NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
433556 |
2jv2   |
15465 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2jv2
save_distance_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 484
_TA_constraint_stats_list.Viol_total 5838.13
_TA_constraint_stats_list.Viol_max 1.85
_TA_constraint_stats_list.Viol_rms 0.23
_TA_constraint_stats_list.Viol_average_all_restraints 0.06
_TA_constraint_stats_list.Viol_average_violations_only 0.55
_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 11 ILE C 1 12 MET N 1 12 MET CA 1 12 MET C -145.00 -77.00 -102.13 -90.56 -145.42 0.60 1 0 "[ . 1 . 2 ]"
2 . 1 12 MET N 1 12 MET CA 1 12 MET C 1 13 SER N 105.00 -177.00 117.37 111.50 137.57 . . 0 "[ . 1 . 2 ]"
3 . 1 12 MET C 1 13 SER N 1 13 SER CA 1 13 SER C -131.00 -69.00 -108.16 -76.89 -91.88 0.06 7 0 "[ . 1 . 2 ]"
4 . 1 13 SER N 1 13 SER CA 1 13 SER C 1 14 GLU N 116.00 164.00 152.57 141.00 164.10 0.10 12 0 "[ . 1 . 2 ]"
5 . 1 13 SER C 1 14 GLU N 1 14 GLU CA 1 14 GLU C -159.00 -123.00 -151.32 -153.20 -153.21 . . 0 "[ . 1 . 2 ]"
6 . 1 14 GLU N 1 14 GLU CA 1 14 GLU C 1 15 LEU N 124.00 164.00 148.71 151.48 150.47 . . 0 "[ . 1 . 2 ]"
7 . 1 14 GLU C 1 15 LEU N 1 15 LEU CA 1 15 LEU C -161.00 -113.00 -126.08 -131.53 -118.98 . . 0 "[ . 1 . 2 ]"
8 . 1 15 LEU N 1 15 LEU CA 1 15 LEU C 1 16 LYS N 120.00 162.00 127.48 120.63 132.01 . . 0 "[ . 1 . 2 ]"
9 . 1 15 LEU C 1 16 LYS N 1 16 LYS CA 1 16 LYS C -139.00 -97.00 -103.44 -104.35 -104.69 . . 0 "[ . 1 . 2 ]"
10 . 1 16 LYS N 1 16 LYS CA 1 16 LYS C 1 17 LEU N 113.00 151.00 124.81 131.97 131.58 . . 0 "[ . 1 . 2 ]"
11 . 1 16 LYS C 1 17 LEU N 1 17 LEU CA 1 17 LEU C -150.00 -114.00 -120.42 -128.21 -113.78 0.22 20 0 "[ . 1 . 2 ]"
12 . 1 17 LEU N 1 17 LEU CA 1 17 LEU C 1 18 LYS N 129.00 169.00 153.42 153.79 153.57 . . 0 "[ . 1 . 2 ]"
13 . 1 17 LEU C 1 18 LYS N 1 18 LYS CA 1 18 LYS C -151.00 -121.00 -131.18 -132.53 -133.34 . . 0 "[ . 1 . 2 ]"
14 . 1 18 LYS N 1 18 LYS CA 1 18 LYS C 1 19 PRO N 129.00 169.00 131.18 128.90 128.83 0.46 21 0 "[ . 1 . 2 ]"
15 . 1 18 LYS C 1 19 PRO N 1 19 PRO CA 1 19 PRO C -92.00 -50.00 -74.83 -77.49 -68.79 . . 0 "[ . 1 . 2 ]"
16 . 1 19 PRO N 1 19 PRO CA 1 19 PRO C 1 20 LEU N 110.00 164.00 140.07 141.21 140.67 . . 0 "[ . 1 . 2 ]"
17 . 1 22 LYS C 1 23 VAL N 1 23 VAL CA 1 23 VAL C -151.00 -93.00 -146.25 -146.13 -146.68 . . 0 "[ . 1 . 2 ]"
