NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
569317 |
3zfj   |
18943 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_3zfj
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 186
_TA_constraint_stats_list.Viol_count 597
_TA_constraint_stats_list.Viol_total 43264.38
_TA_constraint_stats_list.Viol_max 82.17
_TA_constraint_stats_list.Viol_rms 3.94
_TA_constraint_stats_list.Viol_average_all_restraints 0.58
_TA_constraint_stats_list.Viol_average_violations_only 3.62
_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 15 ASP C 1 16 GLY N 1 16 GLY CA 1 16 GLY C 51.30 115.50 102.94 85.92 79.96 1.34 8 0 "[ . 1 . 2]"
2 . 1 16 GLY N 1 16 GLY CA 1 16 GLY C 1 17 ASP N -23.10 48.90 -6.24 53.70 11.97 6.73 12 3 "[ - . 1*+ . 2]"
3 . 1 16 GLY C 1 17 ASP N 1 17 ASP CA 1 17 ASP C -119.80 -33.20 -89.25 -74.89 -94.06 1.50 3 0 "[ . 1 . 2]"
4 . 1 17 ASP N 1 17 ASP CA 1 17 ASP C 1 18 GLN N -84.30 29.70 -46.02 -35.99 -47.01 8.76 9 1 "[ . +1 . 2]"
5 . 1 17 ASP C 1 18 GLN N 1 18 GLN CA 1 18 GLN C -127.80 -25.60 -92.75 -87.80 -92.76 2.74 9 0 "[ . 1 . 2]"
6 . 1 18 GLN N 1 18 GLN CA 1 18 GLN C 1 19 ALA N -72.60 22.00 -31.12 11.87 -13.76 1.20 16 0 "[ . 1 . 2]"
7 . 1 25 ASN C 1 26 LEU N 1 26 LEU CA 1 26 LEU C -164.70 -60.30 -75.35 -77.52 -79.26 . . 0 "[ . 1 . 2]"
8 . 1 26 LEU N 1 26 LEU CA 1 26 LEU C 1 27 THR N 139.40 180.00 170.28 153.61 -176.98 3.02 1 0 "[ . 1 . 2]"
9 . 1 26 LEU C 1 27 THR N 1 27 THR CA 1 27 THR C -158.00 -24.20 -78.33 -73.80 -74.21 . . 0 "[ . 1 . 2]"
10 . 1 27 THR N 1 27 THR CA 1 27 THR C 1 28 PRO N 82.70 -148.70 150.57 144.26 160.86 . . 0 "[ . 1 . 2]"
11 . 1 27 THR C 1 28 PRO N 1 28 PRO CA 1 28 PRO C -75.70 -35.70 -51.55 -51.87 -54.36 . . 0 "[ . 1 . 2]"
12 . 1 28 PRO N 1 28 PRO CA 1 28 PRO C 1 29 ASP N -60.70 -6.10 -35.68 -47.04 -19.45 . . 0 "[ . 1 . 2]"
13 . 1 28 PRO C 1 29 ASP N 1 29 ASP CA 1 29 ASP C -82.00 -42.00 -71.66 -69.43 -70.85 0.84 5 0 "[ . 1 . 2]"
14 . 1 29 ASP N 1 29 ASP CA 1 29 ASP C 1 30 GLU N -59.80 -19.80 -46.86 -53.16 -29.04 . . 0 "[ . 1 . 2]"
15 . 1 29 ASP C 1 30 GLU N 1 30 GLU CA 1 30 GLU C -89.00 -49.00 -57.30 -74.96 -51.82 . . 0 "[ . 1 . 2]"
16 . 1 30 GLU N 1 30 GLU CA 1 30 GLU C 1 31 VAL N -60.30 -20.30 -36.89 -45.38 -26.86 . . 0 "[ . 1 . 2]"
17 . 1 30 GLU C 1 31 VAL N 1 31 VAL CA 1 31 VAL C -85.60 -45.60 -59.16 -54.96 -56.44 . . 0 "[ . 1 . 2]"
18 . 1 31 VAL N 1 31 VAL CA 1 31 VAL C 1 32 SER N -62.10 -22.10 -61.96 -64.51 -54.88 2.41 18 0 "[ . 1 . 2]"
19 . 1 31 VAL C 1 32 SER N 1 32 SER CA 1 32 SER C -82.70 -42.70 -64.72 -61.13 -63.24 . . 0 "[ . 1 . 2]"
