NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
653595 |
6lci   |
cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_6lci
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 225
_TA_constraint_stats_list.Viol_count 335
_TA_constraint_stats_list.Viol_total 8408.70
_TA_constraint_stats_list.Viol_max 5.49
_TA_constraint_stats_list.Viol_rms 0.42
_TA_constraint_stats_list.Viol_average_all_restraints 0.09
_TA_constraint_stats_list.Viol_average_violations_only 1.26
_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 6 PHE C 1 7 GLU N 1 7 GLU CA 1 7 GLU C -132.00 -54.00 -73.40 -72.69 -73.01 . . 0 "[ . 1 . 2]"
2 . 1 7 GLU N 1 7 GLU CA 1 7 GLU C 1 8 LYS N -55.00 13.00 -25.88 -22.90 -23.25 . . 0 "[ . 1 . 2]"
3 . 1 7 GLU C 1 8 LYS N 1 8 LYS CA 1 8 LYS C -179.00 -79.00 -88.47 -146.60 -78.07 0.93 11 0 "[ . 1 . 2]"
4 . 1 8 LYS N 1 8 LYS CA 1 8 LYS C 1 9 SER N 127.00 -169.00 148.00 159.36 152.33 . . 0 "[ . 1 . 2]"
5 . 1 8 LYS C 1 9 SER N 1 9 SER CA 1 9 SER C -145.50 -45.50 -140.01 -135.19 -139.14 1.19 20 0 "[ . 1 . 2]"
6 . 1 9 SER N 1 9 SER CA 1 9 SER C 1 10 GLU N 93.70 177.70 144.58 154.88 150.73 . . 0 "[ . 1 . 2]"
7 . 1 9 SER C 1 10 GLU N 1 10 GLU CA 1 10 GLU C -147.00 -47.00 -112.13 -136.44 -90.60 . . 0 "[ . 1 . 2]"
8 . 1 10 GLU N 1 10 GLU CA 1 10 GLU C 1 11 LYS N 78.00 170.00 169.32 153.23 171.91 1.91 8 0 "[ . 1 . 2]"
9 . 1 10 GLU C 1 11 LYS N 1 11 LYS CA 1 11 LYS C -145.00 -45.00 -105.73 -88.24 -90.63 . . 0 "[ . 1 . 2]"
10 . 1 11 LYS N 1 11 LYS CA 1 11 LYS C 1 12 PHE N 113.00 161.00 158.85 161.30 161.13 1.82 7 0 "[ . 1 . 2]"
11 . 1 11 LYS C 1 12 PHE N 1 12 PHE CA 1 12 PHE C -90.00 -48.00 -85.80 -79.21 -82.09 1.06 20 0 "[ . 1 . 2]"
12 . 1 12 PHE N 1 12 PHE CA 1 12 PHE C 1 13 PRO N 118.00 166.00 151.43 122.36 159.86 . . 0 "[ . 1 . 2]"
13 . 1 15 GLY C 1 16 TRP N 1 16 TRP CA 1 16 TRP C -174.00 -74.00 -83.30 -94.58 -75.72 . . 0 "[ . 1 . 2]"
14 . 1 16 TRP N 1 16 TRP CA 1 16 TRP C 1 17 PHE N 127.00 179.00 143.87 132.35 178.54 . . 0 "[ . 1 . 2]"
15 . 1 16 TRP C 1 17 PHE N 1 17 PHE CA 1 17 PHE C 175.00 -85.00 -159.85 -168.26 -154.42 . . 0 "[ . 1 . 2]"
16 . 1 17 PHE N 1 17 PHE CA 1 17 PHE C 1 18 PHE N 137.30 178.70 163.00 160.83 165.29 . . 0 "[ . 1 . 2]"
17 . 1 17 PHE C 1 18 PHE N 1 18 PHE CA 1 18 PHE C -167.60 -67.60 -119.41 -121.76 -116.28 . . 0 "[ . 1 . 2]"
18 . 1 18 PHE N 1 18 PHE CA 1 18 PHE C 1 19 ILE N 99.90 173.50 138.21 134.66 140.67 . . 0 "[ . 1 . 2]"
19 . 1 18 PHE C 1 19 ILE N 1 19 ILE CA 1 19 ILE C -144.60 -44.60 -103.48 -98.21 -99.10 . . 0 "[ . 1 . 2]"
20 . 1 19 ILE N 1 19 ILE CA 1 19 ILE C 1 20 LYS N 100.50 148.10 115.99 112.23 106.03 . . 0 "[ . 1 . 2]"
21 . 1 19 ILE C 1 20 LYS N 1 20 LYS CA 1 20 LYS C -155.00 -89.00 -114.89 -126.58 -104.71 . . 0 "[ . 1 . 2]"
22 . 1 20 LYS N 1 20 LYS CA 1 20 LYS C 1 21 ASN N 110.00 150.00 135.15 131.06 129.60 . . 0 "[ . 1 . 2]"
23 . 1 20 LYS C 1 21 ASN N 1 21 ASN CA 1 21 ASN C -103.00 -49.00 -86.40 -93.21 -81.01 . . 0 "[ . 1 . 2]"
24 . 1 21 ASN N 1 21 ASN CA 1 21 ASN C 1 22 ASN N 103.00 143.00 124.80 121.40 119.95 . . 0 "[ . 1 . 2]"
25 . 1 21 ASN C 1 22 ASN N 1 22 ASN CA 1 22 ASN C -77.20 -37.20 -62.88 -61.83 -62.08 . . 0 "[ . 1 . 2]"
