYS N -61.00 -17.00 -32.53 -42.67 -25.82 . . 0 "[ . 1 . 2]"
43 . 1 30 ASN C 1 31 CYS N 1 31 CYS CA 1 31 CYS C -174.00 -86.00 -86.90 -101.26 -84.13 1.87 18 0 "[ . 1 . 2]"
44 . 1 31 CYS N 1 31 CYS CA 1 31 CYS C 1 32 SER N 135.00 175.00 174.38 178.88 178.61 7.97 13 6 "[ *- * *1 + . * 2]"
45 . 1 35 GLY C 1 36 ALA N 1 36 ALA CA 1 36 ALA C -149.00 -97.00 -113.92 -148.54 -95.02 1.98 8 0 "[ . 1 . 2]"
46 . 1 36 ALA N 1 36 ALA CA 1 36 ALA C 1 37 HIS N 143.00 -177.00 173.99 140.16 -173.88 3.12 12 0 "[ . 1 . 2]"
47 . 1 36 ALA C 1 37 HIS N 1 37 HIS CA 1 37 HIS C -159.00 -119.00 -142.17 -143.12 -143.76 0.69 11 0 "[ . 1 . 2]"
48 . 1 37 HIS N 1 37 HIS CA 1 37 HIS C 1 38 LEU N 128.00 168.00 165.95 150.52 170.66 2.66 1 0 "[ . 1 . 2]"
49 . 1 38 LEU C 1 39 MET N 1 39 MET CA 1 39 MET C -164.00 -24.00 -51.14 -52.92 -53.43 . . 0 "[ . 1 . 2]"
50 . 1 39 MET N 1 39 MET CA 1 39 MET C 1 40 THR N 99.00 159.00 109.61 96.41 126.13 2.59 6 0 "[ . 1 . 2]"
51 . 1 39 MET C 1 40 THR N 1 40 THR CA 1 40 THR C -134.00 -94.00 -103.91 -98.72 -101.35 1.00 13 0 "[ . 1 . 2]"
52 . 1 40 THR N 1 40 THR CA 1 40 THR C 1 41 ILE N 90.00 154.00 102.17 88.97 135.95 1.03 10 0 "[ . 1 . 2]"
53 . 1 40 THR C 1 41 ILE N 1 41 ILE CA 1 41 ILE C -157.00 -45.00 -68.30 -61.30 -64.60 . . 0 "[ . 1 . 2]"
54 . 1 41 ILE N 1 41 ILE CA 1 41 ILE C 1 42 SER N 86.00 154.00 110.31 103.09 100.72 . . 0 "[ . 1 . 2]"
55 . 1 43 THR C 1 44 GLU N 1 44 GLU CA 1 44 GLU C -87.00 -47.00 -64.50 -66.69 -66.93 . . 0 "[ . 1 . 2]"
56 . 1 44 GLU N 1 44 GLU CA 1 44 GLU C 1 45 ALA N -57.00 -17.00 -35.60 -50.63 -16.47 0.53 1 0 "[ . 1 . 2]"
57 . 1 44 GLU C 1 45 ALA N 1 45 ALA CA 1 45 ALA C -84.00 -44.00 -65.18 -70.55 -74.01 . . 0 "[ . 1 . 2]"
58 . 1 45 ALA N 1 45 ALA CA 1 45 ALA C 1 46 GLU N -60.00 -20.00 -40.05 -37.15 -37.85 . . 0 "[ . 1 . 2]"
59 . 1 45 ALA C 1 46 GLU N 1 46 GLU CA 1 46 GLU C -83.00 -43.00 -53.85 -62.56 -48.25 . . 0 "[ . 1 . 2]"
60 . 1 46 GLU N 1 46 GLU CA 1 46 GLU C 1 47 GLN N -64.00 -24.00 -51.47 -45.71 -47.35 . . 0 "[ . 1 . 2]"
61 . 1 46 GLU C 1 47 GLN N 1 47 GLN CA 1 47 GLN C -81.00 -41.00 -59.82 -64.14 -65.57 . . 0 "[ . 1 . 2]"
62 . 1 47 GLN N 1 47 GLN CA 1 47 GLN C 1 48 ASN N -62.00 -22.00 -50.76 -53.88 -55.44 . . 0 "[ . 1 . 2]"
63 . 1 47 GLN C 1 48 ASN N 1 48 ASN CA 1 48 ASN C -83.00 -43.00 -61.16 -62.39 -64.02 . . 0 "[ . 1 . 2]"