20 . 1 32 SER N 1 32 SER CA 1 32 SER C 1 33 LYS N -61.10 -21.10 -47.86 -59.09 -60.72 1.29 1 0 "[ . 1 . 2]"
21 . 1 32 SER C 1 33 LYS N 1 33 LYS CA 1 33 LYS C -83.00 -43.00 -59.42 -48.43 -50.89 . . 0 "[ . 1 . 2]"
22 . 1 33 LYS N 1 33 LYS CA 1 33 LYS C 1 34 ARG N -63.20 -23.20 -34.95 -45.71 -25.96 . . 0 "[ . 1 . 2]"
23 . 1 33 LYS C 1 34 ARG N 1 34 ARG CA 1 34 ARG C -87.70 -47.50 -74.24 -85.71 -57.74 . . 0 "[ . 1 . 2]"
24 . 1 34 ARG N 1 34 ARG CA 1 34 ARG C 1 35 GLU N -57.00 -17.00 -39.33 -50.17 -55.26 . . 0 "[ . 1 . 2]"
25 . 1 34 ARG C 1 35 GLU N 1 35 GLU CA 1 35 GLU C -105.80 -54.60 -78.10 -79.28 -80.22 . . 0 "[ . 1 . 2]"
26 . 1 35 GLU N 1 35 GLU CA 1 35 GLU C 1 36 GLY N -85.50 31.50 -31.47 -22.62 -24.69 . . 0 "[ . 1 . 2]"
27 . 1 39 ALA C 1 40 GLU N 1 40 GLU CA 1 40 GLU C -167.70 -68.30 -67.70 -67.68 -67.86 1.71 20 0 "[ . 1 . 2]"
28 . 1 40 GLU N 1 40 GLU CA 1 40 GLU C 1 41 GLN N 120.40 169.40 134.88 125.08 144.04 . . 0 "[ . 1 . 2]"
29 . 1 41 GLN C 1 42 ILE N 1 42 ILE CA 1 42 ILE C -154.50 -34.70 -95.75 -92.53 -94.51 . . 0 "[ . 1 . 2]"
30 . 1 42 ILE N 1 42 ILE CA 1 42 ILE C 1 43 VAL N 99.20 145.40 99.30 101.55 100.04 1.26 13 0 "[ . 1 . 2]"
31 . 1 44 ILE C 1 45 LYS N 1 45 LYS CA 1 45 LYS C 175.70 -104.50 -135.09 -141.96 -123.63 . . 0 "[ . 1 . 2]"
32 . 1 45 LYS N 1 45 LYS CA 1 45 LYS C 1 46 ILE N 111.40 156.20 140.67 136.83 134.25 . . 0 "[ . 1 . 2]"
33 . 1 45 LYS C 1 46 ILE N 1 46 ILE CA 1 46 ILE C -163.30 -83.50 -126.33 -130.29 -120.71 . . 0 "[ . 1 . 2]"
34 . 1 46 ILE N 1 46 ILE CA 1 46 ILE C 1 47 THR N 103.30 163.10 139.84 141.56 136.98 . . 0 "[ . 1 . 2]"
35 . 1 46 ILE C 1 47 THR N 1 47 THR CA 1 47 THR C 175.40 -78.20 -139.79 -139.36 -140.54 . . 0 "[ . 1 . 2]"
36 . 1 47 THR N 1 47 THR CA 1 47 THR C 1 48 ASP N 145.70 -150.90 175.71 178.59 176.29 . . 0 "[ . 1 . 2]"
37 . 1 47 THR C 1 48 ASP N 1 48 ASP CA 1 48 ASP C -88.90 -39.90 -76.48 -74.01 -76.64 . . 0 "[ . 1 . 2]"
38 . 1 48 ASP N 1 48 ASP CA 1 48 ASP C 1 49 GLN N -55.10 5.50 -20.43 -44.23 6.39 0.89 12 0 "[ . 1 . 2]"
39 . 1 48 ASP C 1 49 GLN N 1 49 GLN CA 1 49 GLN C -123.00 -79.40 -89.95 -95.70 -97.45 1.24 14 0 "[ . 1 . 2]"
40 . 1 49 GLN N 1 49 GLN CA 1 49 GLN C 1 50 GLY N -26.90 24.70 -10.28 -28.96 19.84 2.06 7 0 "[ . 1 . 2]"
41 . 1 50 GLY C 1 51 TYR N 1 51 TYR CA 1 51 TYR C -173.50 -107.70 -141.46 -156.48 -107.19 0.51 5 0 "[ . 1 . 2]"
42 . 1 51 TYR N 1 51 TYR CA 1 51 TYR C 1 52 VAL N 138.60 178.60 171.68 171.37 167.10 0.78 13 0 "[ . 1 . 2]"
43 . 1 51 TYR C 1 52 VAL N 1 52 VAL CA 1 52 VAL C -139.90 -99.90 -125.46 -135.15 -104.59 . . 0 "[ . 1 . 2]"
44 . 1 52 VAL N 1 52 VAL CA 1 52 VAL C 1 53 THR N 110.50 177.50 126.77 120.39 136.62 . . 0 "[ . 1 . 2]"