26 . 1 22 ASN N 1 22 ASN CA 1 22 ASN C 1 23 SER N -69.40 1.00 -26.76 -28.88 -32.50 . . 0 "[ . 1 . 2]"
27 . 1 22 ASN C 1 23 SER N 1 23 SER CA 1 23 SER C -121.00 -24.40 -64.79 -64.07 -65.16 . . 0 "[ . 1 . 2]"
28 . 1 23 SER N 1 23 SER CA 1 23 SER C 1 24 ASN N -62.10 9.10 -42.59 -46.06 -36.99 . . 0 "[ . 1 . 2]"
29 . 1 23 SER C 1 24 ASN N 1 24 ASN CA 1 24 ASN C -124.80 -68.00 -110.05 -125.80 -96.52 1.00 15 0 "[ . 1 . 2]"
30 . 1 24 ASN N 1 24 ASN CA 1 24 ASN C 1 25 GLY N -22.90 17.10 -17.78 -21.39 -21.84 1.70 14 0 "[ . 1 . 2]"
31 . 1 24 ASN C 1 25 GLY N 1 25 GLY CA 1 25 GLY C 46.70 146.70 75.89 76.39 76.12 . . 0 "[ . 1 . 2]"
32 . 1 25 GLY N 1 25 GLY CA 1 25 GLY C 1 26 TYR N -17.10 28.70 18.91 20.14 19.68 . . 0 "[ . 1 . 2]"
33 . 1 26 TYR C 1 27 VAL N 1 27 VAL CA 1 27 VAL C -177.00 -77.00 -115.61 -121.10 -106.80 . . 0 "[ . 1 . 2]"
34 . 1 27 VAL N 1 27 VAL CA 1 27 VAL C 1 28 LEU N 142.00 -178.00 159.96 158.44 154.29 . . 0 "[ . 1 . 2]"
35 . 1 27 VAL C 1 28 LEU N 1 28 LEU CA 1 28 LEU C -162.30 -62.30 -71.05 -91.86 -61.60 0.70 1 0 "[ . 1 . 2]"
36 . 1 28 LEU N 1 28 LEU CA 1 28 LEU C 1 29 MET N 109.50 178.50 134.79 134.24 133.81 . . 0 "[ . 1 . 2]"
37 . 1 28 LEU C 1 29 MET N 1 29 MET CA 1 29 MET C -142.60 -42.60 -145.85 -147.57 -144.71 4.97 5 0 "[ . 1 . 2]"
38 . 1 29 MET N 1 29 MET CA 1 29 MET C 1 30 VAL N 95.60 175.00 167.56 163.01 178.70 3.70 5 0 "[ . 1 . 2]"
39 . 1 29 MET C 1 30 VAL N 1 30 VAL CA 1 30 VAL C -134.00 -34.00 -69.46 -70.53 -70.79 . . 0 "[ . 1 . 2]"
40 . 1 30 VAL N 1 30 VAL CA 1 30 VAL C 1 31 ASP N 82.00 -178.00 164.50 155.08 179.07 . . 0 "[ . 1 . 2]"
41 . 1 30 VAL C 1 31 ASP N 1 31 ASP CA 1 31 ASP C -96.30 -29.50 -52.87 -49.81 -52.28 . . 0 "[ . 1 . 2]"
42 . 1 31 ASP N 1 31 ASP CA 1 31 ASP C 1 32 ASN N -60.20 -3.00 -41.47 -44.32 -47.91 . . 0 "[ . 1 . 2]"
43 . 1 41 ILE C 1 42 VAL N 1 42 VAL CA 1 42 VAL C -160.00 -112.00 -131.64 -132.39 -133.71 . . 0 "[ . 1 . 2]"
44 . 1 42 VAL N 1 42 VAL CA 1 42 VAL C 1 43 LEU N 143.00 -173.00 165.56 161.41 170.24 . . 0 "[ . 1 . 2]"
45 . 1 42 VAL C 1 43 LEU N 1 43 LEU CA 1 43 LEU C -164.00 -64.00 -93.10 -93.03 -94.36 . . 0 "[ . 1 . 2]"
46 . 1 43 LEU N 1 43 LEU CA 1 43 LEU C 1 44 ALA N 126.00 174.00 143.85 143.18 143.15 . . 0 "[ . 1 . 2]"
47 . 1 43 LEU C 1 44 ALA N 1 44 ALA CA 1 44 ALA C 176.00 -84.00 -146.54 -145.48 -145.83 . . 0 "[ . 1 . 2]"
48 . 1 44 ALA N 1 44 ALA CA 1 44 ALA C 1 45 THR N 114.00 166.00 150.11 146.18 152.16 . . 0 "[ . 1 . 2]"
49 . 1 44 ALA C 1 45 THR N 1 45 THR CA 1 45 THR C -152.00 -52.00 -62.85 -67.69 -58.71 . . 0 "[ . 1 . 2]"
50 . 1 45 THR N 1 45 THR CA 1 45 THR C 1 46 LEU N 104.00 164.00 149.30 154.73 153.50 . . 0 "[ . 1 . 2]"
51 . 1 45 THR C 1 46 LEU N 1 46 LEU CA 1 46 LEU C -147.00 -47.00 -62.42 -67.25 -58.85 . . 0 "[ . 1 . 2]"
52 . 1 46 LEU N 1 46 LEU CA 1 46 LEU C 1 47 ARG N 95.00 139.00 138.86 139.45 139.42 0.84 11 0 "[ . 1 . 2]"
53 . 1 48 THR C 1 49 LYS N 1 49 LYS CA 1 49 LYS C -158.00 -58.00 -119.86 -129.65 -135.27 . . 0 "[ . 1 . 2]"
54 . 1 49 LYS N 1 49 LYS CA 1 49 LYS C 1 50 ASP N 136.00 180.00 148.97 138.30 160.61 . . 0 "[ . 1 . 2]"