18 . 1 23 VAL N 1 23 VAL CA 1 23 VAL C 1 24 GLU N 127.00 179.00 142.27 140.06 144.33 . . 0 "[ . 1 . 2 ]"
19 . 1 24 GLU C 1 25 LEU N 1 25 LEU CA 1 25 LEU C -113.00 -59.00 -93.50 -94.41 -92.66 . . 0 "[ . 1 . 2 ]"
20 . 1 25 LEU N 1 25 LEU CA 1 25 LEU C 1 26 PRO N 128.00 168.00 136.69 127.81 151.30 0.19 8 0 "[ . 1 . 2 ]"
21 . 1 25 LEU C 1 26 PRO N 1 26 PRO CA 1 26 PRO C -71.00 -51.00 -58.70 -57.99 -58.38 . . 0 "[ . 1 . 2 ]"
22 . 1 26 PRO N 1 26 PRO CA 1 26 PRO C 1 27 PRO N 132.00 166.00 165.20 165.89 165.26 0.42 11 0 "[ . 1 . 2 ]"
23 . 1 26 PRO C 1 27 PRO N 1 27 PRO CA 1 27 PRO C -72.00 -46.00 -65.99 -66.44 -66.62 . . 0 "[ . 1 . 2 ]"
24 . 1 27 PRO N 1 27 PRO CA 1 27 PRO C 1 28 ASP N -48.00 -10.00 -10.12 -9.44 -9.48 0.79 8 0 "[ . 1 . 2 ]"
25 . 1 28 ASP C 1 29 PHE N 1 29 PHE CA 1 29 PHE C -75.00 -51.00 -59.83 -60.38 -58.91 . . 0 "[ . 1 . 2 ]"
26 . 1 29 PHE N 1 29 PHE CA 1 29 PHE C 1 30 VAL N -54.00 -30.00 -45.65 -44.59 -44.89 0.17 19 0 "[ . 1 . 2 ]"
27 . 1 29 PHE C 1 30 VAL N 1 30 VAL CA 1 30 VAL C -74.00 -54.00 -58.58 -59.43 -54.93 . . 0 "[ . 1 . 2 ]"
28 . 1 30 VAL N 1 30 VAL CA 1 30 VAL C 1 31 ASP N -53.00 -33.00 -33.80 -33.01 -33.05 0.23 9 0 "[ . 1 . 2 ]"
29 . 1 30 VAL C 1 31 ASP N 1 31 ASP CA 1 31 ASP C -70.00 -48.00 -69.51 -70.26 -64.17 0.26 4 0 "[ . 1 . 2 ]"
30 . 1 31 ASP N 1 31 ASP CA 1 31 ASP C 1 32 VAL N -53.00 -23.00 -41.89 -42.22 -42.26 . . 0 "[ . 1 . 2 ]"
31 . 1 31 ASP C 1 32 VAL N 1 32 VAL CA 1 32 VAL C -79.00 -55.00 -68.84 -69.45 -68.48 . . 0 "[ . 1 . 2 ]"
32 . 1 32 VAL N 1 32 VAL CA 1 32 VAL C 1 33 ILE N -52.00 -36.00 -40.13 -41.30 -39.45 . . 0 "[ . 1 . 2 ]"
33 . 1 32 VAL C 1 33 ILE N 1 33 ILE CA 1 33 ILE C -75.00 -53.00 -63.41 -64.31 -62.69 . . 0 "[ . 1 . 2 ]"
34 . 1 33 ILE N 1 33 ILE CA 1 33 ILE C 1 34 ARG N -60.00 -32.00 -42.84 -42.95 -43.14 . . 0 "[ . 1 . 2 ]"
35 . 1 33 ILE C 1 34 ARG N 1 34 ARG CA 1 34 ARG C -65.00 -47.00 -59.08 -58.58 -58.66 . . 0 "[ . 1 . 2 ]"
36 . 1 34 ARG N 1 34 ARG CA 1 34 ARG C 1 35 ILE N -54.00 -34.00 -41.74 -41.21 -41.59 . . 0 "[ . 1 . 2 ]"
37 . 1 34 ARG C 1 35 ILE N 1 35 ILE CA 1 35 ILE C -75.00 -51.00 -65.78 -66.57 -65.35 . . 0 "[ . 1 . 2 ]"
38 . 1 35 ILE N 1 35 ILE CA 1 35 ILE C 1 36 LYS N -51.00 -23.00 -42.27 -42.36 -42.57 . . 0 "[ . 1 . 2 ]"
39 . 1 35 ILE C 1 36 LYS N 1 36 LYS CA 1 36 LYS C -79.00 -57.00 -65.79 -68.30 -64.22 . . 0 "[ . 1 . 2 ]"