45 . 1 52 VAL C 1 53 THR N 1 53 THR CA 1 53 THR C -157.20 -104.40 -107.42 -108.05 -109.84 0.76 14 0 "[ . 1 . 2]"
46 . 1 53 THR N 1 53 THR CA 1 53 THR C 1 54 SER N 136.10 178.70 142.30 134.80 155.87 1.30 8 0 "[ . 1 . 2]"
47 . 1 53 THR C 1 54 SER N 1 54 SER CA 1 54 SER C -149.70 -86.50 -99.86 -97.03 -98.46 . . 0 "[ . 1 . 2]"
48 . 1 54 SER N 1 54 SER CA 1 54 SER C 1 55 HIS N 91.30 148.90 90.30 90.49 90.24 2.40 13 0 "[ . 1 . 2]"
49 . 1 54 SER C 1 55 HIS N 1 55 HIS CA 1 55 HIS C -152.20 -88.00 -124.94 -129.60 -121.54 . . 0 "[ . 1 . 2]"
50 . 1 55 HIS N 1 55 HIS CA 1 55 HIS C 1 56 GLY N 104.70 162.70 151.98 152.48 151.83 . . 0 "[ . 1 . 2]"
51 . 1 56 GLY C 1 57 ASP N 1 57 ASP CA 1 57 ASP C -131.40 -55.40 -133.22 -132.77 -133.16 3.25 20 0 "[ . 1 . 2]"
52 . 1 57 ASP N 1 57 ASP CA 1 57 ASP C 1 58 HIS N -58.00 38.20 -11.18 -10.24 -11.57 . . 0 "[ . 1 . 2]"
53 . 1 58 HIS C 1 59 TYR N 1 59 TYR CA 1 59 TYR C -161.20 -95.40 -98.82 -98.52 -99.06 . . 0 "[ . 1 . 2]"
54 . 1 59 TYR N 1 59 TYR CA 1 59 TYR C 1 60 HIS N 131.60 178.60 129.44 129.04 128.81 3.59 18 0 "[ . 1 . 2]"
55 . 1 59 TYR C 1 60 HIS N 1 60 HIS CA 1 60 HIS C -178.90 -104.10 -126.25 -121.14 -122.98 . . 0 "[ . 1 . 2]"
56 . 1 60 HIS N 1 60 HIS CA 1 60 HIS C 1 61 TYR N 115.00 -176.40 126.43 120.27 136.47 . . 0 "[ . 1 . 2]"
57 . 1 60 HIS C 1 61 TYR N 1 61 TYR CA 1 61 TYR C -160.30 -88.10 -93.26 -96.96 -107.38 2.56 5 0 "[ . 1 . 2]"
58 . 1 61 TYR N 1 61 TYR CA 1 61 TYR C 1 62 TYR N 103.30 157.30 132.73 126.42 143.03 . . 0 "[ . 1 . 2]"
59 . 1 61 TYR C 1 62 TYR N 1 62 TYR CA 1 62 TYR C -176.70 -83.90 -133.55 -143.26 -155.92 . . 0 "[ . 1 . 2]"
60 . 1 62 TYR N 1 62 TYR CA 1 62 TYR C 1 63 ASN N 136.90 176.90 158.24 136.21 176.98 0.69 12 0 "[ . 1 . 2]"
61 . 1 65 LYS C 1 66 VAL N 1 66 VAL CA 1 66 VAL C -146.60 -36.00 -70.92 -83.50 -55.23 . . 0 "[ . 1 . 2]"
62 . 1 66 VAL N 1 66 VAL CA 1 66 VAL C 1 67 PRO N 110.50 151.90 129.27 130.97 130.17 . . 0 "[ . 1 . 2]"
63 . 1 66 VAL C 1 67 PRO N 1 67 PRO CA 1 67 PRO C -78.20 -38.20 -69.40 -68.68 -69.68 . . 0 "[ . 1 . 2]"
64 . 1 67 PRO N 1 67 PRO CA 1 67 PRO C 1 68 TYR N 124.60 164.60 156.38 147.65 162.48 . . 0 "[ . 1 . 2]"
65 . 1 67 PRO C 1 68 TYR N 1 68 TYR CA 1 68 TYR C -78.80 -38.80 -55.82 -57.68 -58.23 . . 0 "[ . 1 . 2]"
66 . 1 68 TYR N 1 68 TYR CA 1 68 TYR C 1 69 ASP N -53.70 -1.30 -40.55 -31.47 -35.94 . . 0 "[ . 1 . 2]"
67 . 1 68 TYR C 1 69 ASP N 1 69 ASP CA 1 69 ASP C -117.30 -77.30 -98.93 -111.00 -90.46 . . 0 "[ . 1 . 2]"
68 . 1 69 ASP N 1 69 ASP CA 1 69 ASP C 1 70 ALA N -27.80 19.20 16.33 6.11 20.04 0.84 9 0 "[ . 1 . 2]"
