NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
486942 |
2kwp   |
16868 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2kwp
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 184
_TA_constraint_stats_list.Viol_count 360
_TA_constraint_stats_list.Viol_total 133532.61
_TA_constraint_stats_list.Viol_max 109.57
_TA_constraint_stats_list.Viol_rms 12.67
_TA_constraint_stats_list.Viol_average_all_restraints 1.81
_TA_constraint_stats_list.Viol_average_violations_only 18.55
_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 ASN N 1 2 ASN CA 1 2 ASN C -137.86 -54.18 -100.38 -106.57 -88.09 . . 0 "[ . 1 . 2]"
2 . 1 2 ASN C 1 3 LYS N 1 3 LYS CA 1 3 LYS C -73.82 -52.14 -66.67 -71.01 -72.61 0.20 4 0 "[ . 1 . 2]"
3 . 1 3 LYS C 1 4 GLU N 1 4 GLU CA 1 4 GLU C -72.68 -55.24 -60.34 -65.67 -55.20 0.04 20 0 "[ . 1 . 2]"
4 . 1 4 GLU C 1 5 ILE N 1 5 ILE CA 1 5 ILE C -72.58 -52.10 -61.83 -59.40 -60.53 . . 0 "[ . 1 . 2]"
5 . 1 5 ILE C 1 6 LEU N 1 6 LEU CA 1 6 LEU C -75.69 -53.21 -68.94 -68.09 -69.14 0.01 9 0 "[ . 1 . 2]"
6 . 1 6 LEU C 1 7 ALA N 1 7 ALA CA 1 7 ALA C -71.60 -58.52 -70.39 -72.08 -65.40 0.48 15 0 "[ . 1 . 2]"
7 . 1 7 ALA C 1 8 VAL N 1 8 VAL CA 1 8 VAL C -88.43 -48.67 -66.98 -79.33 -56.18 . . 0 "[ . 1 . 2]"
8 . 1 8 VAL C 1 9 VAL N 1 9 VAL CA 1 9 VAL C -69.78 -60.98 -69.43 -69.97 -67.04 0.19 20 0 "[ . 1 . 2]"
9 . 1 9 VAL C 1 10 GLU N 1 10 GLU CA 1 10 GLU C -72.96 -47.36 -70.13 -68.20 -69.79 0.10 17 0 "[ . 1 . 2]"
10 . 1 10 GLU C 1 11 ALA N 1 11 ALA CA 1 11 ALA C -78.00 -49.44 -70.34 -74.95 -78.09 0.09 1 0 "[ . 1 . 2]"
11 . 1 11 ALA C 1 12 VAL N 1 12 VAL CA 1 12 VAL C -82.05 -44.29 -79.30 -78.38 -79.34 0.20 20 0 "[ . 1 . 2]"
12 . 1 12 VAL C 1 13 SER N 1 13 SER CA 1 13 SER C -76.72 -50.84 -71.91 -76.86 -62.26 0.14 13 0 "[ . 1 . 2]"
13 . 1 13 SER C 1 14 ASN N 1 14 ASN CA 1 14 ASN C -78.56 -46.20 -74.59 -71.36 -73.83 0.11 11 0 "[ . 1 . 2]"
14 . 1 14 ASN C 1 15 GLU N 1 15 GLU CA 1 15 GLU C -83.05 -54.01 -72.41 -82.78 -60.02 . . 0 "[ . 1 . 2]"
15 . 1 15 GLU C 1 16 LYS N 1 16 LYS CA 1 16 LYS C -112.95 -83.35 -99.86 -96.93 -97.01 0.24 4 0 "[ . 1 . 2]"
16 . 1 17 ALA C 1 18 LEU N 1 18 LEU CA 1 18 LEU C -169.27 -63.51 -92.45 -88.06 -92.68 . . 0 "[ . 1 . 2]"
17 . 1 18 LEU C 1 19 PRO N 1 19 PRO CA 1 19 PRO C -80.99 -47.07 -69.25 -70.57 -67.81 . . 0 "[ . 1 . 2]"
18 . 1 19 PRO C 1 20 ARG N 1 20 ARG CA 1 20 ARG C -69.41 -32.09 -55.63 -61.91 -51.35 . . 0 "[ . 1 . 2]"
19 . 1 20 ARG C 1 21 GLU N 1 21 GLU CA 1 21 GLU C -70.90 -48.10 -52.92 -60.89 -47.94 0.16 20 0 "[ . 1 . 2]"