40 . 1 36 LYS N 1 36 LYS CA 1 36 LYS C 1 37 LEU N -44.00 -18.00 -41.60 -42.31 -42.40 0.13 7 0 "[ . 1 . 2 ]"
41 . 1 38 GLN C 1 39 GLY N 1 39 GLY CA 1 39 GLY C 79.00 109.00 96.22 95.77 96.73 . . 0 "[ . 1 . 2 ]"
42 . 1 39 GLY N 1 39 GLY CA 1 39 GLY C 1 40 LYS N -30.00 0.00 -26.62 -26.62 -26.75 . . 0 "[ . 1 . 2 ]"
43 . 1 39 GLY C 1 40 LYS N 1 40 LYS CA 1 40 LYS C -111.00 -61.00 -89.54 -89.47 -89.49 . . 0 "[ . 1 . 2 ]"
44 . 1 40 LYS N 1 40 LYS CA 1 40 LYS C 1 41 THR N 113.00 155.00 154.80 155.04 155.00 0.17 20 0 "[ . 1 . 2 ]"
45 . 1 40 LYS C 1 41 THR N 1 41 THR CA 1 41 THR C -129.00 -87.00 -99.46 -99.26 -99.44 . . 0 "[ . 1 . 2 ]"
46 . 1 41 THR N 1 41 THR CA 1 41 THR C 1 42 VAL N 117.00 161.00 148.29 146.92 151.27 . . 0 "[ . 1 . 2 ]"
47 . 1 41 THR C 1 42 VAL N 1 42 VAL CA 1 42 VAL C -151.00 -117.00 -130.99 -134.96 -128.71 . . 0 "[ . 1 . 2 ]"
48 . 1 42 VAL N 1 42 VAL CA 1 42 VAL C 1 43 ARG N 135.00 171.00 142.69 139.60 146.39 . . 0 "[ . 1 . 2 ]"
49 . 1 42 VAL C 1 43 ARG N 1 43 ARG CA 1 43 ARG C -136.00 -98.00 -135.03 -136.26 -132.76 0.26 16 0 "[ . 1 . 2 ]"
50 . 1 43 ARG N 1 43 ARG CA 1 43 ARG C 1 44 THR N 106.00 156.00 148.91 149.09 148.82 . . 0 "[ . 1 . 2 ]"
51 . 1 43 ARG C 1 44 THR N 1 44 THR CA 1 44 THR C -69.00 -41.00 -55.06 -55.61 -54.49 . . 0 "[ . 1 . 2 ]"
52 . 1 44 THR N 1 44 THR CA 1 44 THR C 1 45 GLY N 122.00 142.00 138.04 137.86 137.70 . . 0 "[ . 1 . 2 ]"
53 . 1 44 THR C 1 45 GLY N 1 45 GLY CA 1 45 GLY C 86.00 106.00 98.98 98.14 99.88 . . 0 "[ . 1 . 2 ]"
54 . 1 45 GLY N 1 45 GLY CA 1 45 GLY C 1 46 ASP N -17.00 9.00 -17.69 -17.89 -17.37 0.89 22 0 "[ . 1 . 2 ]"
55 . 1 45 GLY C 1 46 ASP N 1 46 ASP CA 1 46 ASP C -95.00 -59.00 -64.15 -64.91 -62.73 . . 0 "[ . 1 . 2 ]"
56 . 1 46 ASP N 1 46 ASP CA 1 46 ASP C 1 47 VAL N 125.00 153.00 152.06 151.02 153.07 0.07 21 0 "[ . 1 . 2 ]"
57 . 1 46 ASP C 1 47 VAL N 1 47 VAL CA 1 47 VAL C -134.00 -88.00 -132.87 -133.82 -133.96 0.10 16 0 "[ . 1 . 2 ]"
58 . 1 47 VAL N 1 47 VAL CA 1 47 VAL C 1 48 ILE N 118.00 158.00 131.86 129.39 135.69 . . 0 "[ . 1 . 2 ]"
59 . 1 47 VAL C 1 48 ILE N 1 48 ILE CA 1 48 ILE C -147.00 -87.00 -137.57 -138.18 -136.93 . . 0 "[ . 1 . 2 ]"
60 . 1 48 ILE N 1 48 ILE CA 1 48 ILE C 1 49 GLY N 124.00 162.00 150.75 150.63 149.73 . . 0 "[ . 1 . 2 ]"
61 . 1 48 ILE C 1 49 GLY N 1 49 GLY CA 1 49 GLY C -157.00 -101.00 -109.11 -110.89 -107.44 . . 0 "[ . 1 . 2 ]"
62 . 1 49 GLY N 1 49 GLY CA 1 49 GLY C 1 50 ILE N 108.00 158.00 140.22 140.18 139.02 . . 0 "[ . 1 . 2 ]"
