NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
616636 |
5sxy   |
30153 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_5sxy
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 214
_TA_constraint_stats_list.Viol_count 170
_TA_constraint_stats_list.Viol_total 2427.53
_TA_constraint_stats_list.Viol_max 2.01
_TA_constraint_stats_list.Viol_rms 0.17
_TA_constraint_stats_list.Viol_average_all_restraints 0.03
_TA_constraint_stats_list.Viol_average_violations_only 0.71
_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 SER N 1 7 SER CA 1 7 SER C -133.30 -73.30 -97.78 -93.32 -93.65 0.38 6 0 "[ . 1 . 2]"
2 . 1 7 SER C 1 8 GLY N 1 8 GLY CA 1 8 GLY C -87.50 -27.50 -68.38 -87.00 -63.06 . . 0 "[ . 1 . 2]"
3 . 1 10 ASP C 1 11 VAL N 1 11 VAL CA 1 11 VAL C -130.90 -70.90 -124.06 -131.36 -94.57 0.46 14 0 "[ . 1 . 2]"
4 . 1 11 VAL C 1 12 PRO N 1 12 PRO CA 1 12 PRO C -104.10 -44.10 -75.73 -78.11 -78.82 . . 0 "[ . 1 . 2]"
5 . 1 12 PRO C 1 13 ARG N 1 13 ARG CA 1 13 ARG C -159.10 -99.10 -156.10 -158.40 -149.57 . . 0 "[ . 1 . 2]"
6 . 1 13 ARG C 1 14 LEU N 1 14 LEU CA 1 14 LEU C -120.50 -60.50 -68.61 -70.09 -70.62 . . 0 "[ . 1 . 2]"
7 . 1 14 LEU C 1 15 PRO N 1 15 PRO CA 1 15 PRO C -96.60 -36.60 -75.69 -79.50 -60.77 . . 0 "[ . 1 . 2]"
8 . 1 15 PRO C 1 16 ARG N 1 16 ARG CA 1 16 ARG C -89.50 -29.50 -55.63 -59.28 -51.96 . . 0 "[ . 1 . 2]"
9 . 1 16 ARG C 1 17 GLY N 1 17 GLY CA 1 17 GLY C 57.00 117.00 85.05 81.70 80.55 . . 0 "[ . 1 . 2]"
10 . 1 18 VAL C 1 19 ARG N 1 19 ARG CA 1 19 ARG C -155.40 -95.40 -138.71 -145.15 -134.30 . . 0 "[ . 1 . 2]"
11 . 1 19 ARG C 1 20 LEU N 1 20 LEU CA 1 20 LEU C -133.80 -73.80 -94.43 -98.81 -90.75 . . 0 "[ . 1 . 2]"
12 . 1 20 LEU C 1 21 ARG N 1 21 ARG CA 1 21 ARG C -149.00 -89.00 -116.03 -98.46 -135.46 . . 0 "[ . 1 . 2]"
13 . 1 21 ARG C 1 22 PHE N 1 22 PHE CA 1 22 PHE C -132.70 -72.70 -100.62 -105.00 -106.81 . . 0 "[ . 1 . 2]"
14 . 1 23 ASP C 1 24 GLU N 1 24 GLU CA 1 24 GLU C -92.70 -32.70 -62.74 -62.65 -63.38 . . 0 "[ . 1 . 2]"
15 . 1 24 GLU C 1 25 VAL N 1 25 VAL CA 1 25 VAL C -108.70 -48.70 -63.20 -65.55 -60.63 . . 0 "[ . 1 . 2]"
16 . 1 25 VAL C 1 26 ARG N 1 26 ARG CA 1 26 ARG C -123.70 -63.70 -87.49 -90.90 -92.10 . . 0 "[ . 1 . 2]"
17 . 1 26 ARG C 1 27 ASN N 1 27 ASN CA 1 27 ASN C 33.00 93.00 63.64 55.42 54.86 . . 0 "[ . 1 . 2]"
18 . 1 27 ASN C 1 28 LYS N 1 28 LYS CA 1 28 LYS C -144.40 -84.40 -145.03 -145.34 -144.45 0.94 8 0 "[ . 1 . 2]"
19 . 1 28 LYS C 1 29 HIS N 1 29 HIS CA 1 29 HIS C -120.90 -60.90 -91.28 -90.78 -92.49 . . 0 "[ . 1 . 2]"
20 . 1 29 HIS C 1 30 VAL N 1 30 VAL CA 1 30 VAL C -171.50 -111.50 -139.05 -142.45 -136.60 . . 0 "[ . 1 . 2]"
21 . 1 30 VAL C 1 31 LEU N 1 31 LEU CA 1 31 LEU C -152.20 -92.20 -101.41 -109.48 -97.23 . . 0 "[ . 1 . 2]"
22 . 1 31 LEU C 1 32 LEU N 1 32 LEU CA 1 32 LEU C -135.20 -75.20 -78.38 -81.29 -75.32 . . 0 "[ . 1 . 2]"
23 . 1 32 LEU C 1 33 ALA N 1 33 ALA CA 1 33 ALA C -120.60 -60.60 -95.85 -96.05 -96.52 . . 0 "[ . 1 . 2]"