20 . 1 21 GLU C 1 22 LYS N 1 22 LYS CA 1 22 LYS C -104.38 -44.58 -52.62 -53.45 -54.45 . . 0 "[ . 1 . 2]"
21 . 1 22 LYS C 1 23 ILE N 1 23 ILE CA 1 23 ILE C -76.72 -47.40 -53.50 -54.53 -55.72 0.16 7 0 "[ . 1 . 2]"
22 . 1 23 ILE C 1 24 PHE N 1 24 PHE CA 1 24 PHE C -70.50 -52.74 -52.97 -52.57 -52.62 0.29 12 0 "[ . 1 . 2]"
23 . 1 24 PHE C 1 25 GLU N 1 25 GLU CA 1 25 GLU C -72.54 -55.30 -60.89 -65.51 -55.12 0.18 12 0 "[ . 1 . 2]"
24 . 1 25 GLU C 1 26 ALA N 1 26 ALA CA 1 26 ALA C -68.63 -55.47 -66.84 -66.36 -67.09 0.56 4 0 "[ . 1 . 2]"
25 . 1 26 ALA C 1 27 LEU N 1 27 LEU CA 1 27 LEU C -79.78 -50.26 -58.19 -68.20 -50.10 0.16 12 0 "[ . 1 . 2]"
26 . 1 27 LEU C 1 28 GLU N 1 28 GLU CA 1 28 GLU C -77.58 -51.38 -59.36 -58.31 -59.33 0.04 3 0 "[ . 1 . 2]"
27 . 1 28 GLU C 1 29 SER N 1 29 SER CA 1 29 SER C -71.77 -56.21 -62.06 -71.71 -56.16 0.05 5 0 "[ . 1 . 2]"
28 . 1 29 SER C 1 30 ALA N 1 30 ALA CA 1 30 ALA C -76.81 -51.73 -72.22 -64.77 -67.10 0.10 12 0 "[ . 1 . 2]"
29 . 1 30 ALA C 1 31 LEU N 1 31 LEU CA 1 31 LEU C -73.12 -59.48 -66.47 -73.56 -59.25 0.44 4 0 "[ . 1 . 2]"
30 . 1 31 LEU C 1 32 ALA N 1 32 ALA CA 1 32 ALA C -77.13 -55.37 -64.61 -76.65 -57.32 . . 0 "[ . 1 . 2]"
31 . 1 32 ALA C 1 33 THR N 1 33 THR CA 1 33 THR C -81.17 -47.29 -59.27 -71.88 -47.38 . . 0 "[ . 1 . 2]"
32 . 1 33 THR C 1 34 ALA N 1 34 ALA CA 1 34 ALA C -74.85 -50.53 -74.47 -74.82 -74.86 0.63 17 0 "[ . 1 . 2]"
33 . 1 34 ALA C 1 35 THR N 1 35 THR CA 1 35 THR C -85.29 -48.97 -62.79 -71.28 -50.88 . . 0 "[ . 1 . 2]"
34 . 1 35 THR C 1 36 LYS N 1 36 LYS CA 1 36 LYS C -71.16 -50.36 -61.31 -68.99 -49.78 0.58 18 0 "[ . 1 . 2]"
35 . 1 36 LYS C 1 37 LYS N 1 37 LYS CA 1 37 LYS C -80.27 -58.47 -58.56 -61.39 -57.77 0.70 17 0 "[ . 1 . 2]"
36 . 1 37 LYS C 1 38 LYS N 1 38 LYS CA 1 38 LYS C -116.13 -50.09 -58.99 -58.02 -58.61 . . 0 "[ . 1 . 2]"
37 . 1 40 GLU C 1 41 GLN N 1 41 GLN CA 1 41 GLN C -136.48 -59.12 -109.32 -102.28 -103.94 2.61 17 0 "[ . 1 . 2]"
38 . 1 42 GLU C 1 43 ILE N 1 43 ILE CA 1 43 ILE C 173.50 -81.46 -99.28 -95.61 -96.29 . . 0 "[ . 1 . 2]"
39 . 1 43 ILE C 1 44 ASP N 1 44 ASP CA 1 44 ASP C -161.46 -72.54 -86.18 -104.59 -76.41 . . 0 "[ . 1 . 2]"
40 . 1 44 ASP C 1 45 VAL N 1 45 VAL CA 1 45 VAL C -143.93 -118.57 -124.36 -135.22 -118.57 . . 0 "[ . 1 . 2]"
41 . 1 45 VAL C 1 46 ARG N 1 46 ARG CA 1 46 ARG C -168.11 -107.27 -121.40 -130.75 -113.41 . . 0 "[ . 1 . 2]"
42 . 1 46 ARG C 1 47 VAL N 1 47 VAL CA 1 47 VAL C -134.23 -86.87 -113.25 -106.04 -109.78 . . 0 "[ . 1 . 2]"
43 . 1 47 VAL C 1 48 GLN N 1 48 GLN CA 1 48 GLN C -132.19 -100.47 -115.71 -123.05 -107.94 . . 0 "[ . 1 . 2]"