69 . 1 70 ALA C 1 71 ILE N 1 71 ILE CA 1 71 ILE C -133.10 -77.90 -104.32 -103.18 -104.17 . . 0 "[ . 1 . 2]"
70 . 1 71 ILE N 1 71 ILE CA 1 71 ILE C 1 72 ILE N 98.30 142.70 143.04 137.48 144.44 1.74 14 0 "[ . 1 . 2]"
71 . 1 71 ILE C 1 72 ILE N 1 72 ILE CA 1 72 ILE C -155.40 -73.80 -117.91 -114.99 -115.50 . . 0 "[ . 1 . 2]"
72 . 1 72 ILE N 1 72 ILE CA 1 72 ILE C 1 73 SER N 132.50 177.10 152.54 157.75 155.62 . . 0 "[ . 1 . 2]"
73 . 1 72 ILE C 1 73 SER N 1 73 SER CA 1 73 SER C -92.00 -52.00 -78.45 -90.50 -73.54 . . 0 "[ . 1 . 2]"
74 . 1 73 SER N 1 73 SER CA 1 73 SER C 1 74 GLU N 97.50 -172.10 144.09 154.32 148.20 . . 0 "[ . 1 . 2]"
75 . 1 73 SER C 1 74 GLU N 1 74 GLU CA 1 74 GLU C -82.70 -42.70 -63.34 -69.23 -59.74 . . 0 "[ . 1 . 2]"
76 . 1 74 GLU N 1 74 GLU CA 1 74 GLU C 1 75 GLU N -60.30 -0.50 -19.22 -29.24 -13.24 . . 0 "[ . 1 . 2]"
77 . 1 74 GLU C 1 75 GLU N 1 75 GLU CA 1 75 GLU C -93.30 -53.30 -65.26 -67.46 -68.08 . . 0 "[ . 1 . 2]"
78 . 1 75 GLU N 1 75 GLU CA 1 75 GLU C 1 76 LEU N -49.90 -9.90 -25.88 -37.09 -19.08 . . 0 "[ . 1 . 2]"
79 . 1 75 GLU C 1 76 LEU N 1 76 LEU CA 1 76 LEU C -134.80 -63.20 -98.02 -93.72 -94.88 . . 0 "[ . 1 . 2]"
80 . 1 76 LEU N 1 76 LEU CA 1 76 LEU C 1 77 LEU N -61.60 15.40 -5.08 -28.30 11.29 . . 0 "[ . 1 . 2]"
81 . 1 76 LEU C 1 77 LEU N 1 77 LEU CA 1 77 LEU C -114.60 -38.80 -61.33 -67.92 -52.67 . . 0 "[ . 1 . 2]"
82 . 1 77 LEU N 1 77 LEU CA 1 77 LEU C 1 78 MET N 116.40 176.80 142.44 131.69 156.89 . . 0 "[ . 1 . 2]"
83 . 1 77 LEU C 1 78 MET N 1 78 MET CA 1 78 MET C -111.70 -68.10 -92.20 -112.38 -66.60 1.50 5 0 "[ . 1 . 2]"
84 . 1 78 MET N 1 78 MET CA 1 78 MET C 1 79 LYS N 83.90 147.70 116.18 110.26 105.95 4.15 17 0 "[ . 1 . 2]"
85 . 1 78 MET C 1 79 LYS N 1 79 LYS CA 1 79 LYS C -135.10 -70.50 -109.41 -136.21 -65.46 5.04 17 1 "[ . 1 . + 2]"
86 . 1 79 LYS N 1 79 LYS CA 1 79 LYS C 1 80 ASP N 110.00 153.40 116.52 102.28 101.94 14.85 12 19 "[***********+**- ****]"
87 . 1 79 LYS C 1 80 ASP N 1 80 ASP CA 1 80 ASP C -117.50 -32.50 -102.09 -123.26 -123.30 8.68 12 18 "[**********-+**. ****]"
88 . 1 80 ASP N 1 80 ASP CA 1 80 ASP C 1 81 PRO N 90.10 160.90 136.14 109.98 144.82 . . 0 "[ . 1 . 2]"
89 . 1 80 ASP C 1 81 PRO N 1 81 PRO CA 1 81 PRO C -82.30 -40.70 -71.51 -74.62 -74.74 1.99 16 0 "[ . 1 . 2]"
90 . 1 81 PRO N 1 81 PRO CA 1 81 PRO C 1 82 ASN N -48.00 -4.60 -14.17 -14.52 -16.34 3.05 16 0 "[ . 1 . 2]"
91 . 1 81 PRO C 1 82 ASN N 1 82 ASN CA 1 82 ASN C -108.80 -68.80 -99.41 -106.01 -108.25 3.25 16 0 "[ . 1 . 2]"
92 . 1 82 ASN N 1 82 ASN CA 1 82 ASN C 1 83 TYR N -20.00 20.00 -17.29 -18.73 -19.55 3.94 12 0 "[ . 1 . 2]"