24 . 1 33 ALA C 1 34 PRO N 1 34 PRO CA 1 34 PRO C -85.70 -25.70 -49.04 -63.70 -43.37 . . 0 "[ . 1 . 2]"
25 . 1 34 PRO C 1 35 GLU N 1 35 GLU CA 1 35 GLU C -108.90 -48.90 -74.48 -80.85 -71.17 . . 0 "[ . 1 . 2]"
26 . 1 37 THR C 1 38 PHE N 1 38 PHE CA 1 38 PHE C -125.80 -65.80 -107.58 -109.24 -125.92 0.40 13 0 "[ . 1 . 2]"
27 . 1 38 PHE C 1 39 ASP N 1 39 ASP CA 1 39 ASP C -105.90 -45.90 -72.88 -74.88 -70.90 . . 0 "[ . 1 . 2]"
28 . 1 39 ASP C 1 40 LEU N 1 40 LEU CA 1 40 LEU C -154.20 -94.20 -133.23 -133.67 -134.23 . . 0 "[ . 1 . 2]"
29 . 1 40 LEU C 1 41 ASP N 1 41 ASP CA 1 41 ASP C -111.00 -51.00 -85.23 -82.90 -83.72 . . 0 "[ . 1 . 2]"
30 . 1 41 ASP C 1 42 ASP N 1 42 ASP CA 1 42 ASP C -89.90 -29.90 -59.97 -60.28 -60.59 . . 0 "[ . 1 . 2]"
31 . 1 42 ASP C 1 43 ASN N 1 43 ASN CA 1 43 ASN C -98.40 -38.40 -63.80 -66.72 -62.38 . . 0 "[ . 1 . 2]"
32 . 1 43 ASN C 1 44 ALA N 1 44 ALA CA 1 44 ALA C -94.70 -34.70 -69.37 -68.71 -68.75 . . 0 "[ . 1 . 2]"
33 . 1 44 ALA C 1 45 VAL N 1 45 VAL CA 1 45 VAL C -92.60 -32.60 -80.84 -80.42 -86.53 . . 0 "[ . 1 . 2]"
34 . 1 45 VAL C 1 46 ALA N 1 46 ALA CA 1 46 ALA C -90.10 -30.10 -55.78 -55.17 -55.72 . . 0 "[ . 1 . 2]"
35 . 1 46 ALA C 1 47 VAL N 1 47 VAL CA 1 47 VAL C -98.20 -38.20 -60.93 -61.78 -62.39 . . 0 "[ . 1 . 2]"
36 . 1 47 VAL C 1 48 LEU N 1 48 LEU CA 1 48 LEU C -94.20 -34.20 -72.65 -77.61 -68.90 . . 0 "[ . 1 . 2]"
37 . 1 48 LEU C 1 49 LYS N 1 49 LYS CA 1 49 LYS C -95.90 -35.90 -87.23 -92.40 -82.07 . . 0 "[ . 1 . 2]"
38 . 1 49 LYS C 1 50 LEU N 1 50 LEU CA 1 50 LEU C -127.10 -67.10 -71.23 -73.10 -69.29 . . 0 "[ . 1 . 2]"
39 . 1 50 LEU C 1 51 VAL N 1 51 VAL CA 1 51 VAL C -113.50 -53.50 -74.96 -72.51 -73.18 . . 0 "[ . 1 . 2]"
40 . 1 53 GLY C 1 54 ARG N 1 54 ARG CA 1 54 ARG C -114.40 -54.40 -114.32 -114.80 -114.83 0.62 19 0 "[ . 1 . 2]"
41 . 1 54 ARG C 1 55 ASN N 1 55 ASN CA 1 55 ASN C -115.90 -55.90 -117.19 -117.24 -117.27 1.70 5 0 "[ . 1 . 2]"
42 . 1 55 ASN C 1 56 THR N 1 56 THR CA 1 56 THR C -119.60 -59.60 -79.59 -82.59 -74.69 . . 0 "[ . 1 . 2]"
43 . 1 56 THR C 1 57 VAL N 1 57 VAL CA 1 57 VAL C -91.60 -31.60 -54.18 -59.21 -47.31 . . 0 "[ . 1 . 2]"
44 . 1 57 VAL C 1 58 SER N 1 58 SER CA 1 58 SER C -91.60 -31.60 -58.46 -57.68 -57.71 . . 0 "[ . 1 . 2]"
45 . 1 58 SER C 1 59 GLN N 1 59 GLN CA 1 59 GLN C -94.80 -34.80 -65.07 -66.52 -63.84 . . 0 "[ . 1 . 2]"
46 . 1 59 GLN C 1 60 ILE N 1 60 ILE CA 1 60 ILE C -94.90 -34.90 -61.20 -62.12 -59.63 . . 0 "[ . 1 . 2]"
47 . 1 60 ILE C 1 61 ALA N 1 61 ALA CA 1 61 ALA C -90.30 -30.30 -53.00 -55.36 -50.70 . . 0 "[ . 1 . 2]"
48 . 1 61 ALA C 1 62 GLN N 1 62 GLN CA 1 62 GLN C -94.40 -34.40 -63.65 -64.53 -62.96 . . 0 "[ . 1 . 2]"
49 . 1 62 GLN C 1 63 ILE N 1 63 ILE CA 1 63 ILE C -96.60 -36.60 -65.08 -66.75 -63.64 . . 0 "[ . 1 . 2]"
50 . 1 63 ILE C 1 64 LEU N 1 64 LEU CA 1 64 LEU C -92.20 -32.20 -68.74 -70.31 -66.77 . . 0 "[ . 1 . 2]"