44 . 1 55 ASP C 1 56 PHE N 1 56 PHE CA 1 56 PHE C -155.20 -101.36 -121.99 -130.40 -101.20 0.16 17 0 "[ . 1 . 2]"
45 . 1 56 PHE C 1 57 ASP N 1 57 ASP CA 1 57 ASP C -168.33 -101.09 -114.91 -108.54 -109.85 . . 0 "[ . 1 . 2]"
46 . 1 57 ASP C 1 58 THR N 1 58 THR CA 1 58 THR C -150.89 -76.25 -103.04 -124.99 -78.82 . . 0 "[ . 1 . 2]"
47 . 1 58 THR C 1 59 PHE N 1 59 PHE CA 1 59 PHE C -133.03 -102.43 -131.66 -133.58 -128.52 0.55 14 0 "[ . 1 . 2]"
48 . 1 59 PHE C 1 60 ARG N 1 60 ARG CA 1 60 ARG C -147.77 -96.81 -112.37 -127.87 -96.41 0.40 17 0 "[ . 1 . 2]"
49 . 1 60 ARG C 1 61 ARG N 1 61 ARG CA 1 61 ARG C -168.17 -95.97 -130.53 -147.25 -110.31 . . 0 "[ . 1 . 2]"
50 . 1 61 ARG C 1 62 TRP N 1 62 TRP CA 1 62 TRP C -173.86 -106.30 -140.67 -134.10 -136.78 . . 0 "[ . 1 . 2]"
51 . 1 62 TRP C 1 63 LEU N 1 63 LEU CA 1 63 LEU C -156.11 -54.87 -101.92 -94.93 -97.07 . . 0 "[ . 1 . 2]"
52 . 1 63 LEU C 1 64 VAL N 1 64 VAL CA 1 64 VAL C -118.15 -64.15 -67.42 -77.44 -63.72 0.43 14 0 "[ . 1 . 2]"
53 . 1 64 VAL C 1 65 VAL N 1 65 VAL CA 1 65 VAL C -178.38 -78.82 -127.06 -123.97 -124.72 . . 0 "[ . 1 . 2]"
54 . 1 73 LYS C 1 74 GLU N 1 74 GLU CA 1 74 GLU C -171.93 -102.13 -141.27 -158.45 -127.40 . . 0 "[ . 1 . 2]"
55 . 1 74 GLU C 1 75 ILE N 1 75 ILE CA 1 75 ILE C 178.80 -104.40 -119.82 -133.77 -103.95 0.45 19 0 "[ . 1 . 2]"
56 . 1 75 ILE C 1 76 THR N 1 76 THR CA 1 76 THR C -112.62 -52.78 -64.76 -74.92 -56.81 . . 0 "[ . 1 . 2]"
57 . 1 76 THR C 1 77 LEU N 1 77 LEU CA 1 77 LEU C -66.63 -53.67 -59.87 -66.92 -53.66 0.29 14 0 "[ . 1 . 2]"
58 . 1 77 LEU C 1 78 GLU N 1 78 GLU CA 1 78 GLU C -74.67 -48.35 -53.53 -59.78 -47.75 0.60 15 0 "[ . 1 . 2]"
59 . 1 78 GLU C 1 79 ALA N 1 79 ALA CA 1 79 ALA C -68.10 -56.98 -59.15 -69.20 -56.78 1.10 20 0 "[ . 1 . 2]"
60 . 1 79 ALA C 1 80 ALA N 1 80 ALA CA 1 80 ALA C -69.48 -55.88 -61.83 -68.34 -56.34 . . 0 "[ . 1 . 2]"
61 . 1 80 ALA C 1 81 ARG N 1 81 ARG CA 1 81 ARG C -79.39 -51.11 -65.08 -75.83 -52.22 . . 0 "[ . 1 . 2]"
62 . 1 81 ARG C 1 82 TYR N 1 82 TYR CA 1 82 TYR C -79.22 -52.66 -61.07 -60.97 -61.44 0.16 13 0 "[ . 1 . 2]"
63 . 1 82 TYR C 1 83 GLU N 1 83 GLU CA 1 83 GLU C -90.16 -49.80 -80.14 -89.96 -71.12 . . 0 "[ . 1 . 2]"
64 . 1 87 LEU C 1 88 ASN N 1 88 ASN CA 1 88 ASN C -149.39 -111.87 -135.52 -134.72 -135.68 . . 0 "[ . 1 . 2]"
65 . 1 89 LEU C 1 90 GLY N 1 90 GLY CA 1 90 GLY C 75.86 117.94 95.79 98.97 97.36 1.41 16 0 "[ . 1 . 2]"
66 . 1 91 ASP C 1 92 TYR N 1 92 TYR CA 1 92 TYR C -176.28 -70.68 -113.93 -108.75 -111.30 . . 0 "[ . 1 . 2]"
67 . 1 92 TYR C 1 93 VAL N 1 93 VAL CA 1 93 VAL C -168.16 -67.32 -99.64 -124.79 -80.15 . . 0 "[ . 1 . 2]"