63 . 1 49 GLY C 1 50 ILE N 1 50 ILE CA 1 50 ILE C -141.00 -93.00 -126.73 -124.55 -125.80 . . 0 "[ . 1 . 2 ]"
64 . 1 50 ILE N 1 50 ILE CA 1 50 ILE C 1 51 SER N 112.00 150.00 135.72 133.58 132.56 . . 0 "[ . 1 . 2 ]"
65 . 1 50 ILE C 1 51 SER N 1 51 SER CA 1 51 SER C -116.00 -72.00 -89.59 -90.57 -88.61 . . 0 "[ . 1 . 2 ]"
66 . 1 51 SER N 1 51 SER CA 1 51 SER C 1 52 ILE N 114.00 146.00 121.59 117.35 129.87 . . 0 "[ . 1 . 2 ]"
67 . 1 51 SER C 1 52 ILE N 1 52 ILE CA 1 52 ILE C -148.00 -92.00 -129.03 -126.68 -128.78 . . 0 "[ . 1 . 2 ]"
68 . 1 52 ILE N 1 52 ILE CA 1 52 ILE C 1 53 LEU N 113.00 149.00 127.36 121.31 137.55 . . 0 "[ . 1 . 2 ]"
69 . 1 52 ILE C 1 53 LEU N 1 53 LEU CA 1 53 LEU C 44.00 64.00 51.56 51.06 52.68 . . 0 "[ . 1 . 2 ]"
70 . 1 53 LEU N 1 53 LEU CA 1 53 LEU C 1 54 GLY N 33.00 49.00 32.79 32.64 32.62 0.48 6 0 "[ . 1 . 2 ]"
71 . 1 53 LEU C 1 54 GLY N 1 54 GLY CA 1 54 GLY C 60.00 84.00 77.75 78.03 77.95 . . 0 "[ . 1 . 2 ]"
72 . 1 54 GLY N 1 54 GLY CA 1 54 GLY C 1 55 LYS N -10.00 34.00 23.77 23.98 23.86 . . 0 "[ . 1 . 2 ]"
73 . 1 54 GLY C 1 55 LYS N 1 55 LYS CA 1 55 LYS C -144.00 -88.00 -134.73 -131.93 -133.00 . . 0 "[ . 1 . 2 ]"
74 . 1 55 LYS N 1 55 LYS CA 1 55 LYS C 1 56 GLU N 126.00 166.00 130.26 128.67 128.43 0.19 5 0 "[ . 1 . 2 ]"
75 . 1 56 GLU C 1 57 VAL N 1 57 VAL CA 1 57 VAL C -135.00 -87.00 -126.87 -128.97 -124.17 . . 0 "[ . 1 . 2 ]"
76 . 1 57 VAL N 1 57 VAL CA 1 57 VAL C 1 58 LYS N 107.00 157.00 132.29 130.90 133.95 . . 0 "[ . 1 . 2 ]"
77 . 1 57 VAL C 1 58 LYS N 1 58 LYS CA 1 58 LYS C -121.00 -77.00 -95.51 -96.65 -97.00 . . 0 "[ . 1 . 2 ]"
78 . 1 58 LYS N 1 58 LYS CA 1 58 LYS C 1 59 PHE N 113.00 161.00 132.50 127.01 136.30 . . 0 "[ . 1 . 2 ]"
79 . 1 58 LYS C 1 59 PHE N 1 59 PHE CA 1 59 PHE C -134.00 -108.00 -117.51 -123.52 -112.64 . . 0 "[ . 1 . 2 ]"
80 . 1 59 PHE N 1 59 PHE CA 1 59 PHE C 1 60 LYS N 132.00 166.00 131.69 131.78 131.72 0.66 20 0 "[ . 1 . 2 ]"
81 . 1 59 PHE C 1 60 LYS N 1 60 LYS CA 1 60 LYS C -142.00 -94.00 -104.01 -104.29 -104.48 . . 0 "[ . 1 . 2 ]"
82 . 1 60 LYS N 1 60 LYS CA 1 60 LYS C 1 61 VAL N 104.00 156.00 140.35 134.04 143.93 . . 0 "[ . 1 . 2 ]"
83 . 1 60 LYS C 1 61 VAL N 1 61 VAL CA 1 61 VAL C -105.00 -63.00 -83.43 -84.36 -84.36 . . 0 "[ . 1 . 2 ]"
84 . 1 61 VAL N 1 61 VAL CA 1 61 VAL C 1 62 VAL N 97.00 173.00 113.91 115.72 115.59 . . 0 "[ . 1 . 2 ]"