51 . 1 64 LEU C 1 65 GLY N 1 65 GLY CA 1 65 GLY C -94.00 -34.00 -56.94 -58.65 -58.87 . . 0 "[ . 1 . 2]"
52 . 1 65 GLY C 1 66 GLN N 1 66 GLN CA 1 66 GLN C -97.10 -37.10 -65.76 -65.85 -66.03 . . 0 "[ . 1 . 2]"
53 . 1 66 GLN C 1 67 THR N 1 67 THR CA 1 67 THR C -97.80 -37.80 -62.44 -62.27 -62.33 . . 0 "[ . 1 . 2]"
54 . 1 67 THR C 1 68 TYR N 1 68 TYR CA 1 68 TYR C -124.50 -64.50 -93.12 -93.92 -94.48 . . 0 "[ . 1 . 2]"
55 . 1 68 TYR C 1 69 ASP N 1 69 ASP CA 1 69 ASP C 35.40 95.40 52.45 47.97 54.79 . . 0 "[ . 1 . 2]"
56 . 1 69 ASP C 1 70 ALA N 1 70 ALA CA 1 70 ALA C -148.10 -88.10 -141.47 -145.59 -137.26 . . 0 "[ . 1 . 2]"
57 . 1 70 ALA C 1 71 ASP N 1 71 ASP CA 1 71 ASP C -116.00 -56.00 -55.92 -56.77 -55.37 0.63 9 0 "[ . 1 . 2]"
58 . 1 71 ASP C 1 72 PRO N 1 72 PRO CA 1 72 PRO C -85.30 -25.30 -56.30 -48.52 -48.56 . . 0 "[ . 1 . 2]"
59 . 1 72 PRO C 1 73 ALA N 1 73 ALA CA 1 73 ALA C -94.20 -34.20 -53.30 -55.34 -50.68 . . 0 "[ . 1 . 2]"
60 . 1 73 ALA C 1 74 ILE N 1 74 ILE CA 1 74 ILE C -101.70 -41.70 -71.27 -80.24 -66.70 . . 0 "[ . 1 . 2]"
61 . 1 74 ILE C 1 75 ILE N 1 75 ILE CA 1 75 ILE C -92.10 -32.10 -60.50 -61.01 -61.35 . . 0 "[ . 1 . 2]"
62 . 1 75 ILE C 1 76 GLU N 1 76 GLU CA 1 76 GLU C -95.70 -35.70 -61.69 -63.08 -65.00 . . 0 "[ . 1 . 2]"
63 . 1 76 GLU C 1 77 ALA N 1 77 ALA CA 1 77 ALA C -90.30 -30.30 -64.55 -67.90 -55.34 . . 0 "[ . 1 . 2]"
64 . 1 77 ALA C 1 78 ASP N 1 78 ASP CA 1 78 ASP C -97.10 -37.10 -79.68 -80.97 -78.17 . . 0 "[ . 1 . 2]"
65 . 1 78 ASP C 1 79 ILE N 1 79 ILE CA 1 79 ILE C -99.00 -39.00 -75.72 -80.51 -71.08 . . 0 "[ . 1 . 2]"
66 . 1 79 ILE C 1 80 LEU N 1 80 LEU CA 1 80 LEU C -79.60 -19.60 -44.14 -48.56 -40.64 . . 0 "[ . 1 . 2]"
67 . 1 80 LEU C 1 81 PRO N 1 81 PRO CA 1 81 PRO C -87.40 -27.40 -53.98 -60.43 -61.39 . . 0 "[ . 1 . 2]"
68 . 1 81 PRO C 1 82 MET N 1 82 MET CA 1 82 MET C -92.80 -32.80 -66.08 -65.45 -65.61 . . 0 "[ . 1 . 2]"
69 . 1 82 MET C 1 83 LEU N 1 83 LEU CA 1 83 LEU C -95.20 -35.20 -62.32 -63.55 -61.19 . . 0 "[ . 1 . 2]"
70 . 1 83 LEU C 1 84 ALA N 1 84 ALA CA 1 84 ALA C -92.30 -32.30 -62.64 -61.22 -61.70 . . 0 "[ . 1 . 2]"
71 . 1 84 ALA C 1 85 GLY N 1 85 GLY CA 1 85 GLY C -95.20 -35.20 -65.55 -70.56 -61.80 . . 0 "[ . 1 . 2]"
72 . 1 85 GLY C 1 86 LEU N 1 86 LEU CA 1 86 LEU C -95.50 -35.50 -67.68 -70.69 -66.34 . . 0 "[ . 1 . 2]"
73 . 1 86 LEU C 1 87 ALA N 1 87 ALA CA 1 87 ALA C -98.00 -38.00 -53.81 -54.97 -55.82 . . 0 "[ . 1 . 2]"
74 . 1 87 ALA C 1 88 GLN N 1 88 GLN CA 1 88 GLN C -94.70 -34.70 -62.16 -64.14 -56.21 . . 0 "[ . 1 . 2]"
75 . 1 88 GLN C 1 89 LYS N 1 89 LYS CA 1 89 LYS C -124.50 -64.50 -93.25 -91.34 -91.73 . . 0 "[ . 1 . 2]"
76 . 1 89 LYS C 1 90 ARG N 1 90 ARG CA 1 90 ARG C 29.20 89.20 60.88 62.35 62.25 . . 0 "[ . 1 . 2]"
77 . 1 90 ARG C 1 91 VAL N 1 91 VAL CA 1 91 VAL C -141.70 -81.70 -129.15 -133.09 -136.70 0.11 1 0 "[ . 1 . 2]"
78 . 1 91 VAL C 1 92 LEU N 1 92 LEU CA 1 92 LEU C -160.50 -100.50 -124.13 -113.95 -122.18 . . 0 "[ . 1 . 2]"