64 . 1 48 ASN N 1 48 ASN CA 1 48 ASN C 1 49 PHE N -58.00 -18.00 -31.32 -24.14 -25.13 . . 0 "[ . 1 . 2]"
65 . 1 48 ASN C 1 49 PHE N 1 49 PHE CA 1 49 PHE C -88.00 -48.00 -83.81 -82.56 -84.40 1.23 19 0 "[ . 1 . 2]"
66 . 1 49 PHE N 1 49 PHE CA 1 49 PHE C 1 50 ILE N -52.00 -4.00 -36.76 -52.08 -17.78 0.08 2 0 "[ . 1 . 2]"
67 . 1 49 PHE C 1 50 ILE N 1 50 ILE CA 1 50 ILE C -107.00 -47.00 -72.88 -66.92 -68.17 . . 0 "[ . 1 . 2]"
68 . 1 50 ILE N 1 50 ILE CA 1 50 ILE C 1 51 ILE N -81.00 43.00 -31.62 -31.10 -31.72 . . 0 "[ . 1 . 2]"
69 . 1 50 ILE C 1 51 ILE N 1 51 ILE CA 1 51 ILE C -86.00 -46.00 -70.56 -73.41 -65.28 . . 0 "[ . 1 . 2]"
70 . 1 51 ILE N 1 51 ILE CA 1 51 ILE C 1 52 GLN N -58.00 6.00 -7.37 -1.41 -2.64 . . 0 "[ . 1 . 2]"
71 . 1 51 ILE C 1 52 GLN N 1 52 GLN CA 1 52 GLN C -87.00 -47.00 -85.32 -84.93 -86.43 0.88 7 0 "[ . 1 . 2]"
72 . 1 52 GLN N 1 52 GLN CA 1 52 GLN C 1 53 PHE N -46.00 -6.00 -23.08 -33.99 -11.36 . . 0 "[ . 1 . 2]"
73 . 1 52 GLN C 1 53 PHE N 1 53 PHE CA 1 53 PHE C -129.00 -73.00 -92.47 -99.13 -100.13 . . 0 "[ . 1 . 2]"
74 . 1 53 PHE N 1 53 PHE CA 1 53 PHE C 1 54 LEU N -32.00 24.00 -24.14 -30.14 -17.48 . . 0 "[ . 1 . 2]"
75 . 1 58 LEU C 1 59 SER N 1 59 SER CA 1 59 SER C -167.00 -63.00 -113.48 -128.96 -100.50 . . 0 "[ . 1 . 2]"
76 . 1 59 SER N 1 59 SER CA 1 59 SER C 1 60 TYR N 113.00 -175.00 121.28 112.74 130.54 0.26 20 0 "[ . 1 . 2]"
77 . 1 59 SER C 1 60 TYR N 1 60 TYR CA 1 60 TYR C -173.00 -77.00 -106.44 -102.51 -104.67 . . 0 "[ . 1 . 2]"
78 . 1 60 TYR N 1 60 TYR CA 1 60 TYR C 1 61 PHE N 121.00 169.00 123.35 126.23 124.86 0.85 4 0 "[ . 1 . 2]"
79 . 1 60 TYR C 1 61 PHE N 1 61 PHE CA 1 61 PHE C -100.00 -44.00 -62.28 -71.97 -55.19 . . 0 "[ . 1 . 2]"
80 . 1 62 LEU N 1 62 LEU CA 1 62 LEU C 1 63 GLY N 136.00 -164.00 170.16 168.22 166.02 . . 0 "[ . 1 . 2]"
81 . 1 63 GLY C 1 64 LEU N 1 64 LEU CA 1 64 LEU C -153.00 -73.00 -98.04 -73.68 -79.68 1.92 15 0 "[ . 1 . 2]"
82 . 1 64 LEU N 1 64 LEU CA 1 64 LEU C 1 65 ARG N 102.00 150.00 123.31 117.34 116.81 4.32 19 0 "[ . 1 . 2]"
83 . 1 64 LEU C 1 65 ARG N 1 65 ARG CA 1 65 ARG C -163.00 -95.00 -118.83 -153.35 -93.60 1.40 19 0 "[ . 1 . 2]"
84 . 1 65 ARG N 1 65 ARG CA 1 65 ARG C 1 66 ASP N 108.00 164.00 129.59 104.33 161.76 3.67 19 0 "[ . 1 . 2]"