55 . 1 49 LYS C 1 50 ASP N 1 50 ASP CA 1 50 ASP C 37.00 77.00 59.07 57.35 61.64 . . 0 "[ . 1 . 2]"
56 . 1 50 ASP N 1 50 ASP CA 1 50 ASP C 1 51 TYR N 10.00 74.00 43.04 42.16 41.86 . . 0 "[ . 1 . 2]"
57 . 1 50 ASP C 1 51 TYR N 1 51 TYR CA 1 51 TYR C -146.00 -62.00 -87.89 -93.37 -97.22 . . 0 "[ . 1 . 2]"
58 . 1 51 TYR N 1 51 TYR CA 1 51 TYR C 1 52 ALA N -30.00 38.00 -2.83 -31.44 17.49 1.44 15 0 "[ . 1 . 2]"
59 . 1 51 TYR C 1 52 ALA N 1 52 ALA CA 1 52 ALA C -76.00 -36.00 -63.08 -64.27 -60.63 . . 0 "[ . 1 . 2]"
60 . 1 52 ALA N 1 52 ALA CA 1 52 ALA C 1 53 SER N -59.00 -19.00 -37.28 -38.71 -34.46 . . 0 "[ . 1 . 2]"
61 . 1 52 ALA C 1 53 SER N 1 53 SER CA 1 53 SER C -86.00 -46.00 -71.12 -75.04 -66.86 . . 0 "[ . 1 . 2]"
62 . 1 53 SER N 1 53 SER CA 1 53 SER C 1 54 GLN N -38.00 6.00 -16.81 -12.67 -13.12 . . 0 "[ . 1 . 2]"
63 . 1 53 SER C 1 54 GLN N 1 54 GLN CA 1 54 GLN C -141.00 -57.00 -100.64 -101.14 -101.65 . . 0 "[ . 1 . 2]"
64 . 1 54 GLN N 1 54 GLN CA 1 54 GLN C 1 55 LEU N -33.00 19.00 3.07 0.11 7.64 . . 0 "[ . 1 . 2]"
65 . 1 54 GLN C 1 55 LEU N 1 55 LEU CA 1 55 LEU C -166.00 -66.00 -98.74 -95.96 -96.66 . . 0 "[ . 1 . 2]"
66 . 1 55 LEU N 1 55 LEU CA 1 55 LEU C 1 56 TRP N 120.00 172.00 137.03 135.39 133.53 . . 0 "[ . 1 . 2]"
67 . 1 55 LEU C 1 56 TRP N 1 56 TRP CA 1 56 TRP C 174.00 -86.00 -127.60 -130.69 -125.42 . . 0 "[ . 1 . 2]"
68 . 1 56 TRP N 1 56 TRP CA 1 56 TRP C 1 57 ARG N 139.00 179.00 153.41 153.83 152.73 . . 0 "[ . 1 . 2]"
69 . 1 56 TRP C 1 57 ARG N 1 57 ARG CA 1 57 ARG C 170.00 -90.00 -135.44 -149.59 -124.26 . . 0 "[ . 1 . 2]"
70 . 1 57 ARG N 1 57 ARG CA 1 57 ARG C 1 58 HIS N 121.00 -179.00 144.90 158.44 156.30 . . 0 "[ . 1 . 2]"
71 . 1 57 ARG C 1 58 HIS N 1 58 HIS CA 1 58 HIS C -167.00 -67.00 -100.69 -119.76 -89.18 . . 0 "[ . 1 . 2]"
72 . 1 58 HIS N 1 58 HIS CA 1 58 HIS C 1 59 ASP N 96.00 136.00 120.30 128.50 118.55 0.21 7 0 "[ . 1 . 2]"
73 . 1 62 GLY C 1 63 TYR N 1 63 TYR CA 1 63 TYR C -163.00 -63.00 -104.96 -109.70 -111.62 . . 0 "[ . 1 . 2]"
74 . 1 63 TYR N 1 63 TYR CA 1 63 TYR C 1 64 LEU N 99.00 175.00 151.93 133.33 164.90 . . 0 "[ . 1 . 2]"
75 . 1 63 TYR C 1 64 LEU N 1 64 LEU CA 1 64 LEU C -151.70 -51.70 -100.88 -95.17 -97.00 . . 0 "[ . 1 . 2]"
76 . 1 64 LEU N 1 64 LEU CA 1 64 LEU C 1 65 VAL N 104.10 160.70 128.96 127.81 126.29 . . 0 "[ . 1 . 2]"
77 . 1 64 LEU C 1 65 VAL N 1 65 VAL CA 1 65 VAL C -157.00 -73.00 -117.41 -128.38 -105.85 . . 0 "[ . 1 . 2]"
78 . 1 65 VAL N 1 65 VAL CA 1 65 VAL C 1 66 ASN N 115.00 155.00 136.66 134.04 140.45 . . 0 "[ . 1 . 2]"
79 . 1 65 VAL C 1 66 ASN N 1 66 ASN CA 1 66 ASN C -105.20 -39.40 -78.96 -88.92 -73.24 . . 0 "[ . 1 . 2]"
80 . 1 66 ASN N 1 66 ASN CA 1 66 ASN C 1 67 LYS N 109.60 150.80 129.49 123.42 132.49 . . 0 "[ . 1 . 2]"
81 . 1 66 ASN C 1 67 LYS N 1 67 LYS CA 1 67 LYS C -79.00 -39.00 -62.67 -61.94 -62.18 . . 0 "[ . 1 . 2]"
82 . 1 67 LYS N 1 67 LYS CA 1 67 LYS C 1 68 LYS N -69.00 3.00 -41.08 -43.05 -43.36 . . 0 "[ . 1 . 2]"
83 . 1 67 LYS C 1 68 LYS N 1 68 LYS CA 1 68 LYS C -105.00 -39.00 -74.14 -84.89 -62.87 . . 0 "[ . 1 . 2]"
84 . 1 68 LYS N 1 68 LYS CA 1 68 LYS C 1 69 SER N -57.00 7.00 -52.06 -52.09 -52.35 . . 0 "[ . 1 . 2]"