79 . 1 92 LEU C 1 93 GLU N 1 93 GLU CA 1 93 GLU C -160.90 -100.90 -146.89 -149.31 -150.77 . . 0 "[ . 1 . 2]"
80 . 1 7 SER N 1 7 SER CA 1 7 SER C 1 8 GLY N 141.40 -158.60 -177.74 175.01 -161.76 . . 0 "[ . 1 . 2]"
81 . 1 8 GLY N 1 8 GLY CA 1 8 GLY C 1 9 SER N -74.60 -14.60 -35.06 -35.49 -37.47 . . 0 "[ . 1 . 2]"
82 . 1 11 VAL N 1 11 VAL CA 1 11 VAL C 1 12 PRO N 103.50 163.50 121.66 128.29 127.44 0.67 4 0 "[ . 1 . 2]"
83 . 1 12 PRO N 1 12 PRO CA 1 12 PRO C 1 13 ARG N 125.20 -174.80 149.66 143.31 157.58 . . 0 "[ . 1 . 2]"
84 . 1 13 ARG N 1 13 ARG CA 1 13 ARG C 1 14 LEU N 121.30 -178.70 129.33 121.51 144.07 . . 0 "[ . 1 . 2]"
85 . 1 14 LEU N 1 14 LEU CA 1 14 LEU C 1 15 PRO N 101.10 161.10 120.84 113.58 131.59 . . 0 "[ . 1 . 2]"
86 . 1 15 PRO N 1 15 PRO CA 1 15 PRO C 1 16 ARG N 115.90 175.90 159.87 157.40 155.90 . . 0 "[ . 1 . 2]"
87 . 1 16 ARG N 1 16 ARG CA 1 16 ARG C 1 17 GLY N 105.90 165.90 147.50 132.45 154.30 . . 0 "[ . 1 . 2]"
88 . 1 17 GLY N 1 17 GLY CA 1 17 GLY C 1 18 VAL N -33.20 26.80 9.20 -14.83 18.69 . . 0 "[ . 1 . 2]"
89 . 1 19 ARG N 1 19 ARG CA 1 19 ARG C 1 20 LEU N 120.30 -179.70 157.01 155.86 155.78 . . 0 "[ . 1 . 2]"
90 . 1 20 LEU N 1 20 LEU CA 1 20 LEU C 1 21 ARG N 97.80 157.80 121.48 97.64 148.62 0.16 19 0 "[ . 1 . 2]"
91 . 1 21 ARG N 1 21 ARG CA 1 21 ARG C 1 22 PHE N 111.50 171.50 142.26 142.45 141.35 . . 0 "[ . 1 . 2]"
92 . 1 22 PHE N 1 22 PHE CA 1 22 PHE C 1 23 ASP N 96.30 156.30 115.24 100.06 121.45 . . 0 "[ . 1 . 2]"
93 . 1 24 GLU N 1 24 GLU CA 1 24 GLU C 1 25 VAL N -54.60 5.40 -35.41 -34.68 -35.17 . . 0 "[ . 1 . 2]"
94 . 1 25 VAL N 1 25 VAL CA 1 25 VAL C 1 26 ARG N -69.80 -9.80 -43.09 -43.35 -43.57 . . 0 "[ . 1 . 2]"
95 . 1 26 ARG N 1 26 ARG CA 1 26 ARG C 1 27 ASN N -32.10 27.90 -13.46 -20.50 -6.17 . . 0 "[ . 1 . 2]"
96 . 1 27 ASN N 1 27 ASN CA 1 27 ASN C 1 28 LYS N 11.20 71.20 26.38 12.50 43.69 . . 0 "[ . 1 . 2]"
97 . 1 28 LYS N 1 28 LYS CA 1 28 LYS C 1 29 HIS N 120.20 -179.80 164.21 158.53 158.51 . . 0 "[ . 1 . 2]"
98 . 1 29 HIS N 1 29 HIS CA 1 29 HIS C 1 30 VAL N 103.60 163.60 151.83 149.49 148.75 . . 0 "[ . 1 . 2]"
99 . 1 30 VAL N 1 30 VAL CA 1 30 VAL C 1 31 LEU N 136.00 -164.00 157.04 155.46 154.10 . . 0 "[ . 1 . 2]"
100 . 1 31 LEU N 1 31 LEU CA 1 31 LEU C 1 32 LEU N 98.20 158.20 118.69 107.92 124.62 . . 0 "[ . 1 . 2]"
101 . 1 32 LEU N 1 32 LEU CA 1 32 LEU C 1 33 ALA N 90.40 150.40 98.00 92.73 102.06 . . 0 "[ . 1 . 2]"
102 . 1 33 ALA N 1 33 ALA CA 1 33 ALA C 1 34 PRO N 94.70 154.70 147.18 144.48 142.03 0.20 15 0 "[ . 1 . 2]"
103 . 1 34 PRO N 1 34 PRO CA 1 34 PRO C 1 35 GLU N -61.00 -1.00 -35.04 -38.37 -26.67 . . 0 "[ . 1 . 2]"
104 . 1 35 GLU N 1 35 GLU CA 1 35 GLU C 1 36 ARG N -51.70 8.30 -50.95 -52.28 -42.64 0.58 8 0 "[ . 1 . 2]"
105 . 1 38 PHE N 1 38 PHE CA 1 38 PHE C 1 39 ASP N 111.20 171.20 137.28 128.67 142.55 . . 0 "[ . 1 . 2]"
106 . 1 39 ASP N 1 39 ASP CA 1 39 ASP C 1 40 LEU N 108.50 168.50 118.59 119.58 119.15 . . 0 "[ . 1 . 2]"