85 . 1 65 ARG C 1 66 ASP N 1 66 ASP CA 1 66 ASP C -142.00 -58.00 -120.79 -142.24 -94.50 0.24 5 0 "[ . 1 . 2]"
86 . 1 66 ASP N 1 66 ASP CA 1 66 ASP C 1 67 GLU N 77.00 153.00 123.51 75.40 154.67 1.67 12 0 "[ . 1 . 2]"
87 . 1 72 GLN C 1 73 TRP N 1 73 TRP CA 1 73 TRP C -112.00 -36.00 -68.45 -61.16 -65.47 . . 0 "[ . 1 . 2]"
88 . 1 73 TRP N 1 73 TRP CA 1 73 TRP C 1 74 ARG N 105.00 173.00 125.62 128.04 117.00 1.76 6 0 "[ . 1 . 2]"
89 . 1 73 TRP C 1 74 ARG N 1 74 ARG CA 1 74 ARG C -155.00 -79.00 -135.53 -126.43 -132.48 . . 0 "[ . 1 . 2]"
90 . 1 74 ARG N 1 74 ARG CA 1 74 ARG C 1 75 TRP N 108.00 172.00 148.05 120.12 172.41 0.41 17 0 "[ . 1 . 2]"
91 . 1 74 ARG C 1 75 TRP N 1 75 TRP CA 1 75 TRP C -112.00 -64.00 -81.21 -84.91 -85.88 . . 0 "[ . 1 . 2]"
92 . 1 75 TRP N 1 75 TRP CA 1 75 TRP C 1 76 VAL N 111.00 -145.00 153.47 108.14 -174.65 2.86 2 0 "[ . 1 . 2]"
93 . 1 78 GLN C 1 79 THR N 1 79 THR CA 1 79 THR C -130.00 -38.00 -60.91 -131.15 -42.08 1.15 3 0 "[ . 1 . 2]"
94 . 1 79 THR N 1 79 THR CA 1 79 THR C 1 80 PRO N 111.00 155.00 123.06 113.05 131.33 . . 0 "[ . 1 . 2]"
95 . 1 79 THR C 1 80 PRO N 1 80 PRO CA 1 80 PRO C -88.00 -48.00 -70.64 -72.55 -73.97 . . 0 "[ . 1 . 2]"
96 . 1 80 PRO N 1 80 PRO CA 1 80 PRO C 1 81 PHE N 129.00 169.00 157.74 169.64 169.18 0.80 2 0 "[ . 1 . 2]"
97 . 1 80 PRO C 1 81 PHE N 1 81 PHE CA 1 81 PHE C -146.00 -54.00 -63.83 -78.16 -53.82 0.18 10 0 "[ . 1 . 2]"
98 . 1 81 PHE N 1 81 PHE CA 1 81 PHE C 1 82 ASN N 91.00 151.00 135.04 132.33 127.91 0.24 2 0 "[ . 1 . 2]"
99 . 1 81 PHE C 1 82 ASN N 1 82 ASN CA 1 82 ASN C -166.00 -38.00 -94.43 -119.40 -77.55 . . 0 "[ . 1 . 2]"
100 . 1 82 ASN N 1 82 ASN CA 1 82 ASN C 1 83 PRO N 78.00 170.00 112.69 127.08 124.70 . . 0 "[ . 1 . 2]"
101 . 1 101 CYS C 1 102 VAL N 1 102 VAL CA 1 102 VAL C -171.00 -75.00 -92.25 -115.96 -74.40 0.60 10 0 "[ . 1 . 2]"
102 . 1 102 VAL N 1 102 VAL CA 1 102 VAL C 1 103 VAL N 119.00 171.00 145.05 146.67 145.68 . . 0 "[ . 1 . 2]"
103 . 1 102 VAL C 1 103 VAL N 1 103 VAL CA 1 103 VAL C -147.90 -107.90 -122.94 -130.62 -111.43 . . 0 "[ . 1 . 2]"
104 . 1 103 VAL N 1 103 VAL CA 1 103 VAL C 1 104 LEU N 134.80 174.80 151.39 156.48 155.46 . . 0 "[ . 1 . 2]"
105 . 1 103 VAL C 1 104 LEU N 1 104 LEU CA 1 104 LEU C -137.40 -84.20 -84.25 -88.52 -81.53 2.67 18 0 "[ . 1 . 2]"