85 . 1 68 LYS C 1 69 SER N 1 69 SER CA 1 69 SER C -130.30 -54.50 -76.09 -68.24 -68.37 . . 0 "[ . 1 . 2]"
86 . 1 69 SER N 1 69 SER CA 1 69 SER C 1 70 GLY N -52.70 37.30 -36.12 -39.49 -39.64 . . 0 "[ . 1 . 2]"
87 . 1 69 SER C 1 70 GLY N 1 70 GLY CA 1 70 GLY C 37.70 129.90 82.17 81.49 81.43 . . 0 "[ . 1 . 2]"
88 . 1 70 GLY N 1 70 GLY CA 1 70 GLY C 1 71 GLN N -19.00 42.60 5.19 4.89 4.60 . . 0 "[ . 1 . 2]"
89 . 1 71 GLN C 1 72 VAL N 1 72 VAL CA 1 72 VAL C -173.00 -83.00 -115.35 -119.18 -106.79 . . 0 "[ . 1 . 2]"
90 . 1 72 VAL N 1 72 VAL CA 1 72 VAL C 1 73 MET N 143.00 -177.00 159.86 160.29 156.82 . . 0 "[ . 1 . 2]"
91 . 1 73 MET C 1 74 ASP N 1 74 ASP CA 1 74 ASP C -177.00 -77.00 -156.44 -162.42 -152.04 . . 0 "[ . 1 . 2]"
92 . 1 74 ASP N 1 74 ASP CA 1 74 ASP C 1 75 ILE N 134.00 -174.00 171.42 166.61 -177.86 . . 0 "[ . 1 . 2]"
93 . 1 74 ASP C 1 75 ILE N 1 75 ILE CA 1 75 ILE C -140.00 -40.00 -86.88 -93.39 -77.80 . . 0 "[ . 1 . 2]"
94 . 1 75 ILE N 1 75 ILE CA 1 75 ILE C 1 76 ALA N 144.00 -176.00 143.23 142.25 145.27 1.75 11 0 "[ . 1 . 2]"
95 . 1 75 ILE C 1 76 ALA N 1 76 ALA CA 1 76 ALA C -79.00 -39.00 -67.56 -67.73 -68.05 . . 0 "[ . 1 . 2]"
96 . 1 76 ALA N 1 76 ALA CA 1 76 ALA C 1 77 LYS N -56.00 -4.00 -42.46 -41.52 -42.05 . . 0 "[ . 1 . 2]"
97 . 1 76 ALA C 1 77 LYS N 1 77 LYS CA 1 77 LYS C -111.30 -63.70 -72.08 -71.50 -71.65 . . 0 "[ . 1 . 2]"
98 . 1 77 LYS N 1 77 LYS CA 1 77 LYS C 1 78 GLY N -31.30 31.10 -33.20 -34.07 -31.70 2.77 2 0 "[ . 1 . 2]"
99 . 1 77 LYS C 1 78 GLY N 1 78 GLY CA 1 78 GLY C 31.70 116.10 89.79 87.83 91.10 . . 0 "[ . 1 . 2]"
100 . 1 78 GLY N 1 78 GLY CA 1 78 GLY C 1 79 THR N -10.20 59.00 -7.53 -7.99 -8.12 0.17 18 0 "[ . 1 . 2]"
101 . 1 78 GLY C 1 79 THR N 1 79 THR CA 1 79 THR C -148.40 -49.20 -121.01 -126.25 -113.49 . . 0 "[ . 1 . 2]"
102 . 1 79 THR N 1 79 THR CA 1 79 THR C 1 80 PRO N 84.20 173.20 123.98 117.18 128.72 . . 0 "[ . 1 . 2]"
103 . 1 79 THR C 1 80 PRO N 1 80 PRO CA 1 80 PRO C -90.50 -38.50 -69.26 -62.35 -69.41 . . 0 "[ . 1 . 2]"
104 . 1 80 PRO N 1 80 PRO CA 1 80 PRO C 1 81 LYS N 106.80 -173.20 119.87 118.63 117.89 0.04 19 0 "[ . 1 . 2]"
105 . 1 80 PRO C 1 81 LYS N 1 81 LYS CA 1 81 LYS C -170.70 -70.70 -142.10 -150.54 -129.42 . . 0 "[ . 1 . 2]"
106 . 1 81 LYS N 1 81 LYS CA 1 81 LYS C 1 82 ALA N 102.10 -159.70 161.23 150.15 168.04 . . 0 "[ . 1 . 2]"
107 . 1 81 LYS C 1 82 ALA N 1 82 ALA CA 1 82 ALA C -88.40 -28.40 -74.70 -80.03 -71.16 . . 0 "[ . 1 . 2]"
108 . 1 85 ASP C 1 86 ILE N 1 86 ILE CA 1 86 ILE C -167.00 -67.00 -109.17 -105.19 -106.59 . . 0 "[ . 1 . 2]"
109 . 1 86 ILE N 1 86 ILE CA 1 86 ILE C 1 87 VAL N 117.00 -175.00 128.53 128.25 128.01 . . 0 "[ . 1 . 2]"
110 . 1 86 ILE C 1 87 VAL N 1 87 VAL CA 1 87 VAL C -165.00 -93.00 -131.73 -133.65 -129.74 . . 0 "[ . 1 . 2]"
111 . 1 87 VAL N 1 87 VAL CA 1 87 VAL C 1 88 GLN N 141.00 -175.00 163.54 163.27 162.48 . . 0 "[ . 1 . 2]"
112 . 1 87 VAL C 1 88 GLN N 1 88 GLN CA 1 88 GLN C -173.00 -73.00 -86.85 -100.95 -76.70 . . 0 "[ . 1 . 2]"
113 . 1 88 GLN N 1 88 GLN CA 1 88 GLN C 1 89 GLN N 108.00 168.00 140.71 140.96 140.05 . . 0 "[ . 1 . 2]"