107 . 1 40 LEU N 1 40 LEU CA 1 40 LEU C 1 41 ASP N 117.20 177.20 157.31 158.12 157.58 . . 0 "[ . 1 . 2]"
108 . 1 41 ASP N 1 41 ASP CA 1 41 ASP C 1 42 ASP N 136.70 -163.30 157.10 147.06 165.87 . . 0 "[ . 1 . 2]"
109 . 1 42 ASP N 1 42 ASP CA 1 42 ASP C 1 43 ASN N -64.40 -4.40 -39.70 -44.73 -35.09 . . 0 "[ . 1 . 2]"
110 . 1 43 ASN N 1 43 ASN CA 1 43 ASN C 1 44 ALA N -70.80 -10.80 -37.35 -39.32 -39.63 . . 0 "[ . 1 . 2]"
111 . 1 44 ALA N 1 44 ALA CA 1 44 ALA C 1 45 VAL N -68.40 -8.40 -40.45 -44.86 -34.62 . . 0 "[ . 1 . 2]"
112 . 1 45 VAL N 1 45 VAL CA 1 45 VAL C 1 46 ALA N -74.00 -14.00 -27.36 -35.72 -17.40 . . 0 "[ . 1 . 2]"
113 . 1 46 ALA N 1 46 ALA CA 1 46 ALA C 1 47 VAL N -71.60 -11.60 -40.33 -42.38 -44.86 . . 0 "[ . 1 . 2]"
114 . 1 47 VAL N 1 47 VAL CA 1 47 VAL C 1 48 LEU N -67.80 -7.80 -45.35 -48.07 -38.06 . . 0 "[ . 1 . 2]"
115 . 1 48 LEU N 1 48 LEU CA 1 48 LEU C 1 49 LYS N -70.10 -10.10 -24.60 -24.06 -28.71 . . 0 "[ . 1 . 2]"
116 . 1 49 LYS N 1 49 LYS CA 1 49 LYS C 1 50 LEU N -60.10 -0.10 -29.95 -34.70 -23.50 . . 0 "[ . 1 . 2]"
117 . 1 50 LEU N 1 50 LEU CA 1 50 LEU C 1 51 VAL N -31.30 28.70 -32.47 -32.25 -32.28 1.73 16 0 "[ . 1 . 2]"
118 . 1 51 VAL N 1 51 VAL CA 1 51 VAL C 1 52 ASP N 100.30 160.30 126.83 120.34 132.19 . . 0 "[ . 1 . 2]"
119 . 1 54 ARG N 1 54 ARG CA 1 54 ARG C 1 55 ASN N 106.30 166.30 104.78 104.78 104.73 2.01 7 0 "[ . 1 . 2]"
120 . 1 55 ASN N 1 55 ASN CA 1 55 ASN C 1 56 THR N 102.80 162.80 148.07 133.85 155.79 . . 0 "[ . 1 . 2]"
121 . 1 56 THR N 1 56 THR CA 1 56 THR C 1 57 VAL N 134.50 -165.50 142.16 148.67 142.15 . . 0 "[ . 1 . 2]"
122 . 1 57 VAL N 1 57 VAL CA 1 57 VAL C 1 58 SER N -68.50 -8.50 -39.29 -40.35 -41.23 . . 0 "[ . 1 . 2]"
123 . 1 58 SER N 1 58 SER CA 1 58 SER C 1 59 GLN N -71.90 -11.90 -44.34 -45.58 -42.54 . . 0 "[ . 1 . 2]"
124 . 1 59 GLN N 1 59 GLN CA 1 59 GLN C 1 60 ILE N -72.40 -12.40 -46.42 -46.49 -46.66 . . 0 "[ . 1 . 2]"
125 . 1 60 ILE N 1 60 ILE CA 1 60 ILE C 1 61 ALA N -74.10 -14.10 -42.86 -43.42 -40.75 . . 0 "[ . 1 . 2]"
126 . 1 61 ALA N 1 61 ALA CA 1 61 ALA C 1 62 GLN N -71.80 -11.80 -39.31 -42.95 -35.42 . . 0 "[ . 1 . 2]"
127 . 1 62 GLN N 1 62 GLN CA 1 62 GLN C 1 63 ILE N -72.30 -12.30 -52.72 -56.08 -47.57 . . 0 "[ . 1 . 2]"
128 . 1 63 ILE N 1 63 ILE CA 1 63 ILE C 1 64 LEU N -71.50 -11.50 -48.92 -51.08 -45.13 . . 0 "[ . 1 . 2]"
129 . 1 64 LEU N 1 64 LEU CA 1 64 LEU C 1 65 GLY N -70.60 -10.60 -37.00 -37.06 -37.60 . . 0 "[ . 1 . 2]"
130 . 1 65 GLY N 1 65 GLY CA 1 65 GLY C 1 66 GLN N -70.40 -10.40 -41.10 -39.54 -40.09 . . 0 "[ . 1 . 2]"
131 . 1 66 GLN N 1 66 GLN CA 1 66 GLN C 1 67 THR N -67.90 -7.90 -32.48 -38.66 -30.19 . . 0 "[ . 1 . 2]"
132 . 1 67 THR N 1 67 THR CA 1 67 THR C 1 68 TYR N -61.80 -1.80 -46.48 -48.71 -49.01 . . 0 "[ . 1 . 2]"
133 . 1 68 TYR N 1 68 TYR CA 1 68 TYR C 1 69 ASP N -27.60 32.40 -1.09 -1.34 -2.14 . . 0 "[ . 1 . 2]"
134 . 1 69 ASP N 1 69 ASP CA 1 69 ASP C 1 70 ALA N 2.10 62.10 57.74 48.36 62.26 0.16 7 0 "[ . 1 . 2]"