93 . 1 82 ASN C 1 83 TYR N 1 83 TYR CA 1 83 TYR C -135.50 -24.70 -87.82 -108.55 -62.80 . . 0 "[ . 1 . 2]"
94 . 1 83 TYR N 1 83 TYR CA 1 83 TYR C 1 84 GLN N 106.30 155.90 133.44 132.82 131.44 . . 0 "[ . 1 . 2]"
95 . 1 83 TYR C 1 84 GLN N 1 84 GLN CA 1 84 GLN C -149.10 -90.70 -119.62 -140.63 -97.96 . . 0 "[ . 1 . 2]"
96 . 1 84 GLN N 1 84 GLN CA 1 84 GLN C 1 85 LEU N 86.00 162.40 143.63 129.31 157.73 . . 0 "[ . 1 . 2]"
97 . 1 84 GLN C 1 85 LEU N 1 85 LEU CA 1 85 LEU C -130.30 -51.50 -55.50 -52.59 -53.48 0.27 3 0 "[ . 1 . 2]"
98 . 1 85 LEU N 1 85 LEU CA 1 85 LEU C 1 86 LYS N 105.30 153.50 113.50 104.58 131.90 0.72 4 0 "[ . 1 . 2]"
99 . 1 85 LEU C 1 86 LYS N 1 86 LYS CA 1 86 LYS C -126.10 -60.70 -99.94 -103.86 -109.00 0.26 7 0 "[ . 1 . 2]"
100 . 1 86 LYS N 1 86 LYS CA 1 86 LYS C 1 87 ASP N 108.50 -167.10 129.93 136.54 133.48 . . 0 "[ . 1 . 2]"
101 . 1 86 LYS C 1 87 ASP N 1 87 ASP CA 1 87 ASP C -77.60 -37.60 -62.96 -68.79 -56.16 . . 0 "[ . 1 . 2]"
102 . 1 87 ASP N 1 87 ASP CA 1 87 ASP C 1 88 SER N -57.00 -15.00 -20.82 -30.41 -14.54 0.46 1 0 "[ . 1 . 2]"
103 . 1 87 ASP C 1 88 SER N 1 88 SER CA 1 88 SER C -91.60 -50.20 -82.64 -87.63 -75.30 . . 0 "[ . 1 . 2]"
104 . 1 88 SER N 1 88 SER CA 1 88 SER C 1 89 ASP N -58.60 19.80 -22.43 -17.96 -20.02 . . 0 "[ . 1 . 2]"
105 . 1 88 SER C 1 89 ASP N 1 89 ASP CA 1 89 ASP C -116.50 -69.70 -95.96 -103.42 -107.74 . . 0 "[ . 1 . 2]"
106 . 1 89 ASP N 1 89 ASP CA 1 89 ASP C 1 90 ILE N -37.60 27.60 -19.96 -8.77 -15.67 . . 0 "[ . 1 . 2]"
107 . 1 89 ASP C 1 90 ILE N 1 90 ILE CA 1 90 ILE C -99.30 -44.70 -63.42 -71.75 -55.22 . . 0 "[ . 1 . 2]"
108 . 1 90 ILE N 1 90 ILE CA 1 90 ILE C 1 91 VAL N 75.60 159.00 115.31 104.24 126.30 . . 0 "[ . 1 . 2]"
109 . 1 90 ILE C 1 91 VAL N 1 91 VAL CA 1 91 VAL C -114.10 -67.10 -92.77 -97.37 -99.32 . . 0 "[ . 1 . 2]"
110 . 1 91 VAL N 1 91 VAL CA 1 91 VAL C 1 92 ASN N -63.40 -21.60 -36.13 -33.07 -34.94 . . 0 "[ . 1 . 2]"
111 . 1 91 VAL C 1 92 ASN N 1 92 ASN CA 1 92 ASN C 177.30 -140.50 -158.81 -169.13 -151.38 . . 0 "[ . 1 . 2]"
112 . 1 92 ASN N 1 92 ASN CA 1 92 ASN C 1 93 GLU N 119.10 -178.90 164.39 161.00 171.45 . . 0 "[ . 1 . 2]"
113 . 1 92 ASN C 1 93 GLU N 1 93 GLU CA 1 93 GLU C -160.50 -52.50 -119.72 -134.23 -104.95 . . 0 "[ . 1 . 2]"
114 . 1 93 GLU N 1 93 GLU CA 1 93 GLU C 1 94 ILE N 112.10 -179.70 136.07 116.81 160.02 . . 0 "[ . 1 . 2]"
115 . 1 93 GLU C 1 94 ILE N 1 94 ILE CA 1 94 ILE C -174.00 -77.20 -120.16 -106.16 -111.26 . . 0 "[ . 1 . 2]"
116 . 1 94 ILE N 1 94 ILE CA 1 94 ILE C 1 95 LYS N 141.30 -178.70 -176.62 -176.70 -176.97 3.04 5 0 "[ . 1 . 2]"