114 . 1 88 GLN C 1 89 GLN N 1 89 GLN CA 1 89 GLN C 177.00 -87.00 -145.90 -166.32 -139.23 . . 0 "[ . 1 . 2]"
115 . 1 89 GLN N 1 89 GLN CA 1 89 GLN C 1 90 THR N 114.00 -170.00 171.93 172.97 171.67 . . 0 "[ . 1 . 2]"
116 . 1 89 GLN C 1 90 THR N 1 90 THR CA 1 90 THR C -128.80 -28.80 -70.17 -76.07 -62.68 . . 0 "[ . 1 . 2]"
117 . 1 90 THR N 1 90 THR CA 1 90 THR C 1 91 GLN N 115.90 169.10 154.23 159.70 150.92 0.08 15 0 "[ . 1 . 2]"
118 . 1 90 THR C 1 91 GLN N 1 91 GLN CA 1 91 GLN C -126.20 -26.20 -76.60 -131.25 -64.20 5.05 11 1 "[ . 1+ . 2]"
119 . 1 91 GLN N 1 91 GLN CA 1 91 GLN C 1 92 ALA N 94.70 156.10 153.48 134.97 161.59 5.49 11 1 "[ . 1+ . 2]"
120 . 1 93 GLY C 1 94 SER N 1 94 SER CA 1 94 SER C -103.00 -31.00 -74.62 -70.55 -85.50 . . 0 "[ . 1 . 2]"
121 . 1 94 SER N 1 94 SER CA 1 94 SER C 1 95 ASN N -53.00 7.00 -26.74 -51.43 7.46 0.46 1 0 "[ . 1 . 2]"
122 . 1 95 ASN C 1 96 VAL N 1 96 VAL CA 1 96 VAL C -132.00 -32.00 -120.43 -119.34 -119.52 1.74 18 0 "[ . 1 . 2]"
123 . 1 96 VAL N 1 96 VAL CA 1 96 VAL C 1 97 LYS N 103.00 155.00 130.69 124.92 124.04 . . 0 "[ . 1 . 2]"
124 . 1 96 VAL C 1 97 LYS N 1 97 LYS CA 1 97 LYS C -127.00 -27.00 -64.44 -70.22 -60.21 . . 0 "[ . 1 . 2]"
125 . 1 97 LYS N 1 97 LYS CA 1 97 LYS C 1 98 ASP N 105.00 -175.00 146.83 145.19 144.00 . . 0 "[ . 1 . 2]"
126 . 1 97 LYS C 1 98 ASP N 1 98 ASP CA 1 98 ASP C -77.00 -35.00 -68.83 -78.18 -64.22 1.18 16 0 "[ . 1 . 2]"
127 . 1 98 ASP N 1 98 ASP CA 1 98 ASP C 1 99 ASP N -56.00 -16.00 -19.29 -20.64 -21.54 0.47 11 0 "[ . 1 . 2]"
128 . 1 98 ASP C 1 99 ASP N 1 99 ASP CA 1 99 ASP C -89.00 -49.00 -89.79 -90.78 -86.44 1.78 13 0 "[ . 1 . 2]"
129 . 1 99 ASP N 1 99 ASP CA 1 99 ASP C 1 100 LEU N -37.00 7.00 -5.07 -11.97 -1.62 . . 0 "[ . 1 . 2]"
130 . 1 99 ASP C 1 100 LEU N 1 100 LEU CA 1 100 LEU C -147.00 -47.00 -115.65 -116.99 -117.76 . . 0 "[ . 1 . 2]"
131 . 1 100 LEU N 1 100 LEU CA 1 100 LEU C 1 101 ASN N -46.00 34.00 9.27 10.62 10.25 . . 0 "[ . 1 . 2]"
132 . 1 100 LEU C 1 101 ASN N 1 101 ASN CA 1 101 ASN C -136.00 -36.00 -88.86 -87.86 -88.97 . . 0 "[ . 1 . 2]"
133 . 1 101 ASN N 1 101 ASN CA 1 101 ASN C 1 102 PHE N 99.00 167.00 118.38 97.96 139.11 1.04 13 0 "[ . 1 . 2]"
134 . 1 101 ASN C 1 102 PHE N 1 102 PHE CA 1 102 PHE C -97.00 -31.00 -91.28 -98.87 -75.51 1.87 11 0 "[ . 1 . 2]"
135 . 1 102 PHE N 1 102 PHE CA 1 102 PHE C 1 103 GLN N -62.00 -2.00 -7.77 -5.46 -6.32 . . 0 "[ . 1 . 2]"
136 . 1 103 GLN C 1 104 LYS N 1 104 LYS CA 1 104 LYS C -146.00 -46.00 -75.49 -77.52 -78.26 . . 0 "[ . 1 . 2]"
137 . 1 104 LYS N 1 104 LYS CA 1 104 LYS C 1 105 PHE N 110.00 154.00 129.25 124.41 140.34 . . 0 "[ . 1 . 2]"
138 . 1 104 LYS C 1 105 PHE N 1 105 PHE CA 1 105 PHE C -171.00 -71.00 -120.51 -120.02 -123.45 . . 0 "[ . 1 . 2]"
139 . 1 105 PHE N 1 105 PHE CA 1 105 PHE C 1 106 GLY N 102.00 162.00 153.57 148.51 157.09 . . 0 "[ . 1 . 2]"
140 . 1 105 PHE C 1 106 GLY N 1 106 GLY CA 1 106 GLY C 173.90 -86.10 -115.32 -136.85 -110.08 . . 0 "[ . 1 . 2]"
141 . 1 106 GLY N 1 106 GLY CA 1 106 GLY C 1 107 LEU N 114.90 -175.10 154.68 158.47 155.17 . . 0 "[ . 1 . 2]"