68 . 1 93 VAL C 1 94 GLU N 1 94 GLU CA 1 94 GLU C -177.56 -102.00 -117.43 -115.76 -117.29 0.14 17 0 "[ . 1 . 2]"
69 . 1 94 GLU C 1 95 ASP N 1 95 ASP CA 1 95 ASP C -160.51 -109.15 -156.11 -161.04 -148.53 0.53 12 0 "[ . 1 . 2]"
70 . 1 95 ASP C 1 96 GLN N 1 96 GLN CA 1 96 GLN C -119.29 -49.17 -91.52 -91.18 -94.08 . . 0 "[ . 1 . 2]"
71 . 1 96 GLN C 1 97 ILE N 1 97 ILE CA 1 97 ILE C 179.62 -70.30 -131.03 -139.44 -124.05 . . 0 "[ . 1 . 2]"
72 . 1 98 GLU C 1 99 SER N 1 99 SER CA 1 99 SER C -166.01 -38.93 -115.02 -122.75 -124.69 . . 0 "[ . 1 . 2]"
73 . 1 108 GLN C 1 109 THR N 1 109 THR CA 1 109 THR C -76.55 -46.99 -60.98 -58.92 -61.34 . . 0 "[ . 1 . 2]"
74 . 1 109 THR C 1 110 ALA N 1 110 ALA CA 1 110 ALA C -76.03 -51.75 -67.27 -68.76 -71.09 0.28 4 0 "[ . 1 . 2]"
75 . 1 110 ALA C 1 111 LYS N 1 111 LYS CA 1 111 LYS C -70.60 -50.44 -65.04 -70.81 -56.56 0.21 9 0 "[ . 1 . 2]"
76 . 1 111 LYS C 1 112 GLN N 1 112 GLN CA 1 112 GLN C -76.52 -52.28 -63.35 -64.60 -66.21 . . 0 "[ . 1 . 2]"
77 . 1 112 GLN C 1 113 VAL N 1 113 VAL CA 1 113 VAL C -77.92 -53.72 -70.46 -78.28 -63.29 0.36 4 0 "[ . 1 . 2]"
78 . 1 113 VAL C 1 114 ILE N 1 114 ILE CA 1 114 ILE C -73.00 -50.64 -66.19 -73.59 -59.18 0.59 2 0 "[ . 1 . 2]"
79 . 1 114 ILE C 1 115 VAL N 1 115 VAL CA 1 115 VAL C -73.58 -48.54 -68.62 -73.75 -62.86 0.17 13 0 "[ . 1 . 2]"
80 . 1 115 VAL C 1 116 GLN N 1 116 GLN CA 1 116 GLN C -70.63 -53.87 -63.47 -71.08 -59.43 0.45 2 0 "[ . 1 . 2]"
81 . 1 116 GLN C 1 117 LYS N 1 117 LYS CA 1 117 LYS C -78.12 -49.92 -65.37 -70.28 -61.52 . . 0 "[ . 1 . 2]"
82 . 1 117 LYS C 1 118 VAL N 1 118 VAL CA 1 118 VAL C -72.94 -51.62 -66.96 -65.10 -67.50 0.03 5 0 "[ . 1 . 2]"
83 . 1 118 VAL C 1 119 ARG N 1 119 ARG CA 1 119 ARG C -72.68 -56.60 -61.04 -66.17 -56.55 0.05 16 0 "[ . 1 . 2]"
84 . 1 119 ARG C 1 120 GLU N 1 120 GLU CA 1 120 GLU C -72.23 -54.83 -63.63 -65.73 -67.32 . . 0 "[ . 1 . 2]"
85 . 1 120 GLU C 1 121 ALA N 1 121 ALA CA 1 121 ALA C -71.67 -47.07 -62.98 -63.71 -64.86 . . 0 "[ . 1 . 2]"
86 . 1 121 ALA C 1 122 GLU N 1 122 GLU CA 1 122 GLU C -73.45 -51.45 -62.01 -70.44 -52.32 . . 0 "[ . 1 . 2]"
87 . 1 122 GLU C 1 123 ARG N 1 123 ARG CA 1 123 ARG C -115.56 -29.92 -56.91 -56.54 -57.33 . . 0 "[ . 1 . 2]"
88 . 1 2 ASN N 1 2 ASN CA 1 2 ASN C 1 3 LYS N 70.80 165.84 106.18 115.10 114.80 . . 0 "[ . 1 . 2]"
89 . 1 3 LYS N 1 3 LYS CA 1 3 LYS C 1 4 GLU N -48.83 -5.55 -28.26 -29.15 -29.24 . . 0 "[ . 1 . 2]"
90 . 1 4 GLU N 1 4 GLU CA 1 4 GLU C 1 5 ILE N -49.79 -37.71 -38.73 -37.68 -37.77 0.14 8 0 "[ . 1 . 2]"