106 . 1 104 LEU N 1 104 LEU CA 1 104 LEU C 1 105 VAL N 102.30 151.30 107.64 113.40 110.58 1.44 10 0 "[ . 1 . 2]"
107 . 1 104 LEU C 1 105 VAL N 1 105 VAL CA 1 105 VAL C -170.90 -91.50 -125.22 -134.81 -109.33 . . 0 "[ . 1 . 2]"
108 . 1 105 VAL N 1 105 VAL CA 1 105 VAL C 1 106 TYR N 112.20 152.20 142.95 141.33 141.32 0.11 19 0 "[ . 1 . 2]"
109 . 1 105 VAL C 1 106 TYR N 1 106 TYR CA 1 106 TYR C -147.00 -67.00 -85.22 -80.56 -81.35 . . 0 "[ . 1 . 2]"
110 . 1 106 TYR N 1 106 TYR CA 1 106 TYR C 1 107 ASN N 97.00 161.00 102.49 102.42 99.41 0.91 18 0 "[ . 1 . 2]"
111 . 1 106 TYR C 1 107 ASN N 1 107 ASN CA 1 107 ASN C -167.00 -47.00 -144.88 -162.10 -129.33 . . 0 "[ . 1 . 2]"
112 . 1 107 ASN N 1 107 ASN CA 1 107 ASN C 1 108 GLN N 106.00 -166.00 135.63 116.38 147.17 . . 0 "[ . 1 . 2]"
113 . 1 110 LYS C 1 111 TRP N 1 111 TRP CA 1 111 TRP C -140.00 -48.00 -81.52 -91.73 -69.29 . . 0 "[ . 1 . 2]"
114 . 1 112 ALA N 1 112 ALA CA 1 112 ALA C 1 113 TRP N 70.00 -170.00 169.14 156.41 -179.40 . . 0 "[ . 1 . 2]"
115 . 1 112 ALA C 1 113 TRP N 1 113 TRP CA 1 113 TRP C -179.00 -57.40 -79.15 -96.37 -71.74 . . 0 "[ . 1 . 2]"
116 . 1 113 TRP N 1 113 TRP CA 1 113 TRP C 1 114 ASN N 108.40 177.00 131.44 129.16 125.81 . . 0 "[ . 1 . 2]"
117 . 1 113 TRP C 1 114 ASN N 1 114 ASN CA 1 114 ASN C -151.60 -97.40 -123.82 -140.52 -99.55 . . 0 "[ . 1 . 2]"
118 . 1 114 ASN N 1 114 ASN CA 1 114 ASN C 1 115 ASP N 122.20 170.20 134.35 127.95 125.70 1.95 1 0 "[ . 1 . 2]"
119 . 1 114 ASN C 1 115 ASP N 1 115 ASP CA 1 115 ASP C -176.60 -67.60 -78.80 -89.19 -89.79 0.68 13 0 "[ . 1 . 2]"
120 . 1 115 ASP N 1 115 ASP CA 1 115 ASP C 1 116 VAL N 125.40 175.20 125.51 125.24 125.04 2.75 19 0 "[ . 1 . 2]"
121 . 1 115 ASP C 1 116 VAL N 1 116 VAL CA 1 116 VAL C -162.30 -101.90 -143.58 -158.67 -129.38 . . 0 "[ . 1 . 2]"
122 . 1 116 VAL N 1 116 VAL CA 1 116 VAL C 1 117 PRO N 20.50 158.30 152.63 116.46 160.12 1.82 8 0 "[ . 1 . 2]"
123 . 1 116 VAL C 1 117 PRO N 1 117 PRO CA 1 117 PRO C -86.00 -46.00 -55.47 -67.50 -43.19 2.81 12 0 "[ . 1 . 2]"
124 . 1 117 PRO N 1 117 PRO CA 1 117 PRO C 1 118 CYS N 129.00 169.00 135.21 131.32 129.09 1.09 12 0 "[ . 1 . 2]"
125 . 1 120 PHE C 1 121 GLU N 1 121 GLU CA 1 121 GLU C -151.00 -63.00 -81.21 -83.67 -92.96 . . 0 "[ . 1 . 2]"
126 . 1 121 GLU N 1 121 GLU CA 1 121 GLU C 1 122 ALA N 111.00 167.00 123.88 109.30 146.26 1.70 8 0 "[ . 1 . 2]"