85 . 1 63 GLN C 1 64 ALA N 1 64 ALA CA 1 64 ALA C -156.00 -102.00 -103.55 -103.97 -105.42 0.20 22 0 "[ . 1 . 2 ]"
86 . 1 64 ALA N 1 64 ALA CA 1 64 ALA C 1 65 TYR N 112.00 162.00 134.26 133.32 132.61 . . 0 "[ . 1 . 2 ]"
87 . 1 64 ALA C 1 65 TYR N 1 65 TYR CA 1 65 TYR C -129.00 -69.00 -129.34 -129.11 -129.14 0.73 22 0 "[ . 1 . 2 ]"
88 . 1 65 TYR N 1 65 TYR CA 1 65 TYR C 1 66 PRO N 106.00 148.00 117.32 115.63 115.47 . . 0 "[ . 1 . 2 ]"
89 . 1 65 TYR C 1 66 PRO N 1 66 PRO CA 1 66 PRO C -78.00 -50.00 -73.41 -75.38 -71.22 . . 0 "[ . 1 . 2 ]"
90 . 1 66 PRO N 1 66 PRO CA 1 66 PRO C 1 67 SER N 135.00 163.00 163.57 163.19 163.95 0.95 7 0 "[ . 1 . 2 ]"
91 . 1 66 PRO C 1 67 SER N 1 67 SER CA 1 67 SER C -147.00 -103.00 -102.24 -102.58 -101.96 1.04 4 0 "[ . 1 . 2 ]"
92 . 1 67 SER N 1 67 SER CA 1 67 SER C 1 68 PRO N 79.00 159.00 142.41 139.80 144.39 . . 0 "[ . 1 . 2 ]"
93 . 1 67 SER C 1 68 PRO N 1 68 PRO CA 1 68 PRO C -88.00 -54.00 -71.94 -74.01 -70.28 . . 0 "[ . 1 . 2 ]"
94 . 1 68 PRO N 1 68 PRO CA 1 68 PRO C 1 69 LEU N 127.00 171.00 162.80 160.75 165.00 . . 0 "[ . 1 . 2 ]"
95 . 1 68 PRO C 1 69 LEU N 1 69 LEU CA 1 69 LEU C -144.00 -84.00 -142.54 -143.74 -141.39 . . 0 "[ . 1 . 2 ]"
96 . 1 69 LEU N 1 69 LEU CA 1 69 LEU C 1 70 ARG N 107.00 155.00 155.83 155.70 155.70 1.12 16 0 "[ . 1 . 2 ]"
97 . 1 69 LEU C 1 70 ARG N 1 70 ARG CA 1 70 ARG C -131.00 -83.00 -91.63 -92.32 -92.47 . . 0 "[ . 1 . 2 ]"
98 . 1 70 ARG N 1 70 ARG CA 1 70 ARG C 1 71 VAL N 103.00 149.00 142.52 143.47 142.80 . . 0 "[ . 1 . 2 ]"
99 . 1 71 VAL C 1 72 GLU N 1 72 GLU CA 1 72 GLU C -131.00 -85.00 -131.16 -131.18 -131.21 0.35 1 0 "[ . 1 . 2 ]"
100 . 1 72 GLU N 1 72 GLU CA 1 72 GLU C 1 73 ASP N 115.00 -177.00 170.00 163.62 179.56 . . 0 "[ . 1 . 2 ]"
101 . 1 73 ASP C 1 74 ARG N 1 74 ARG CA 1 74 ARG C -111.00 -65.00 -82.41 -84.30 -80.28 . . 0 "[ . 1 . 2 ]"
102 . 1 74 ARG N 1 74 ARG CA 1 74 ARG C 1 75 THR N -20.00 12.00 -20.58 -20.88 -20.31 0.88 12 0 "[ . 1 . 2 ]"
103 . 1 76 LYS C 1 77 ILE N 1 77 ILE CA 1 77 ILE C -126.00 -84.00 -125.22 -126.10 -126.10 0.27 13 0 "[ . 1 . 2 ]"
104 . 1 77 ILE N 1 77 ILE CA 1 77 ILE C 1 78 THR N 114.00 150.00 135.23 129.95 139.99 . . 0 "[ . 1 . 2 ]"
105 . 1 77 ILE C 1 78 THR N 1 78 THR CA 1 78 THR C -148.00 -102.00 -126.46 -126.51 -126.97 . . 0 "[ . 1 . 2 ]"
106 . 1 78 THR N 1 78 THR CA 1 78 THR C 1 79 LEU N 115.00 151.00 141.81 140.85 139.97 . . 0 "[ . 1 . 2 ]"