91 . 1 5 ILE N 1 5 ILE CA 1 5 ILE C 1 6 LEU N -65.48 -22.56 -44.00 -54.23 -29.37 . . 0 "[ . 1 . 2]"
92 . 1 6 LEU N 1 6 LEU CA 1 6 LEU C 1 7 ALA N -55.11 -16.75 -31.22 -37.71 -25.54 . . 0 "[ . 1 . 2]"
93 . 1 7 ALA N 1 7 ALA CA 1 7 ALA C 1 8 VAL N -53.13 -29.25 -39.31 -34.65 -35.85 0.12 20 0 "[ . 1 . 2]"
94 . 1 8 VAL N 1 8 VAL CA 1 8 VAL C 1 9 VAL N -58.17 -20.37 -32.93 -40.12 -26.50 . . 0 "[ . 1 . 2]"
95 . 1 9 VAL N 1 9 VAL CA 1 9 VAL C 1 10 GLU N -55.21 -26.65 -35.33 -32.67 -33.88 . . 0 "[ . 1 . 2]"
96 . 1 10 GLU N 1 10 GLU CA 1 10 GLU C 1 11 ALA N -52.61 -32.09 -32.41 -33.97 -31.89 0.20 13 0 "[ . 1 . 2]"
97 . 1 11 ALA N 1 11 ALA CA 1 11 ALA C 1 12 VAL N -52.06 -30.78 -33.51 -31.48 -32.45 0.39 18 0 "[ . 1 . 2]"
98 . 1 12 VAL N 1 12 VAL CA 1 12 VAL C 1 13 SER N -61.26 -23.42 -31.05 -43.18 -23.29 0.13 10 0 "[ . 1 . 2]"
99 . 1 13 SER N 1 13 SER CA 1 13 SER C 1 14 ASN N -59.91 -22.91 -35.47 -40.93 -45.13 . . 0 "[ . 1 . 2]"
100 . 1 14 ASN N 1 14 ASN CA 1 14 ASN C 1 15 GLU N -47.99 -36.99 -37.10 -37.71 -38.60 0.68 5 0 "[ . 1 . 2]"
101 . 1 15 GLU N 1 15 GLU CA 1 15 GLU C 1 16 LYS N -51.84 -12.56 -44.42 -51.39 -36.63 . . 0 "[ . 1 . 2]"
102 . 1 16 LYS N 1 16 LYS CA 1 16 LYS C 1 17 ALA N -28.55 24.49 1.86 0.48 -2.63 . . 0 "[ . 1 . 2]"
103 . 1 18 LEU N 1 18 LEU CA 1 18 LEU C 1 19 PRO N 59.51 -172.49 165.69 171.66 170.13 . . 0 "[ . 1 . 2]"
104 . 1 19 PRO N 1 19 PRO CA 1 19 PRO C 1 20 ARG N 119.19 163.03 136.83 128.69 145.44 . . 0 "[ . 1 . 2]"
105 . 1 20 ARG N 1 20 ARG CA 1 20 ARG C 1 21 GLU N -65.04 -28.52 -40.03 -40.87 -41.61 . . 0 "[ . 1 . 2]"
106 . 1 21 GLU N 1 21 GLU CA 1 21 GLU C 1 22 LYS N -59.97 -13.57 -53.18 -60.24 -43.18 0.27 18 0 "[ . 1 . 2]"
107 . 1 22 LYS N 1 22 LYS CA 1 22 LYS C 1 23 ILE N -60.34 -10.98 -48.37 -55.46 -42.77 . . 0 "[ . 1 . 2]"
108 . 1 23 ILE N 1 23 ILE CA 1 23 ILE C 1 24 PHE N -63.93 -23.25 -50.86 -53.26 -53.83 . . 0 "[ . 1 . 2]"
109 . 1 24 PHE N 1 24 PHE CA 1 24 PHE C 1 25 GLU N -47.49 -32.85 -34.63 -38.43 -32.55 0.30 7 0 "[ . 1 . 2]"
110 . 1 25 GLU N 1 25 GLU CA 1 25 GLU C 1 26 ALA N -52.98 -33.82 -44.67 -43.72 -44.11 . . 0 "[ . 1 . 2]"
111 . 1 26 ALA N 1 26 ALA CA 1 26 ALA C 1 27 LEU N -59.93 -23.37 -43.78 -50.05 -29.44 . . 0 "[ . 1 . 2]"
112 . 1 27 LEU N 1 27 LEU CA 1 27 LEU C 1 28 GLU N -50.14 -29.18 -46.22 -50.48 -37.39 0.34 12 0 "[ . 1 . 2]"
113 . 1 28 GLU N 1 28 GLU CA 1 28 GLU C 1 29 SER N -53.68 -27.00 -42.00 -42.47 -42.71 . . 0 "[ . 1 . 2]"
114 . 1 29 SER N 1 29 SER CA 1 29 SER C 1 30 ALA N -52.01 -31.89 -36.26 -48.50 -31.83 0.06 19 0 "[ . 1 . 2]"
115 . 1 30 ALA N 1 30 ALA CA 1 30 ALA C 1 31 LEU N -49.59 -32.03 -41.17 -35.76 -38.84 0.09 15 0 "[ . 1 . 2]"