127 . 1 121 GLU C 1 122 ALA N 1 122 ALA CA 1 122 ALA C -162.00 -30.00 -150.10 -147.76 -152.05 0.91 14 0 "[ . 1 . 2]"
128 . 1 122 ALA N 1 122 ALA CA 1 122 ALA C 1 123 SER N 87.00 -169.00 -173.43 176.64 -167.25 1.75 20 0 "[ . 1 . 2]"
129 . 1 122 ALA C 1 123 SER N 1 123 SER CA 1 123 SER C -119.70 -56.70 -79.15 -69.35 -72.96 . . 0 "[ . 1 . 2]"
130 . 1 124 ARG N 1 124 ARG CA 1 124 ARG C 1 125 ILE N 117.00 -163.00 153.77 135.66 170.08 . . 0 "[ . 1 . 2]"
131 . 1 124 ARG C 1 125 ILE N 1 125 ILE CA 1 125 ILE C -156.40 -105.20 -124.50 -136.97 -105.85 . . 0 "[ . 1 . 2]"
132 . 1 125 ILE N 1 125 ILE CA 1 125 ILE C 1 126 CYS N 119.40 159.40 127.40 119.63 135.73 . . 0 "[ . 1 . 2]"
133 . 1 125 ILE C 1 126 CYS N 1 126 CYS CA 1 126 CYS C -152.50 -103.70 -110.12 -103.50 -106.53 1.10 19 0 "[ . 1 . 2]"
134 . 1 126 CYS N 1 126 CYS CA 1 126 CYS C 1 127 LYS N 119.00 177.80 132.16 131.57 130.78 . . 0 "[ . 1 . 2]"
135 . 1 126 CYS C 1 127 LYS N 1 127 LYS CA 1 127 LYS C -152.90 -112.90 -117.07 -128.90 -111.95 0.95 17 0 "[ . 1 . 2]"
136 . 1 127 LYS N 1 127 LYS CA 1 127 LYS C 1 128 ILE N 112.00 152.00 129.45 135.55 132.92 0.25 6 0 "[ . 1 . 2]"
137 . 1 127 LYS C 1 128 ILE N 1 128 ILE CA 1 128 ILE C -153.60 -96.60 -120.96 -139.06 -96.85 . . 0 "[ . 1 . 2]"
138 . 1 128 ILE N 1 128 ILE CA 1 128 ILE C 1 129 PRO N 88.80 154.60 138.81 138.50 136.26 . . 0 "[ . 1 . 2]"
139 . 1 128 ILE C 1 129 PRO N 1 129 PRO CA 1 129 PRO C -81.70 -41.70 -66.48 -60.93 -64.06 . . 0 "[ . 1 . 2]"
140 . 1 129 PRO N 1 129 PRO CA 1 129 PRO C 1 130 GLY N 126.00 166.00 161.61 133.59 168.74 2.74 6 0 "[ . 1 . 2]"
141 . 1 131 THR C 1 132 THR N 1 132 THR CA 1 132 THR C -129.00 -29.00 -66.58 -94.85 -55.91 . . 0 "[ . 1 . 2]"
142 . 1 132 THR N 1 132 THR CA 1 132 THR C 1 133 LEU N -84.00 28.00 -20.97 -21.91 -24.94 . . 0 "[ . 1 . 2]"
143 . 1 132 THR C 1 133 LEU N 1 133 LEU CA 1 133 LEU C -92.00 -48.00 -73.19 -90.32 -54.26 . . 0 "[ . 1 . 2]"
144 . 1 133 LEU N 1 133 LEU CA 1 133 LEU C 1 134 ASN N -73.00 15.00 -29.05 -43.36 -18.14 . . 0 "[ . 1 . 2]"
145 . 1 133 LEU C 1 134 ASN N 1 134 ASN CA 1 134 ASN C -87.00 -47.00 -85.11 -90.89 -67.20 3.89 11 0 "[ . 1 . 2]"
146 . 1 134 ASN N 1 134 ASN CA 1 134 ASN C 1 135 ALA N -58.00 -14.00 -40.14 -56.52 -14.51 . . 0 "[ . 1 . 2]"