135 . 1 70 ALA N 1 70 ALA CA 1 70 ALA C 1 71 ASP N 118.00 178.00 161.23 159.57 159.00 . . 0 "[ . 1 . 2]"
136 . 1 71 ASP N 1 71 ASP CA 1 71 ASP C 1 72 PRO N 107.80 167.80 124.62 114.50 114.21 . . 0 "[ . 1 . 2]"
137 . 1 72 PRO N 1 72 PRO CA 1 72 PRO C 1 73 ALA N -64.20 -4.20 -33.72 -37.61 -28.46 . . 0 "[ . 1 . 2]"
138 . 1 73 ALA N 1 73 ALA CA 1 73 ALA C 1 74 ILE N -65.80 -5.80 -36.76 -39.99 -29.51 . . 0 "[ . 1 . 2]"
139 . 1 74 ILE N 1 74 ILE CA 1 74 ILE C 1 75 ILE N -66.10 -6.10 -40.98 -38.34 -39.31 . . 0 "[ . 1 . 2]"
140 . 1 75 ILE N 1 75 ILE CA 1 75 ILE C 1 76 GLU N -70.10 -10.10 -46.68 -48.79 -49.10 . . 0 "[ . 1 . 2]"
141 . 1 76 GLU N 1 76 GLU CA 1 76 GLU C 1 77 ALA N -74.70 -14.70 -47.43 -66.24 -42.38 . . 0 "[ . 1 . 2]"
142 . 1 77 ALA N 1 77 ALA CA 1 77 ALA C 1 78 ASP N -72.20 -12.20 -20.67 -19.21 -19.86 . . 0 "[ . 1 . 2]"
143 . 1 78 ASP N 1 78 ASP CA 1 78 ASP C 1 79 ILE N -69.70 -9.70 -49.57 -50.01 -51.91 . . 0 "[ . 1 . 2]"
144 . 1 79 ILE N 1 79 ILE CA 1 79 ILE C 1 80 LEU N -66.30 -6.30 -36.97 -35.01 -36.47 . . 0 "[ . 1 . 2]"
145 . 1 80 LEU N 1 80 LEU CA 1 80 LEU C 1 81 PRO N -80.80 -20.80 -60.16 -59.04 -59.63 . . 0 "[ . 1 . 2]"
146 . 1 81 PRO N 1 81 PRO CA 1 81 PRO C 1 82 MET N -69.30 -9.30 -33.52 -45.24 -24.20 . . 0 "[ . 1 . 2]"
147 . 1 82 MET N 1 82 MET CA 1 82 MET C 1 83 LEU N -70.20 -10.20 -40.41 -43.14 -35.50 . . 0 "[ . 1 . 2]"
148 . 1 83 LEU N 1 83 LEU CA 1 83 LEU C 1 84 ALA N -73.20 -13.20 -40.75 -39.63 -39.80 . . 0 "[ . 1 . 2]"
149 . 1 84 ALA N 1 84 ALA CA 1 84 ALA C 1 85 GLY N -71.00 -11.00 -38.98 -42.14 -35.98 . . 0 "[ . 1 . 2]"
150 . 1 85 GLY N 1 85 GLY CA 1 85 GLY C 1 86 LEU N -70.50 -10.50 -40.08 -40.63 -40.71 . . 0 "[ . 1 . 2]"
151 . 1 86 LEU N 1 86 LEU CA 1 86 LEU C 1 87 ALA N -71.80 -11.80 -38.95 -40.59 -40.77 . . 0 "[ . 1 . 2]"
152 . 1 87 ALA N 1 87 ALA CA 1 87 ALA C 1 88 GLN N -67.50 -7.50 -35.32 -40.02 -24.33 . . 0 "[ . 1 . 2]"
153 . 1 88 GLN N 1 88 GLN CA 1 88 GLN C 1 89 LYS N -54.30 5.70 -23.11 -30.85 -19.14 . . 0 "[ . 1 . 2]"
154 . 1 89 LYS N 1 89 LYS CA 1 89 LYS C 1 90 ARG N -13.50 46.50 -2.91 -7.99 1.28 . . 0 "[ . 1 . 2]"
155 . 1 90 ARG N 1 90 ARG CA 1 90 ARG C 1 91 VAL N 8.00 68.00 52.24 22.46 68.03 0.03 12 0 "[ . 1 . 2]"
156 . 1 91 VAL N 1 91 VAL CA 1 91 VAL C 1 92 LEU N -33.30 26.70 5.37 -14.98 16.61 . . 0 "[ . 1 . 2]"
157 . 1 92 LEU N 1 92 LEU CA 1 92 LEU C 1 93 GLU N 121.90 -178.10 146.34 143.54 141.18 0.32 20 0 "[ . 1 . 2]"
158 . 1 93 GLU N 1 93 GLU CA 1 93 GLU C 1 94 ARG N 113.70 173.70 143.23 113.13 174.49 0.79 20 0 "[ . 1 . 2]"
159 . 1 13 ARG N 1 13 ARG CA 1 13 ARG CB 1 13 ARG CG 150.00 -150.00 -176.13 -177.17 -175.10 . . 0 "[ . 1 . 2]"
160 . 1 13 ARG CA 1 13 ARG CB 1 13 ARG CG 1 13 ARG CD 150.00 -150.00 175.36 171.90 179.52 . . 0 "[ . 1 . 2]"
161 . 1 14 LEU N 1 14 LEU CA 1 14 LEU CB 1 14 LEU CG -95.00 -35.00 -55.57 -55.56 -56.67 . . 0 "[ . 1 . 2]"