116 . 1 31 LEU N 1 31 LEU CA 1 31 LEU C 1 32 ALA N -51.10 -25.70 -46.57 -48.53 -50.90 0.22 5 0 "[ . 1 . 2]"
117 . 1 32 ALA N 1 32 ALA CA 1 32 ALA C 1 33 THR N -58.57 -30.01 -45.85 -40.95 -43.24 . . 0 "[ . 1 . 2]"
118 . 1 33 THR N 1 33 THR CA 1 33 THR C 1 34 ALA N -59.38 -30.98 -43.54 -39.98 -41.92 . . 0 "[ . 1 . 2]"
119 . 1 34 ALA N 1 34 ALA CA 1 34 ALA C 1 35 THR N -47.80 -29.48 -32.74 -42.96 -29.01 0.47 14 0 "[ . 1 . 2]"
120 . 1 35 THR N 1 35 THR CA 1 35 THR C 1 36 LYS N -53.03 -28.67 -48.67 -48.29 -48.99 0.72 17 0 "[ . 1 . 2]"
121 . 1 36 LYS N 1 36 LYS CA 1 36 LYS C 1 37 LYS N -57.59 -24.19 -28.78 -43.17 -23.64 0.55 18 0 "[ . 1 . 2]"
122 . 1 37 LYS N 1 37 LYS CA 1 37 LYS C 1 38 LYS N -47.05 -8.61 -35.58 -40.94 -30.80 . . 0 "[ . 1 . 2]"
123 . 1 38 LYS N 1 38 LYS CA 1 38 LYS C 1 39 TYR N -62.94 19.14 -40.36 -54.32 -16.30 . . 0 "[ . 1 . 2]"
124 . 1 41 GLN N 1 41 GLN CA 1 41 GLN C 1 42 GLU N -31.32 25.64 16.76 2.94 25.74 0.10 15 0 "[ . 1 . 2]"
125 . 1 43 ILE N 1 43 ILE CA 1 43 ILE C 1 44 ASP N 126.25 -171.99 154.78 149.87 147.93 . . 0 "[ . 1 . 2]"
126 . 1 44 ASP N 1 44 ASP CA 1 44 ASP C 1 45 VAL N 112.30 165.14 119.20 120.97 118.67 0.13 19 0 "[ . 1 . 2]"
127 . 1 45 VAL N 1 45 VAL CA 1 45 VAL C 1 46 ARG N 117.89 179.05 139.10 138.27 137.71 . . 0 "[ . 1 . 2]"
128 . 1 46 ARG N 1 46 ARG CA 1 46 ARG C 1 47 VAL N 112.44 149.68 129.60 112.30 136.99 0.14 15 0 "[ . 1 . 2]"
129 . 1 47 VAL N 1 47 VAL CA 1 47 VAL C 1 48 GLN N 119.19 136.59 133.79 128.76 137.00 0.41 18 0 "[ . 1 . 2]"
130 . 1 48 GLN N 1 48 GLN CA 1 48 GLN C 1 49 ILE N 105.91 137.99 133.05 116.09 138.53 0.54 10 0 "[ . 1 . 2]"
131 . 1 56 PHE N 1 56 PHE CA 1 56 PHE C 1 57 ASP N 117.19 -177.77 138.63 116.83 151.89 0.36 15 0 "[ . 1 . 2]"
132 . 1 57 ASP N 1 57 ASP CA 1 57 ASP C 1 58 THR N 100.68 156.48 149.75 144.61 140.69 0.49 12 0 "[ . 1 . 2]"
133 . 1 58 THR N 1 58 THR CA 1 58 THR C 1 59 PHE N 98.39 157.71 134.24 128.75 145.58 . . 0 "[ . 1 . 2]"
134 . 1 59 PHE N 1 59 PHE CA 1 59 PHE C 1 60 ARG N 108.98 154.22 152.55 147.83 154.74 0.52 15 0 "[ . 1 . 2]"
135 . 1 60 ARG N 1 60 ARG CA 1 60 ARG C 1 61 ARG N 100.41 161.29 146.56 146.94 146.46 0.14 20 0 "[ . 1 . 2]"
136 . 1 61 ARG N 1 61 ARG CA 1 61 ARG C 1 62 TRP N 121.42 -173.98 154.21 156.38 155.71 . . 0 "[ . 1 . 2]"
137 . 1 62 TRP N 1 62 TRP CA 1 62 TRP C 1 63 LEU N 114.16 154.80 154.61 155.24 155.14 0.57 3 0 "[ . 1 . 2]"
138 . 1 63 LEU N 1 63 LEU CA 1 63 LEU C 1 64 VAL N 86.50 148.62 134.93 125.80 143.74 . . 0 "[ . 1 . 2]"