117 . 1 94 ILE C 1 95 LYS N 1 95 LYS CA 1 95 LYS C -74.60 -34.60 -71.90 -75.64 -67.61 1.04 15 0 "[ . 1 . 2]"
118 . 1 95 LYS N 1 95 LYS CA 1 95 LYS C 1 96 GLY N 114.90 154.90 114.12 113.24 113.04 2.75 18 0 "[ . 1 . 2]"
119 . 1 95 LYS C 1 96 GLY N 1 96 GLY CA 1 96 GLY C 75.20 115.20 81.25 82.88 82.16 1.75 19 0 "[ . 1 . 2]"
120 . 1 96 GLY N 1 96 GLY CA 1 96 GLY C 1 97 GLY N -36.20 3.80 -34.31 -34.84 -35.28 2.11 19 0 "[ . 1 . 2]"
121 . 1 96 GLY C 1 97 GLY N 1 97 GLY CA 1 97 GLY C -114.90 -47.70 -115.47 -117.36 -109.60 2.46 4 0 "[ . 1 . 2]"
122 . 1 97 GLY N 1 97 GLY CA 1 97 GLY C 1 98 TYR N 88.50 -155.30 172.60 172.05 171.60 . . 0 "[ . 1 . 2]"
123 . 1 97 GLY C 1 98 TYR N 1 98 TYR CA 1 98 TYR C -158.30 -103.10 -124.77 -136.54 -115.32 . . 0 "[ . 1 . 2]"
124 . 1 98 TYR N 1 98 TYR CA 1 98 TYR C 1 99 VAL N 122.60 167.00 122.06 120.47 131.34 2.13 2 0 "[ . 1 . 2]"
125 . 1 98 TYR C 1 99 VAL N 1 99 VAL CA 1 99 VAL C -120.00 -63.20 -78.39 -82.37 -75.78 . . 0 "[ . 1 . 2]"
126 . 1 99 VAL N 1 99 VAL CA 1 99 VAL C 1 100 ILE N 113.70 156.90 110.56 111.34 111.16 4.16 10 0 "[ . 1 . 2]"
127 . 1 99 VAL C 1 100 ILE N 1 100 ILE CA 1 100 ILE C -152.70 -112.30 -127.51 -127.77 -128.58 . . 0 "[ . 1 . 2]"
128 . 1 100 ILE N 1 100 ILE CA 1 100 ILE C 1 101 LYS N 139.80 179.80 150.27 142.15 158.15 . . 0 "[ . 1 . 2]"
129 . 1 100 ILE C 1 101 LYS N 1 101 LYS CA 1 101 LYS C -145.30 -98.50 -114.98 -111.10 -114.79 . . 0 "[ . 1 . 2]"
130 . 1 101 LYS N 1 101 LYS CA 1 101 LYS C 1 102 VAL N 106.60 146.60 103.86 102.89 105.03 3.71 2 0 "[ . 1 . 2]"
131 . 1 101 LYS C 1 102 VAL N 1 102 VAL CA 1 102 VAL C -159.30 -108.30 -120.23 -122.37 -122.94 . . 0 "[ . 1 . 2]"
132 . 1 102 VAL N 1 102 VAL CA 1 102 VAL C 1 103 ASP N 105.50 146.50 135.18 130.00 139.51 . . 0 "[ . 1 . 2]"
133 . 1 102 VAL C 1 103 ASP N 1 103 ASP CA 1 103 ASP C 33.20 73.20 58.68 54.94 62.94 . . 0 "[ . 1 . 2]"
134 . 1 103 ASP N 1 103 ASP CA 1 103 ASP C 1 104 GLY N 22.40 62.40 28.94 24.94 24.19 0.31 15 0 "[ . 1 . 2]"
135 . 1 103 ASP C 1 104 GLY N 1 104 GLY CA 1 104 GLY C 57.50 97.50 86.75 84.83 82.55 0.69 13 0 "[ . 1 . 2]"
136 . 1 104 GLY N 1 104 GLY CA 1 104 GLY C 1 105 LYS N -21.50 29.10 -4.06 -23.40 14.38 1.90 18 0 "[ . 1 . 2]"
137 . 1 104 GLY C 1 105 LYS N 1 105 LYS CA 1 105 LYS C -140.70 -80.50 -116.03 -116.06 -121.02 . . 0 "[ . 1 . 2]"
138 . 1 105 LYS N 1 105 LYS CA 1 105 LYS C 1 106 TYR N 116.30 178.90 159.11 148.64 172.13 . . 0 "[ . 1 . 2]"
139 . 1 105 LYS C 1 106 TYR N 1 106 TYR CA 1 106 TYR C -137.10 -67.50 -104.82 -108.89 -111.04 . . 0 "[ . 1 . 2]"
140 . 1 106 TYR N 1 106 TYR CA 1 106 TYR C 1 107 TYR N 116.10 171.90 135.89 135.04 134.96 . . 0 "[ . 1 . 2]"