162 . 1 14 LEU CA 1 14 LEU CB 1 14 LEU CG 1 14 LEU CD1 130.00 -170.00 174.98 175.05 173.62 . . 0 "[ . 1 . 2]"
163 . 1 16 ARG CA 1 16 ARG CB 1 16 ARG CG 1 16 ARG CD 150.00 -150.00 179.49 174.15 -172.75 . . 0 "[ . 1 . 2]"
164 . 1 19 ARG CA 1 19 ARG CB 1 19 ARG CG 1 19 ARG CD 150.00 -150.00 -178.82 175.83 -172.54 . . 0 "[ . 1 . 2]"
165 . 1 20 LEU N 1 20 LEU CA 1 20 LEU CB 1 20 LEU CG -90.00 -30.00 -48.11 -49.02 -50.51 . . 0 "[ . 1 . 2]"
166 . 1 20 LEU CA 1 20 LEU CB 1 20 LEU CG 1 20 LEU CD1 146.00 -154.00 -177.14 -177.92 -178.16 . . 0 "[ . 1 . 2]"
167 . 1 21 ARG N 1 21 ARG CA 1 21 ARG CB 1 21 ARG CG -97.00 -37.00 -64.36 -67.53 -60.30 . . 0 "[ . 1 . 2]"
168 . 1 21 ARG CA 1 21 ARG CB 1 21 ARG CG 1 21 ARG CD 150.00 -150.00 -179.93 175.89 -174.45 . . 0 "[ . 1 . 2]"
169 . 1 23 ASP N 1 23 ASP CA 1 23 ASP CB 1 23 ASP CG -110.00 -50.00 -69.77 -76.41 -65.13 . . 0 "[ . 1 . 2]"
170 . 1 23 ASP CA 1 23 ASP CB 1 23 ASP CG 1 23 ASP OD1 -30.00 30.00 -7.88 -14.68 -15.77 . . 0 "[ . 1 . 2]"
171 . 1 24 GLU N 1 24 GLU CA 1 24 GLU CB 1 24 GLU CG 150.00 -150.00 -174.59 -174.16 -174.31 . . 0 "[ . 1 . 2]"
172 . 1 24 GLU CA 1 24 GLU CB 1 24 GLU CG 1 24 GLU CD 150.00 -150.00 175.57 175.44 175.30 . . 0 "[ . 1 . 2]"
173 . 1 28 LYS N 1 28 LYS CA 1 28 LYS CB 1 28 LYS CG 30.00 90.00 56.62 73.15 70.55 . . 0 "[ . 1 . 2]"
174 . 1 28 LYS CA 1 28 LYS CB 1 28 LYS CG 1 28 LYS CD 150.00 -150.00 177.51 -162.78 -164.59 . . 0 "[ . 1 . 2]"
175 . 1 29 HIS N 1 29 HIS CA 1 29 HIS CB 1 29 HIS CG -110.00 -50.00 -64.68 -63.94 -64.21 . . 0 "[ . 1 . 2]"
176 . 1 29 HIS CA 1 29 HIS CB 1 29 HIS CG 1 29 HIS ND1 74.00 134.00 80.16 75.54 75.12 . . 0 "[ . 1 . 2]"
177 . 1 31 LEU N 1 31 LEU CA 1 31 LEU CB 1 31 LEU CG 153.00 -147.00 -171.65 -173.19 -173.67 . . 0 "[ . 1 . 2]"
178 . 1 31 LEU CA 1 31 LEU CB 1 31 LEU CG 1 31 LEU CD1 33.00 93.00 68.67 63.89 63.48 . . 0 "[ . 1 . 2]"
179 . 1 32 LEU N 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG 153.00 -147.00 -177.36 177.49 -172.68 . . 0 "[ . 1 . 2]"
180 . 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG 1 32 LEU CD1 33.00 93.00 62.28 56.58 66.26 . . 0 "[ . 1 . 2]"
181 . 1 39 ASP CA 1 39 ASP CB 1 39 ASP CG 1 39 ASP OD1 -45.00 15.00 -16.55 -40.98 11.96 . . 0 "[ . 1 . 2]"
182 . 1 41 ASP N 1 41 ASP CA 1 41 ASP CB 1 41 ASP CG -96.00 -36.00 -60.59 -68.60 -48.57 . . 0 "[ . 1 . 2]"
183 . 1 41 ASP CA 1 41 ASP CB 1 41 ASP CG 1 41 ASP OD1 -45.00 15.00 -21.31 -16.65 -18.51 . . 0 "[ . 1 . 2]"
184 . 1 42 ASP CA 1 42 ASP CB 1 42 ASP CG 1 42 ASP OD1 -45.00 15.00 -6.58 10.70 -5.59 . . 0 "[ . 1 . 2]"
185 . 1 48 LEU N 1 48 LEU CA 1 48 LEU CB 1 48 LEU CG -90.00 -30.00 -50.89 -50.76 -51.04 . . 0 "[ . 1 . 2]"
186 . 1 48 LEU CA 1 48 LEU CB 1 48 LEU CG 1 48 LEU CD1 150.00 -150.00 179.97 179.41 178.56 . . 0 "[ . 1 . 2]"
187 . 1 50 LEU N 1 50 LEU CA 1 50 LEU CB 1 50 LEU CG 166.00 -134.00 -171.98 -167.45 -173.01 . . 0 "[ . 1 . 2]"
188 . 1 50 LEU CA 1 50 LEU CB 1 50 LEU CG 1 50 LEU CD1 30.00 90.00 75.11 84.38 65.87 . . 0 "[ . 1 . 2]"