139 . 1 64 VAL N 1 64 VAL CA 1 64 VAL C 1 65 VAL N 104.88 148.32 120.94 115.01 126.84 . . 0 "[ . 1 . 2]"
140 . 1 65 VAL N 1 65 VAL CA 1 65 VAL C 1 66 ASP N 131.81 -154.63 141.32 137.51 133.90 0.30 12 0 "[ . 1 . 2]"
141 . 1 68 VAL N 1 68 VAL CA 1 68 VAL C 1 69 THR N 115.24 141.40 116.02 113.40 119.37 1.84 11 0 "[ . 1 . 2]"
142 . 1 74 GLU N 1 74 GLU CA 1 74 GLU C 1 75 ILE N 129.03 179.71 145.09 142.46 138.24 . . 0 "[ . 1 . 2]"
143 . 1 75 ILE N 1 75 ILE CA 1 75 ILE C 1 76 THR N 129.54 175.22 133.00 140.95 137.29 1.02 17 0 "[ . 1 . 2]"
144 . 1 76 THR N 1 76 THR CA 1 76 THR C 1 77 LEU N 146.28 -176.32 159.49 168.69 165.74 . . 0 "[ . 1 . 2]"
145 . 1 77 LEU N 1 77 LEU CA 1 77 LEU C 1 78 GLU N -55.21 -23.73 -49.66 -55.28 -44.71 0.07 10 0 "[ . 1 . 2]"
146 . 1 78 GLU N 1 78 GLU CA 1 78 GLU C 1 79 ALA N -52.01 -29.53 -49.94 -49.19 -49.85 1.03 14 0 "[ . 1 . 2]"
147 . 1 79 ALA N 1 79 ALA CA 1 79 ALA C 1 80 ALA N -53.13 -33.53 -37.90 -42.61 -45.41 1.13 14 0 "[ . 1 . 2]"
148 . 1 80 ALA N 1 80 ALA CA 1 80 ALA C 1 81 ARG N -52.06 -29.50 -40.17 -41.64 -45.96 0.69 20 0 "[ . 1 . 2]"
149 . 1 81 ARG N 1 81 ARG CA 1 81 ARG C 1 82 TYR N -51.89 -9.65 -40.62 -48.82 -27.90 . . 0 "[ . 1 . 2]"
150 . 1 82 TYR N 1 82 TYR CA 1 82 TYR C 1 83 GLU N -50.50 -19.30 -39.27 -42.30 -43.75 0.45 12 0 "[ . 1 . 2]"
151 . 1 83 GLU N 1 83 GLU CA 1 83 GLU C 1 84 ASP N -55.89 -14.49 -30.92 -31.24 -32.13 . . 0 "[ . 1 . 2]"
152 . 1 88 ASN N 1 88 ASN CA 1 88 ASN C 1 89 LEU N 133.10 -166.22 174.48 140.77 -167.33 . . 0 "[ . 1 . 2]"
153 . 1 90 GLY N 1 90 GLY CA 1 90 GLY C 1 91 ASP N -39.32 4.16 -3.31 -19.70 4.49 0.33 9 0 "[ . 1 . 2]"
154 . 1 92 TYR N 1 92 TYR CA 1 92 TYR C 1 93 VAL N 120.30 176.54 137.38 138.19 134.51 . . 0 "[ . 1 . 2]"
155 . 1 93 VAL N 1 93 VAL CA 1 93 VAL C 1 94 GLU N 122.34 162.30 145.08 127.32 161.42 . . 0 "[ . 1 . 2]"
156 . 1 94 GLU N 1 94 GLU CA 1 94 GLU C 1 95 ASP N 142.71 -176.97 150.69 152.41 151.49 . . 0 "[ . 1 . 2]"
157 . 1 95 ASP N 1 95 ASP CA 1 95 ASP C 1 96 GLN N 106.68 152.92 149.45 146.36 152.93 0.01 10 0 "[ . 1 . 2]"
158 . 1 96 GLN N 1 96 GLN CA 1 96 GLN C 1 97 ILE N 103.74 159.82 133.74 137.62 135.14 . . 0 "[ . 1 . 2]"
159 . 1 97 ILE N 1 97 ILE CA 1 97 ILE C 1 98 GLU N 128.13 -158.51 159.56 151.16 167.32 . . 0 "[ . 1 . 2]"
160 . 1 99 SER N 1 99 SER CA 1 99 SER C 1 100 VAL N 118.30 -167.78 159.18 161.61 161.18 . . 0 "[ . 1 . 2]"
161 . 1 109 THR N 1 109 THR CA 1 109 THR C 1 110 ALA N -52.03 -31.39 -38.67 -31.40 -34.03 . . 0 "[ . 1 . 2]"
162 . 1 110 ALA N 1 110 ALA CA 1 110 ALA C 1 111 LYS N -52.79 -25.67 -34.47 -46.49 -25.67 0.00 9 0 "[ . 1 . 2]"