141 . 1 106 TYR C 1 107 TYR N 1 107 TYR CA 1 107 TYR C -162.10 -101.90 -139.64 -139.10 -139.48 . . 0 "[ . 1 . 2]"
142 . 1 107 TYR N 1 107 TYR CA 1 107 TYR C 1 108 VAL N 137.80 -177.40 173.44 167.71 -178.88 . . 0 "[ . 1 . 2]"
143 . 1 107 TYR C 1 108 VAL N 1 108 VAL CA 1 108 VAL C -161.10 -102.70 -126.37 -137.73 -119.11 . . 0 "[ . 1 . 2]"
144 . 1 108 VAL N 1 108 VAL CA 1 108 VAL C 1 109 TYR N 97.90 157.50 109.95 100.82 120.32 . . 0 "[ . 1 . 2]"
145 . 1 108 VAL C 1 109 TYR N 1 109 TYR CA 1 109 TYR C -159.30 -81.70 -79.54 -76.60 -77.72 5.33 2 2 "[ + . 1 .- 2]"
146 . 1 109 TYR N 1 109 TYR CA 1 109 TYR C 1 110 LEU N 103.30 153.50 108.79 102.36 139.00 0.94 12 0 "[ . 1 . 2]"
147 . 1 109 TYR C 1 110 LEU N 1 110 LEU CA 1 110 LEU C -121.60 -51.00 -95.60 -124.16 -88.35 2.56 4 0 "[ . 1 . 2]"
148 . 1 110 LEU N 1 110 LEU CA 1 110 LEU C 1 111 LYS N 93.00 -171.80 126.56 121.51 119.78 . . 0 "[ . 1 . 2]"
149 . 1 110 LEU C 1 111 LYS N 1 111 LYS CA 1 111 LYS C -124.10 -45.70 -80.75 -89.25 -74.78 . . 0 "[ . 1 . 2]"
150 . 1 111 LYS N 1 111 LYS CA 1 111 LYS C 1 112 ASP N -56.00 10.40 -18.26 -17.19 -18.68 . . 0 "[ . 1 . 2]"
151 . 1 111 LYS C 1 112 ASP N 1 112 ASP CA 1 112 ASP C -175.60 -42.80 -137.77 -156.65 -127.83 . . 0 "[ . 1 . 2]"
152 . 1 112 ASP N 1 112 ASP CA 1 112 ASP C 1 113 ALA N 54.70 176.90 81.86 57.46 102.67 . . 0 "[ . 1 . 2]"
153 . 1 112 ASP C 1 113 ALA N 1 113 ALA CA 1 113 ALA C -80.00 -40.00 -76.03 -75.82 -78.13 0.78 8 0 "[ . 1 . 2]"
154 . 1 113 ALA N 1 113 ALA CA 1 113 ALA C 1 114 ALA N -47.40 -7.40 -12.72 -28.74 -6.06 1.34 11 0 "[ . 1 . 2]"
155 . 1 113 ALA C 1 114 ALA N 1 114 ALA CA 1 114 ALA C -95.30 -43.30 -83.47 -84.60 -86.85 0.30 4 0 "[ . 1 . 2]"
156 . 1 114 ALA N 1 114 ALA CA 1 114 ALA C 1 115 HIS N -44.80 14.00 -38.58 -34.73 -39.90 1.88 9 0 "[ . 1 . 2]"
157 . 1 114 ALA C 1 115 HIS N 1 115 HIS CA 1 115 HIS C -122.20 -82.20 -104.93 -120.09 -81.38 0.82 14 0 "[ . 1 . 2]"
158 . 1 115 HIS N 1 115 HIS CA 1 115 HIS C 1 116 ALA N -22.10 35.50 7.94 15.35 13.65 . . 0 "[ . 1 . 2]"
159 . 1 116 ALA C 1 117 ASP N 1 117 ASP CA 1 117 ASP C -127.00 -73.00 -113.23 -128.00 -89.00 1.00 13 0 "[ . 1 . 2]"
160 . 1 117 ASP N 1 117 ASP CA 1 117 ASP C 1 118 ASN N -62.50 60.10 61.98 20.09 68.12 8.02 20 5 "[* . - *1 . *+]"
161 . 1 117 ASP C 1 118 ASN N 1 118 ASN CA 1 118 ASN C 40.20 80.20 81.66 56.45 87.55 7.35 7 3 "[ . + *1 . -2]"
162 . 1 118 ASN N 1 118 ASN CA 1 118 ASN C 1 119 ILE N 4.50 87.50 24.20 3.77 56.35 0.73 6 0 "[ . 1 . 2]"
163 . 1 118 ASN C 1 119 ILE N 1 119 ILE CA 1 119 ILE C -155.20 -77.20 -106.25 -113.86 -120.83 . . 0 "[ . 1 . 2]"