107 . 1 78 THR C 1 79 LEU N 1 79 LEU CA 1 79 LEU C -123.00 -89.00 -99.27 -99.11 -99.40 . . 0 "[ . 1 . 2 ]"
108 . 1 79 LEU N 1 79 LEU CA 1 79 LEU C 1 80 VAL N 111.00 147.00 126.06 128.04 127.60 . . 0 "[ . 1 . 2 ]"
109 . 1 79 LEU C 1 80 VAL N 1 80 VAL CA 1 80 VAL C -117.00 -83.00 -94.36 -94.23 -94.41 . . 0 "[ . 1 . 2 ]"
110 . 1 80 VAL N 1 80 VAL CA 1 80 VAL C 1 81 THR N 103.00 155.00 138.18 125.04 148.88 . . 0 "[ . 1 . 2 ]"
111 . 1 8 GLU C 1 9 GLY N 1 9 GLY CA 1 9 GLY C 60.00 -60.00 -172.36 64.69 -69.04 . . 0 "[ . 1 . 2 ]"
112 . 1 8 GLU C 1 9 GLY N 1 9 GLY CA 1 9 GLY C -150.00 150.00 -172.36 64.69 -69.04 0.16 18 0 "[ . 1 . 2 ]"
113 . 1 9 GLY N 1 9 GLY CA 1 9 GLY C 1 10 VAL N -40.00 -140.00 172.65 -168.83 178.98 0.23 11 0 "[ . 1 . 2 ]"
114 . 1 9 GLY N 1 9 GLY CA 1 9 GLY C 1 10 VAL N 130.00 70.00 172.65 -168.83 178.98 0.30 14 0 "[ . 1 . 2 ]"
115 . 1 81 THR C 1 82 HIS N 1 82 HIS CA 1 82 HIS C -155.00 -65.00 -121.26 -151.20 -99.71 . . 0 "[ . 1 . 2 ]"
116 . 1 82 HIS N 1 82 HIS CA 1 82 HIS C 1 83 PRO N -60.00 -170.00 108.70 91.39 158.87 . . 0 "[ . 1 . 2 ]"
117 . 1 15 LEU N 1 15 LEU CA 1 15 LEU CB 1 15 LEU CG 150.00 -30.00 -164.82 -171.23 -70.18 . . 0 "[ . 1 . 2 ]"
118 . 1 15 LEU N 1 15 LEU CA 1 15 LEU CB 1 15 LEU CG -90.00 -150.00 -164.82 -171.23 -70.18 . . 0 "[ . 1 . 2 ]"
119 . 1 15 LEU CA 1 15 LEU CB 1 15 LEU CG 1 15 LEU CD1 30.00 -150.00 89.60 72.41 168.90 . . 0 "[ . 1 . 2 ]"
120 . 1 15 LEU CA 1 15 LEU CB 1 15 LEU CG 1 15 LEU CD1 150.00 90.00 89.60 72.41 168.90 . . 0 "[ . 1 . 2 ]"
121 . 1 53 LEU N 1 53 LEU CA 1 53 LEU CB 1 53 LEU CG 150.00 -30.00 -73.35 -149.26 -65.36 . . 0 "[ . 1 . 2 ]"
122 . 1 53 LEU N 1 53 LEU CA 1 53 LEU CB 1 53 LEU CG -90.00 -150.00 -73.35 -149.26 -65.36 0.87 9 0 "[ . 1 . 2 ]"
123 . 1 53 LEU CA 1 53 LEU CB 1 53 LEU CG 1 53 LEU CD1 30.00 -150.00 158.11 167.84 167.78 . . 0 "[ . 1 . 2 ]"
124 . 1 53 LEU CA 1 53 LEU CB 1 53 LEU CG 1 53 LEU CD1 150.00 90.00 158.11 167.84 167.78 0.15 9 0 "[ . 1 . 2 ]"
125 . 1 79 LEU N 1 79 LEU CA 1 79 LEU CB 1 79 LEU CG 150.00 -30.00 -67.88 -67.75 -67.84 . . 0 "[ . 1 . 2 ]"
126 . 1 79 LEU N 1 79 LEU CA 1 79 LEU CB 1 79 LEU CG -90.00 -150.00 -67.88 -67.75 -67.84 . . 0 "[ . 1 . 2 ]"
127 . 1 79 LEU CA 1 79 LEU CB 1 79 LEU CG 1 79 LEU CD1 30.00 -150.00 165.76 161.64 168.05 . . 0 "[ . 1 . 2 ]"