189 . 1 52 ASP N 1 52 ASP CA 1 52 ASP CB 1 52 ASP CG -100.00 -40.00 -68.35 -68.93 -69.37 . . 0 "[ . 1 . 2]"
190 . 1 52 ASP CA 1 52 ASP CB 1 52 ASP CG 1 52 ASP OD1 -45.00 15.00 -14.08 -13.65 -14.28 . . 0 "[ . 1 . 2]"
191 . 1 54 ARG N 1 54 ARG CA 1 54 ARG CB 1 54 ARG CG -97.00 -37.00 -65.29 -70.00 -60.33 . . 0 "[ . 1 . 2]"
192 . 1 54 ARG CA 1 54 ARG CB 1 54 ARG CG 1 54 ARG CD 150.00 -150.00 177.95 174.69 174.23 . . 0 "[ . 1 . 2]"
193 . 1 55 ASN N 1 55 ASN CA 1 55 ASN CB 1 55 ASN CG -100.00 -40.00 -71.66 -73.53 -74.10 . . 0 "[ . 1 . 2]"
194 . 1 55 ASN CA 1 55 ASN CB 1 55 ASN CG 1 55 ASN OD1 -50.00 10.00 -16.16 -24.05 -10.80 . . 0 "[ . 1 . 2]"
195 . 1 64 LEU N 1 64 LEU CA 1 64 LEU CB 1 64 LEU CG 150.00 -150.00 -169.74 -171.06 -172.00 . . 0 "[ . 1 . 2]"
196 . 1 64 LEU CA 1 64 LEU CB 1 64 LEU CG 1 64 LEU CD1 33.00 93.00 66.79 64.27 63.94 . . 0 "[ . 1 . 2]"
197 . 1 68 TYR N 1 68 TYR CA 1 68 TYR CB 1 68 TYR CG -100.00 -40.00 -68.59 -82.45 -65.48 . . 0 "[ . 1 . 2]"
198 . 1 68 TYR CA 1 68 TYR CB 1 68 TYR CG 1 68 TYR CD1 62.00 122.00 87.97 79.23 96.72 . . 0 "[ . 1 . 2]"
199 . 1 69 ASP N 1 69 ASP CA 1 69 ASP CB 1 69 ASP CG 150.00 -150.00 -172.21 -171.70 -172.17 . . 0 "[ . 1 . 2]"
200 . 1 69 ASP CA 1 69 ASP CB 1 69 ASP CG 1 69 ASP OD1 -40.00 20.00 -4.47 13.08 -7.01 . . 0 "[ . 1 . 2]"
201 . 1 71 ASP N 1 71 ASP CA 1 71 ASP CB 1 71 ASP CG -90.00 -30.00 -66.67 -61.32 -62.81 . . 0 "[ . 1 . 2]"
202 . 1 71 ASP CA 1 71 ASP CB 1 71 ASP CG 1 71 ASP OD1 -45.00 15.00 -27.17 -44.10 13.85 . . 0 "[ . 1 . 2]"
203 . 1 74 ILE N 1 74 ILE CA 1 74 ILE CB 1 74 ILE CG1 -90.00 -30.00 -56.63 -69.07 -46.47 . . 0 "[ . 1 . 2]"
204 . 1 75 ILE N 1 75 ILE CA 1 75 ILE CB 1 75 ILE CG1 -90.00 -30.00 -66.33 -79.21 -50.63 . . 0 "[ . 1 . 2]"
205 . 1 78 ASP N 1 78 ASP CA 1 78 ASP CB 1 78 ASP CG 150.00 -150.00 -172.49 -172.25 -172.42 . . 0 "[ . 1 . 2]"
206 . 1 78 ASP CA 1 78 ASP CB 1 78 ASP CG 1 78 ASP OD1 -45.00 15.00 -7.66 -15.81 12.93 . . 0 "[ . 1 . 2]"
207 . 1 79 ILE N 1 79 ILE CA 1 79 ILE CB 1 79 ILE CG1 20.00 80.00 61.61 58.93 57.08 . . 0 "[ . 1 . 2]"
208 . 1 80 LEU N 1 80 LEU CA 1 80 LEU CB 1 80 LEU CG -90.00 -30.00 -90.03 -91.25 -86.44 1.25 15 0 "[ . 1 . 2]"
209 . 1 80 LEU CA 1 80 LEU CB 1 80 LEU CG 1 80 LEU CD1 130.00 -170.00 161.99 162.64 162.06 . . 0 "[ . 1 . 2]"
210 . 1 88 GLN N 1 88 GLN CA 1 88 GLN CB 1 88 GLN CG -90.00 -30.00 -65.19 -65.79 -66.04 . . 0 "[ . 1 . 2]"
211 . 1 88 GLN CA 1 88 GLN CB 1 88 GLN CG 1 88 GLN CD 150.00 -150.00 177.98 176.22 -177.82 . . 0 "[ . 1 . 2]"
212 . 1 89 LYS N 1 89 LYS CA 1 89 LYS CB 1 89 LYS CG -90.00 -30.00 -62.11 -65.07 -65.11 . . 0 "[ . 1 . 2]"
213 . 1 89 LYS CA 1 89 LYS CB 1 89 LYS CG 1 89 LYS CD 150.00 -150.00 -179.72 179.72 179.00 . . 0 "[ . 1 . 2]"
214 . 1 90 ARG N 1 90 ARG CA 1 90 ARG CB 1 90 ARG CG 150.00 -150.00 -164.22 -164.45 -165.03 . . 0 "[ . 1 . 2]"
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