164 . 1 119 ILE N 1 119 ILE CA 1 119 ILE C 1 120 ARG N 115.60 -168.60 121.30 124.76 122.14 . . 0 "[ . 1 . 2]"
165 . 1 119 ILE C 1 120 ARG N 1 120 ARG CA 1 120 ARG C -161.30 -94.30 -102.74 -108.84 -94.15 0.15 12 0 "[ . 1 . 2]"
166 . 1 120 ARG N 1 120 ARG CA 1 120 ARG C 1 121 THR N 123.30 -177.90 124.91 120.96 136.61 2.34 2 0 "[ . 1 . 2]"
167 . 1 120 ARG C 1 121 THR N 1 121 THR CA 1 121 THR C -105.10 -65.10 -66.43 -74.02 -63.64 1.46 14 0 "[ . 1 . 2]"
168 . 1 121 THR N 1 121 THR CA 1 121 THR C 1 122 LYS N 148.30 -171.70 158.27 149.59 164.01 . . 0 "[ . 1 . 2]"
169 . 1 121 THR C 1 122 LYS N 1 122 LYS CA 1 122 LYS C -77.90 -37.90 -56.67 -56.04 -56.95 . . 0 "[ . 1 . 2]"
170 . 1 122 LYS N 1 122 LYS CA 1 122 LYS C 1 123 GLU N -57.30 -17.30 -31.99 -32.76 -34.76 . . 0 "[ . 1 . 2]"
171 . 1 122 LYS C 1 123 GLU N 1 123 GLU CA 1 123 GLU C -85.70 -45.70 -69.46 -85.64 -58.05 . . 0 "[ . 1 . 2]"
172 . 1 123 GLU N 1 123 GLU CA 1 123 GLU C 1 124 GLU N -57.70 -17.70 -43.43 -54.28 -18.07 . . 0 "[ . 1 . 2]"
173 . 1 123 GLU C 1 124 GLU N 1 124 GLU CA 1 124 GLU C -107.80 -44.20 -74.49 -91.27 -65.62 . . 0 "[ . 1 . 2]"
174 . 1 124 GLU N 1 124 GLU CA 1 124 GLU C 1 125 ILE N -59.50 -15.90 -31.96 -40.06 -17.11 . . 0 "[ . 1 . 2]"
175 . 1 124 GLU C 1 125 ILE N 1 125 ILE CA 1 125 ILE C -81.80 -41.80 -54.74 -59.48 -50.50 . . 0 "[ . 1 . 2]"
176 . 1 125 ILE N 1 125 ILE CA 1 125 ILE C 1 126 LYS N -64.70 -24.70 -45.64 -40.98 -43.10 . . 0 "[ . 1 . 2]"
177 . 1 125 ILE C 1 126 LYS N 1 126 LYS CA 1 126 LYS C -80.50 -40.50 -68.06 -74.51 -55.19 . . 0 "[ . 1 . 2]"
178 . 1 126 LYS N 1 126 LYS CA 1 126 LYS C 1 127 ARG N -61.70 -21.70 -29.62 -23.73 -25.50 . . 0 "[ . 1 . 2]"
179 . 1 126 LYS C 1 127 ARG N 1 127 ARG CA 1 127 ARG C -83.90 -43.90 -70.17 -78.43 -79.64 . . 0 "[ . 1 . 2]"
180 . 1 127 ARG N 1 127 ARG CA 1 127 ARG C 1 128 GLN N -60.60 -20.60 -43.35 -58.11 -31.68 . . 0 "[ . 1 . 2]"
181 . 1 127 ARG C 1 128 GLN N 1 128 GLN CA 1 128 GLN C -84.50 -44.50 -72.51 -71.94 -73.44 0.47 19 0 "[ . 1 . 2]"
182 . 1 128 GLN N 1 128 GLN CA 1 128 GLN C 1 129 LYS N -57.70 -3.10 -21.60 -36.57 -9.16 . . 0 "[ . 1 . 2]"
183 . 1 128 GLN C 1 129 LYS N 1 129 LYS CA 1 129 LYS C -92.10 -52.10 -85.92 -87.01 -89.17 0.90 7 0 "[ . 1 . 2]"
184 . 1 129 LYS N 1 129 LYS CA 1 129 LYS C 1 130 GLN N -52.90 -1.50 -5.48 -36.33 0.57 2.07 13 0 "[ . 1 . 2]"
185 . 1 129 LYS C 1 130 GLN N 1 130 GLN CA 1 130 GLN C -133.20 -68.00 -87.00 -80.11 -81.92 . . 0 "[ . 1 . 2]"
186 . 1 130 GLN N 1 130 GLN CA 1 130 GLN C 1 131 GLU N -34.90 28.50 -70.00 -106.06 110.67 82.17 13 19 "[****** ****-+*******]"
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