128 . 1 79 LEU CA 1 79 LEU CB 1 79 LEU CG 1 79 LEU CD1 150.00 90.00 165.76 161.64 168.05 . . 0 "[ . 1 . 2 ]"
129 . 1 10 VAL N 1 10 VAL CA 1 10 VAL CB 1 10 VAL CG1 150.00 -150.00 -179.27 177.29 -178.80 . . 0 "[ . 1 . 2 ]"
130 . 1 11 ILE N 1 11 ILE CA 1 11 ILE CB 1 11 ILE CG1 -90.00 -30.00 -59.86 -62.07 -57.20 . . 0 "[ . 1 . 2 ]"
131 . 1 12 MET N 1 12 MET CA 1 12 MET CB 1 12 MET CG 30.00 90.00 62.77 60.91 59.89 . . 0 "[ . 1 . 2 ]"
132 . 1 13 SER N 1 13 SER CA 1 13 SER CB 1 13 SER OG 30.00 90.00 56.48 47.92 66.28 . . 0 "[ . 1 . 2 ]"
133 . 1 16 LYS N 1 16 LYS CA 1 16 LYS CB 1 16 LYS CG -90.00 -30.00 -87.70 -86.20 -86.25 0.25 22 0 "[ . 1 . 2 ]"
134 . 1 17 LEU N 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG -90.00 -30.00 -66.66 -67.81 -67.81 . . 0 "[ . 1 . 2 ]"
135 . 1 18 LYS N 1 18 LYS CA 1 18 LYS CB 1 18 LYS CG 150.00 -150.00 -171.02 -170.75 -170.83 . . 0 "[ . 1 . 2 ]"
136 . 1 20 LEU N 1 20 LEU CA 1 20 LEU CB 1 20 LEU CG -90.00 -30.00 -68.09 -69.21 -70.08 . . 0 "[ . 1 . 2 ]"
137 . 1 23 VAL N 1 23 VAL CA 1 23 VAL CB 1 23 VAL CG1 30.00 90.00 62.03 61.92 62.13 . . 0 "[ . 1 . 2 ]"
138 . 1 25 LEU N 1 25 LEU CA 1 25 LEU CB 1 25 LEU CG -90.00 -30.00 -69.47 -67.46 -67.62 . . 0 "[ . 1 . 2 ]"
139 . 1 26 PRO N 1 26 PRO CA 1 26 PRO CB 1 26 PRO CG -45.00 -15.00 -22.19 -23.28 -21.17 . . 0 "[ . 1 . 2 ]"
140 . 1 27 PRO N 1 27 PRO CA 1 27 PRO CB 1 27 PRO CG -45.00 -15.00 -17.23 -19.16 -16.74 . . 0 "[ . 1 . 2 ]"
141 . 1 28 ASP N 1 28 ASP CA 1 28 ASP CB 1 28 ASP CG 30.00 90.00 60.43 59.22 63.10 . . 0 "[ . 1 . 2 ]"
142 . 1 29 PHE N 1 29 PHE CA 1 29 PHE CB 1 29 PHE CG -90.00 -30.00 -90.62 -90.57 -90.66 1.01 4 0 "[ . 1 . 2 ]"
143 . 1 32 VAL N 1 32 VAL CA 1 32 VAL CB 1 32 VAL CG1 150.00 -150.00 -178.66 -178.51 -178.55 . . 0 "[ . 1 . 2 ]"
144 . 1 33 ILE N 1 33 ILE CA 1 33 ILE CB 1 33 ILE CG1 -90.00 -30.00 -61.64 -62.48 -60.99 . . 0 "[ . 1 . 2 ]"
145 . 1 35 ILE N 1 35 ILE CA 1 35 ILE CB 1 35 ILE CG1 -90.00 -30.00 -62.23 -62.06 -62.08 . . 0 "[ . 1 . 2 ]"
146 . 1 37 LEU N 1 37 LEU CA 1 37 LEU CB 1 37 LEU CG -90.00 -30.00 -74.39 -87.72 -67.06 . . 0 "[ . 1 . 2 ]"
147 . 1 40 LYS N 1 40 LYS CA 1 40 LYS CB 1 40 LYS CG -90.00 -30.00 -66.87 -66.95 -66.99 . . 0 "[ . 1 . 2 ]"
148 . 1 41 THR N 1 41 THR CA 1 41 THR CB 1 41 THR OG1 -90.00 -30.00 -49.83 -49.99 -50.06 . . 0 "[ . 1 . 2 ]"
149 . 1 42 VAL N 1 42 VAL CA 1 42 VAL CB 1 42 VAL CG1 -90.00 -30.00 -64.29 -64.55 -63.93 . . 0 "[ . 1 . 2 ]"