163 . 1 111 LYS N 1 111 LYS CA 1 111 LYS C 1 112 GLN N -55.47 -29.35 -32.78 -29.49 -29.88 0.17 15 0 "[ . 1 . 2]"
164 . 1 112 GLN N 1 112 GLN CA 1 112 GLN C 1 113 VAL N -51.79 -25.43 -38.12 -41.00 -42.43 . . 0 "[ . 1 . 2]"
165 . 1 113 VAL N 1 113 VAL CA 1 113 VAL C 1 114 ILE N -64.53 -17.85 -33.75 -24.50 -30.60 . . 0 "[ . 1 . 2]"
166 . 1 114 ILE N 1 114 ILE CA 1 114 ILE C 1 115 VAL N -55.91 -31.59 -42.12 -47.75 -35.07 . . 0 "[ . 1 . 2]"
167 . 1 115 VAL N 1 115 VAL CA 1 115 VAL C 1 116 GLN N -55.69 -28.29 -41.85 -40.74 -42.12 . . 0 "[ . 1 . 2]"
168 . 1 116 GLN N 1 116 GLN CA 1 116 GLN C 1 117 LYS N -53.42 -29.90 -45.13 -43.04 -43.92 . . 0 "[ . 1 . 2]"
169 . 1 117 LYS N 1 117 LYS CA 1 117 LYS C 1 118 VAL N -57.20 -21.00 -40.82 -41.70 -42.51 . . 0 "[ . 1 . 2]"
170 . 1 118 VAL N 1 118 VAL CA 1 118 VAL C 1 119 ARG N -55.26 -31.90 -38.12 -46.02 -31.85 0.05 9 0 "[ . 1 . 2]"
171 . 1 119 ARG N 1 119 ARG CA 1 119 ARG C 1 120 GLU N -52.19 -26.71 -36.39 -40.24 -41.78 . . 0 "[ . 1 . 2]"
172 . 1 120 GLU N 1 120 GLU CA 1 120 GLU C 1 121 ALA N -62.33 -21.81 -32.01 -31.62 -32.48 . . 0 "[ . 1 . 2]"
173 . 1 121 ALA N 1 121 ALA CA 1 121 ALA C 1 122 GLU N -56.91 -25.19 -33.99 -47.33 -25.90 . . 0 "[ . 1 . 2]"
174 . 1 122 GLU N 1 122 GLU CA 1 122 GLU C 1 123 ARG N -52.83 -28.83 -34.04 -31.40 -32.65 . . 0 "[ . 1 . 2]"
175 . 1 123 ARG N 1 123 ARG CA 1 123 ARG C 1 124 ALA N -81.28 25.96 -38.00 -45.63 -32.37 . . 0 "[ . 1 . 2]"
176 . 1 9 VAL N 1 9 VAL CA 1 9 VAL CB 1 9 VAL CG1 150.00 -150.00 -177.03 -175.73 -176.04 . . 0 "[ . 1 . 2]"
177 . 1 9 VAL C 1 9 VAL CA 1 9 VAL CB 1 9 VAL CG2 150.00 -150.00 -177.14 -175.79 -176.17 . . 0 "[ . 1 . 2]"
178 . 1 43 ILE C 1 43 ILE CA 1 43 ILE CB 1 43 ILE CG2 150.00 -150.00 -173.22 -170.95 -171.30 . . 0 "[ . 1 . 2]"
179 . 1 64 VAL C 1 64 VAL CA 1 64 VAL CB 1 64 VAL CG1 150.00 -150.00 69.75 71.39 71.28 88.90 8 20 [*******+***********-]
180 . 1 64 VAL N 1 64 VAL CA 1 64 VAL CB 1 64 VAL CG2 150.00 -150.00 -50.26 -48.72 -49.00 109.57 20 20 [*******-***********+]
181 . 1 45 VAL C 1 45 VAL CA 1 45 VAL CB 1 45 VAL CG1 150.00 -150.00 56.00 49.36 65.34 100.64 18 20 [*****************+*-]
182 . 1 76 THR C 1 76 THR CA 1 76 THR CB 1 76 THR CG2 150.00 -150.00 174.07 177.19 171.65 0.10 7 0 "[ . 1 . 2]"
183 . 1 72 THR C 1 72 THR CA 1 72 THR CB 1 72 THR CG2 150.00 -150.00 -174.25 -171.77 -172.14 . . 0 "[ . 1 . 2]"
184 . 1 65 VAL C 1 65 VAL CA 1 65 VAL CB 1 65 VAL CG1 150.00 -150.00 91.62 60.80 168.25 89.20 10 13 "[ * *-***+ *** ** *]"
stop_
save_
Contact the webmaster for help, if required. Friday, May 3, 2024 12:53:34 PM GMT (wattos1)