147 . 1 134 ASN C 1 135 ALA N 1 135 ALA CA 1 135 ALA C -89.00 -45.00 -89.86 -92.45 -85.46 3.45 8 0 "[ . 1 . 2]"
148 . 1 135 ALA C 1 136 GLU N 1 136 GLU CA 1 136 GLU C -83.00 -43.00 -61.30 -72.36 -48.83 . . 0 "[ . 1 . 2]"
149 . 1 136 GLU N 1 136 GLU CA 1 136 GLU C 1 137 ASN N -65.00 -17.00 -52.32 -59.32 -63.65 2.99 8 0 "[ . 1 . 2]"
150 . 1 136 GLU C 1 137 ASN N 1 137 ASN CA 1 137 ASN C -83.00 -43.00 -76.61 -75.22 -80.10 3.81 8 0 "[ . 1 . 2]"
151 . 1 137 ASN N 1 137 ASN CA 1 137 ASN C 1 138 LEU N -61.00 -21.00 -27.71 -34.80 -20.29 0.71 4 0 "[ . 1 . 2]"
152 . 1 137 ASN C 1 138 LEU N 1 138 LEU CA 1 138 LEU C -82.00 -42.00 -62.69 -69.15 -55.64 . . 0 "[ . 1 . 2]"
153 . 1 138 LEU N 1 138 LEU CA 1 138 LEU C 1 139 TYR N -59.00 -15.00 -47.70 -49.78 -51.68 . . 0 "[ . 1 . 2]"
154 . 1 138 LEU C 1 139 TYR N 1 139 TYR CA 1 139 TYR C -88.00 -48.00 -72.91 -73.54 -74.63 . . 0 "[ . 1 . 2]"
155 . 1 139 TYR N 1 139 TYR CA 1 139 TYR C 1 140 PHE N -61.00 -21.00 -24.12 -31.02 -19.30 1.70 19 0 "[ . 1 . 2]"
156 . 1 139 TYR C 1 140 PHE N 1 140 PHE CA 1 140 PHE C -84.00 -44.00 -68.88 -75.20 -63.02 . . 0 "[ . 1 . 2]"
157 . 1 140 PHE N 1 140 PHE CA 1 140 PHE C 1 141 GLN N -64.00 -24.00 -31.92 -42.54 -23.42 0.58 4 0 "[ . 1 . 2]"
158 . 1 140 PHE C 1 141 GLN N 1 141 GLN CA 1 141 GLN C -86.00 -46.00 -84.76 -89.03 -73.91 3.03 9 0 "[ . 1 . 2]"
159 . 1 141 GLN N 1 141 GLN CA 1 141 GLN C 1 142 SER N -59.00 -7.00 -16.12 -14.70 -31.15 1.81 7 0 "[ . 1 . 2]"
160 . 1 141 GLN C 1 142 SER N 1 142 SER CA 1 142 SER C -95.00 -55.00 -94.62 -96.36 -96.53 1.84 10 0 "[ . 1 . 2]"
161 . 1 11 GLN CA 1 11 GLN CB 1 11 GLN CG 1 11 GLN CD 160.00 -160.00 -177.26 171.77 -167.30 . . 0 "[ . 1 . 2]"
162 . 1 44 GLU CA 1 44 GLU CB 1 44 GLU CG 1 44 GLU CD 160.00 -160.00 -178.59 156.53 -154.41 5.59 1 1 "[+ . 1 . 2]"
163 . 1 65 ARG CA 1 65 ARG CB 1 65 ARG CG 1 65 ARG CD 160.00 -160.00 -169.26 -157.71 -158.58 5.12 11 1 "[ . 1+ . 2]"
164 . 1 70 LYS CA 1 70 LYS CB 1 70 LYS CG 1 70 LYS CD 160.00 -160.00 177.99 177.58 177.37 2.12 13 0 "[ . 1 . 2]"
165 . 1 108 GLN CA 1 108 GLN CB 1 108 GLN CG 1 108 GLN CD 160.00 -160.00 178.12 159.19 -168.52 0.81 11 0 "[ . 1 . 2]"
166 . 1 124 ARG CA 1 124 ARG CB 1 124 ARG CG 1 124 ARG CD 160.00 -160.00 -179.31 -178.36 -179.49 0.62 7 0 "[ . 1 . 2]"
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