142 . 1 106 GLY C 1 107 LEU N 1 107 LEU CA 1 107 LEU C -170.80 -70.80 -123.51 -146.32 -105.60 . . 0 "[ . 1 . 2]"
143 . 1 107 LEU N 1 107 LEU CA 1 107 LEU C 1 108 SER N 110.10 152.50 126.00 137.15 132.29 0.13 16 0 "[ . 1 . 2]"
144 . 1 107 LEU C 1 108 SER N 1 108 SER CA 1 108 SER C -138.00 -38.00 -90.43 -86.78 -89.15 . . 0 "[ . 1 . 2]"
145 . 1 108 SER N 1 108 SER CA 1 108 SER C 1 109 PRO N 93.00 -171.00 149.22 162.63 160.65 . . 0 "[ . 1 . 2]"
146 . 1 108 SER C 1 109 PRO N 1 109 PRO CA 1 109 PRO C -80.80 -28.00 -65.89 -59.46 -60.30 . . 0 "[ . 1 . 2]"
147 . 1 109 PRO N 1 109 PRO CA 1 109 PRO C 1 110 TYR N -52.90 -8.50 -12.76 -16.93 -19.55 0.36 7 0 "[ . 1 . 2]"
148 . 1 109 PRO C 1 110 TYR N 1 110 TYR CA 1 110 TYR C -138.00 -48.00 -83.72 -72.93 -74.79 . . 0 "[ . 1 . 2]"
149 . 1 110 TYR N 1 110 TYR CA 1 110 TYR C 1 111 GLY N -48.00 40.00 -6.31 -26.03 2.34 . . 0 "[ . 1 . 2]"
150 . 1 111 GLY C 1 112 HIS N 1 112 HIS CA 1 112 HIS C -134.00 -34.00 -105.01 -134.21 -82.72 0.21 3 0 "[ . 1 . 2]"
151 . 1 112 HIS N 1 112 HIS CA 1 112 HIS C 1 113 ILE N 126.00 170.00 142.98 130.80 154.16 . . 0 "[ . 1 . 2]"
152 . 1 112 HIS C 1 113 ILE N 1 113 ILE CA 1 113 ILE C -158.00 -58.00 -112.32 -101.93 -107.35 . . 0 "[ . 1 . 2]"
153 . 1 113 ILE N 1 113 ILE CA 1 113 ILE C 1 114 TYR N 103.00 152.40 125.90 126.13 125.30 . . 0 "[ . 1 . 2]"
154 . 1 113 ILE C 1 114 TYR N 1 114 TYR CA 1 114 TYR C -169.70 -110.10 -132.45 -140.06 -127.00 . . 0 "[ . 1 . 2]"
155 . 1 114 TYR N 1 114 TYR CA 1 114 TYR C 1 115 LEU N 139.50 -176.10 176.27 171.18 -178.67 . . 0 "[ . 1 . 2]"
156 . 1 114 TYR C 1 115 LEU N 1 115 LEU CA 1 115 LEU C -120.00 -42.00 -86.03 -83.54 -83.92 . . 0 "[ . 1 . 2]"
157 . 1 115 LEU N 1 115 LEU CA 1 115 LEU C 1 116 ALA N 85.00 153.00 149.46 145.88 151.29 . . 0 "[ . 1 . 2]"
158 . 1 115 LEU C 1 116 ALA N 1 116 ALA CA 1 116 ALA C -95.00 -29.00 -71.26 -65.87 -70.07 . . 0 "[ . 1 . 2]"
159 . 1 116 ALA N 1 116 ALA CA 1 116 ALA C 1 117 ASN N -52.00 -12.00 -26.46 -37.77 -17.52 . . 0 "[ . 1 . 2]"
160 . 1 116 ALA C 1 117 ASN N 1 117 ASN CA 1 117 ASN C -146.00 -50.00 -101.86 -98.74 -99.80 . . 0 "[ . 1 . 2]"
161 . 1 117 ASN N 1 117 ASN CA 1 117 ASN C 1 118 LYS N -32.00 52.00 -19.29 -15.70 -17.30 . . 0 "[ . 1 . 2]"
162 . 1 117 ASN C 1 118 LYS N 1 118 LYS CA 1 118 LYS C -132.30 -32.30 -133.62 -135.25 -131.79 2.95 9 0 "[ . 1 . 2]"
163 . 1 118 LYS N 1 118 LYS CA 1 118 LYS C 1 119 PRO N 72.70 172.70 84.47 82.50 86.02 . . 0 "[ . 1 . 2]"
164 . 1 118 LYS C 1 119 PRO N 1 119 PRO CA 1 119 PRO C -90.00 -30.00 -67.17 -69.15 -64.65 . . 0 "[ . 1 . 2]"
165 . 1 119 PRO N 1 119 PRO CA 1 119 PRO C 1 120 SER N -45.00 -1.00 -9.41 -15.02 -6.08 . . 0 "[ . 1 . 2]"
166 . 1 119 PRO C 1 120 SER N 1 120 SER CA 1 120 SER C -127.00 -49.00 -85.63 -88.88 -79.94 . . 0 "[ . 1 . 2]"
167 . 1 120 SER N 1 120 SER CA 1 120 SER C 1 121 LEU N -29.00 11.00 -17.98 -29.46 -8.71 0.46 8 0 "[ . 1 . 2]"
168 . 1 120 SER C 1 121 LEU N 1 121 LEU CA 1 121 LEU C -139.00 -39.00 -100.57 -98.81 -102.22 . . 0 "[ . 1 . 2]"
169 . 1 121 LEU N 1 121 LEU CA 1 121 LEU C 1 122 ILE N 133.00 173.00 130.95 129.95 131.88 3.05 9 0 "[ . 1 . 2]"
170 . 1 121 LEU C 1 122 ILE N 1 122 ILE CA 1 122 ILE C -170.00 -70.00 -134.89 -141.44 -133.19 . . 0 "[ . 1 . 2]"
171 . 1 122 ILE N 1 122 ILE CA 1 122 ILE C 1 123 LEU N 140.00 180.00 164.51 160.36 168.20 . . 0 "[ . 1 . 2]"
172 . 1 125 ILE N 1 125 ILE CA 1 125 ILE C 1 126 LYS N 104.60 -160.20 161.83 168.64 161.64 . . 0 "[ . 1 . 2]"
173 . 1 125 ILE C 1 126 LYS N 1 126 LYS CA 1 126 LYS C -133.30 -70.90 -110.46 -119.07 -122.44 . . 0 "[ . 1 . 2]"
174 . 1 126 LYS N 1 126 LYS CA 1 126 LYS C 1 127 GLU N 98.00 168.60 136.29 111.06 147.79 . . 0 "[ . 1 . 2]"
175 . 1 126 LYS C 1 127 GLU N 1 127 GLU CA 1 127 GLU C -134.00 -34.00 -95.67 -134.75 -66.95 0.75 10 0 "[ . 1 . 2]"
176 . 1 127 GLU N 1 127 GLU CA 1 127 GLU C 1 128 SER N 112.00 164.00 141.68 125.76 164.67 0.67 13 0 "[ . 1 . 2]"
177 . 1 127 GLU C 1 128 SER N 1 128 SER CA 1 128 SER C -148.00 -48.00 -138.22 -150.90 -98.16 2.90 17 0 "[ . 1 . 2]"
178 . 1 128 SER N 1 128 SER CA 1 128 SER C 1 129 PHE N 118.00 -162.00 162.26 172.34 167.54 . . 0 "[ . 1 . 2]"
179 . 1 128 SER C 1 129 PHE N 1 129 PHE CA 1 129 PHE C -97.00 -33.00 -69.53 -92.34 -60.80 . . 0 "[ . 1 . 2]"
180 . 1 129 PHE N 1 129 PHE CA 1 129 PHE C 1 130 PHE N -45.30 -5.30 -29.78 -30.93 -36.00 0.34 5 0 "[ . 1 . 2]"
181 . 1 129 PHE C 1 130 PHE N 1 130 PHE CA 1 130 PHE C -140.70 -55.50 -100.31 -110.63 -89.06 . . 0 "[ . 1 . 2]"
182 . 1 130 PHE N 1 130 PHE CA 1 130 PHE C 1 131 ALA N -57.10 37.50 22.33 23.45 11.25 0.01 15 0 "[ . 1 . 2]"
183 . 1 132 ARG C 1 133 ARG N 1 133 ARG CA 1 133 ARG C -103.00 -25.00 -66.49 -70.39 -72.51 . . 0 "[ . 1 . 2]"
184 . 1 133 ARG N 1 133 ARG CA 1 133 ARG C 1 134 GLU N -67.00 9.00 -29.03 -36.89 -13.11 . . 0 "[ . 1 . 2]"
185 . 1 133 ARG C 1 134 GLU N 1 134 GLU CA 1 134 GLU C -128.40 -51.80 -87.85 -88.24 -90.49 . . 0 "[ . 1 . 2]"
186 . 1 136 LEU C 1 137 HIS N 1 137 HIS CA 1 137 HIS C -145.00 -45.00 -88.36 -86.09 -87.70 . . 0 "[ . 1 . 2]"
187 . 1 137 HIS N 1 137 HIS CA 1 137 HIS C 1 138 VAL N 74.00 162.00 154.23 155.37 154.87 . . 0 "[ . 1 . 2]"
188 . 1 137 HIS C 1 138 VAL N 1 138 VAL CA 1 138 VAL C -160.10 -60.10 -91.67 -86.31 -94.12 . . 0 "[ . 1 . 2]"
189 . 1 138 VAL N 1 138 VAL CA 1 138 VAL C 1 139 HIS N 100.50 172.70 139.92 134.16 146.92 . . 0 "[ . 1 . 2]"
190 . 1 138 VAL C 1 139 HIS N 1 139 HIS CA 1 139 HIS C -169.80 -69.80 -142.13 -120.16 -130.09 . . 0 "[ . 1 . 2]"
191 . 1 139 HIS N 1 139 HIS CA 1 139 HIS C 1 140 LEU N 136.80 176.80 158.40 136.52 167.66 0.28 20 0 "[ . 1 . 2]"
192 . 1 139 HIS C 1 140 LEU N 1 140 LEU CA 1 140 LEU C -176.00 -76.00 -86.62 -80.77 -83.26 0.51 6 0 "[ . 1 . 2]"
193 . 1 140 LEU N 1 140 LEU CA 1 140 LEU C 1 141 GLN N 115.00 175.00 124.58 114.22 133.17 0.78 10 0 "[ . 1 . 2]"
194 . 1 140 LEU C 1 141 GLN N 1 141 GLN CA 1 141 GLN C -154.40 -94.00 -118.18 -125.22 -126.77 . . 0 "[ . 1 . 2]"
195 . 1 141 GLN N 1 141 GLN CA 1 141 GLN C 1 142 LEU N 111.00 169.00 147.19 150.79 144.44 . . 0 "[ . 1 . 2]"
196 . 1 141 GLN C 1 142 LEU N 1 142 LEU CA 1 142 LEU C -146.00 -50.00 -78.60 -94.11 -68.79 . . 0 "[ . 1 . 2]"
197 . 1 142 LEU N 1 142 LEU CA 1 142 LEU C 1 143 VAL N 97.00 153.00 143.76 151.13 150.81 . . 0 "[ . 1 . 2]"
198 . 1 142 LEU C 1 143 VAL N 1 143 VAL CA 1 143 VAL C -146.00 -62.00 -62.45 -66.43 -60.85 1.15 4 0 "[ . 1 . 2]"
199 . 1 143 VAL N 1 143 VAL CA 1 143 VAL C 1 144 ASP N 111.00 155.00 145.93 146.68 144.89 0.80 14 0 "[ . 1 . 2]"
200 . 1 143 VAL C 1 144 ASP N 1 144 ASP CA 1 144 ASP C -153.00 -57.00 -137.91 -149.82 -115.29 . . 0 "[ . 1 . 2]"
201 . 1 144 ASP N 1 144 ASP CA 1 144 ASP C 1 145 LYS N 76.00 176.00 97.40 94.61 92.08 . . 0 "[ . 1 . 2]"
202 . 1 144 ASP C 1 145 LYS N 1 145 LYS CA 1 145 LYS C -82.60 -42.60 -66.20 -70.48 -63.08 . . 0 "[ . 1 . 2]"
203 . 1 145 LYS N 1 145 LYS CA 1 145 LYS C 1 146 ARG N -41.80 -1.80 -20.64 -28.73 -18.27 . . 0 "[ . 1 . 2]"
204 . 1 147 HIS C 1 148 LEU N 1 148 LEU CA 1 148 LEU C -114.50 -14.50 -100.94 -91.06 -96.31 . . 0 "[ . 1 . 2]"
205 . 1 148 LEU N 1 148 LEU CA 1 148 LEU C 1 149 ASP N -70.00 3.00 4.46 3.74 5.45 2.45 18 0 "[ . 1 . 2]"
206 . 1 150 ARG C 1 151 LYS N 1 151 LYS CA 1 151 LYS C -75.00 -35.00 -68.62 -69.55 -69.71 . . 0 "[ . 1 . 2]"
207 . 1 151 LYS N 1 151 LYS CA 1 151 LYS C 1 152 GLU N -63.00 -23.00 -21.97 -22.24 -22.82 2.90 8 0 "[ . 1 . 2]"
208 . 1 151 LYS C 1 152 GLU N 1 152 GLU CA 1 152 GLU C -88.00 -46.00 -72.49 -69.20 -69.82 . . 0 "[ . 1 . 2]"
209 . 1 152 GLU N 1 152 GLU CA 1 152 GLU C 1 153 GLN N -38.00 2.00 -21.48 -21.89 -26.03 . . 0 "[ . 1 . 2]"
210 . 1 152 GLU C 1 153 GLN N 1 153 GLN CA 1 153 GLN C -125.00 -65.00 -96.67 -103.52 -89.49 . . 0 "[ . 1 . 2]"
211 . 1 153 GLN N 1 153 GLN CA 1 153 GLN C 1 154 ARG N -50.00 34.00 -0.37 -3.38 3.00 . . 0 "[ . 1 . 2]"
212 . 1 153 GLN C 1 154 ARG N 1 154 ARG CA 1 154 ARG C -174.00 -74.00 -99.18 -102.81 -109.34 . . 0 "[ . 1 . 2]"
213 . 1 154 ARG N 1 154 ARG CA 1 154 ARG C 1 155 TRP N 134.00 -178.00 133.53 131.41 137.53 2.59 11 0 "[ . 1 . 2]"
214 . 1 154 ARG C 1 155 TRP N 1 155 TRP CA 1 155 TRP C -175.00 -75.00 -120.78 -126.71 -116.73 . . 0 "[ . 1 . 2]"
215 . 1 155 TRP N 1 155 TRP CA 1 155 TRP C 1 156 ASP N 112.00 176.00 140.33 137.01 144.58 . . 0 "[ . 1 . 2]"
216 . 1 155 TRP C 1 156 ASP N 1 156 ASP CA 1 156 ASP C 178.10 -81.90 -118.31 -130.87 -110.27 . . 0 "[ . 1 . 2]"
217 . 1 156 ASP N 1 156 ASP CA 1 156 ASP C 1 157 PHE N 117.60 -176.60 152.96 148.63 147.61 . . 0 "[ . 1 . 2]"
218 . 1 156 ASP C 1 157 PHE N 1 157 PHE CA 1 157 PHE C -175.00 -75.00 -119.29 -128.57 -112.04 . . 0 "[ . 1 . 2]"
219 . 1 157 PHE N 1 157 PHE CA 1 157 PHE C 1 158 VAL N 106.10 168.30 139.95 137.57 136.31 . . 0 "[ . 1 . 2]"
220 . 1 157 PHE C 1 158 VAL N 1 158 VAL CA 1 158 VAL C -160.00 -94.00 -128.28 -125.81 -127.22 . . 0 "[ . 1 . 2]"
221 . 1 158 VAL N 1 158 VAL CA 1 158 VAL C 1 159 LEU N 101.00 157.00 144.49 143.30 145.49 . . 0 "[ . 1 . 2]"
222 . 1 158 VAL C 1 159 LEU N 1 159 LEU CA 1 159 LEU C -156.00 -56.00 -108.78 -109.58 -109.71 . . 0 "[ . 1 . 2]"
223 . 1 159 LEU N 1 159 LEU CA 1 159 LEU C 1 160 PRO N 68.00 168.00 153.04 154.58 153.76 . . 0 "[ . 1 . 2]"
224 . 1 159 LEU C 1 160 PRO N 1 160 PRO CA 1 160 PRO C -96.00 -36.40 -65.50 -58.98 -67.67 . . 0 "[ . 1 . 2]"
225 . 1 160 PRO N 1 160 PRO CA 1 160 PRO C 1 161 VAL N 129.40 169.40 147.13 139.98 151.13 . . 0 "[ . 1 . 2]"
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