150 . 1 44 THR N 1 44 THR CA 1 44 THR CB 1 44 THR OG1 -90.00 -30.00 -47.82 -48.38 -48.62 . . 0 "[ . 1 . 2 ]"
151 . 1 46 ASP N 1 46 ASP CA 1 46 ASP CB 1 46 ASP CG -90.00 -30.00 -70.30 -69.43 -69.68 . . 0 "[ . 1 . 2 ]"
152 . 1 47 VAL N 1 47 VAL CA 1 47 VAL CB 1 47 VAL CG1 150.00 -150.00 -179.13 -179.15 -179.17 . . 0 "[ . 1 . 2 ]"
153 . 1 48 ILE N 1 48 ILE CA 1 48 ILE CB 1 48 ILE CG1 30.00 90.00 58.29 58.26 58.18 . . 0 "[ . 1 . 2 ]"
154 . 1 48 ILE CA 1 48 ILE CB 1 48 ILE CG1 1 48 ILE CD1 30.00 90.00 88.18 87.09 90.20 0.20 7 0 "[ . 1 . 2 ]"
155 . 1 50 ILE N 1 50 ILE CA 1 50 ILE CB 1 50 ILE CG1 -90.00 -30.00 -60.59 -61.70 -59.90 . . 0 "[ . 1 . 2 ]"
156 . 1 52 ILE N 1 52 ILE CA 1 52 ILE CB 1 52 ILE CG1 -90.00 -30.00 -59.49 -60.91 -57.83 . . 0 "[ . 1 . 2 ]"
157 . 1 57 VAL N 1 57 VAL CA 1 57 VAL CB 1 57 VAL CG1 30.00 90.00 59.59 58.66 58.49 . . 0 "[ . 1 . 2 ]"
158 . 1 58 LYS N 1 58 LYS CA 1 58 LYS CB 1 58 LYS CG -90.00 -30.00 -67.50 -68.35 -66.60 . . 0 "[ . 1 . 2 ]"
159 . 1 59 PHE N 1 59 PHE CA 1 59 PHE CB 1 59 PHE CG -90.00 -30.00 -75.86 -77.12 -77.42 . . 0 "[ . 1 . 2 ]"
160 . 1 60 LYS N 1 60 LYS CA 1 60 LYS CB 1 60 LYS CG 150.00 -150.00 -170.54 -169.53 -169.55 . . 0 "[ . 1 . 2 ]"
161 . 1 61 VAL N 1 61 VAL CA 1 61 VAL CB 1 61 VAL CG1 150.00 -150.00 -178.38 -178.69 -177.55 . . 0 "[ . 1 . 2 ]"
162 . 1 62 VAL N 1 62 VAL CA 1 62 VAL CB 1 62 VAL CG1 150.00 -150.00 -178.58 -178.67 -178.74 . . 0 "[ . 1 . 2 ]"
163 . 1 65 TYR N 1 65 TYR CA 1 65 TYR CB 1 65 TYR CG -90.00 -30.00 -87.03 -90.24 -84.81 0.24 17 0 "[ . 1 . 2 ]"
164 . 1 66 PRO N 1 66 PRO CA 1 66 PRO CB 1 66 PRO CG 15.00 45.00 27.61 28.17 28.09 . . 0 "[ . 1 . 2 ]"
165 . 1 67 SER N 1 67 SER CA 1 67 SER CB 1 67 SER OG -90.00 -30.00 -67.88 -77.44 -48.89 . . 0 "[ . 1 . 2 ]"
166 . 1 68 PRO N 1 68 PRO CA 1 68 PRO CB 1 68 PRO CG 15.00 45.00 26.78 27.64 27.35 . . 0 "[ . 1 . 2 ]"
167 . 1 69 LEU N 1 69 LEU CA 1 69 LEU CB 1 69 LEU CG 30.00 90.00 60.74 60.77 60.65 . . 0 "[ . 1 . 2 ]"
168 . 1 69 LEU CA 1 69 LEU CB 1 69 LEU CG 1 69 LEU CD1 20.00 100.00 88.36 88.32 88.29 . . 0 "[ . 1 . 2 ]"
169 . 1 70 ARG N 1 70 ARG CA 1 70 ARG CB 1 70 ARG CG -90.00 -30.00 -90.66 -90.57 -90.59 0.80 3 0 "[ . 1 . 2 ]"
170 . 1 71 VAL N 1 71 VAL CA 1 71 VAL CB 1 71 VAL CG1 150.00 -150.00 -179.95 179.86 179.67 . . 0 "[ . 1 . 2 ]"
171 . 1 75 THR N 1 75 THR CA 1 75 THR CB 1 75 THR OG1 -90.00 -30.00 -49.47 -50.47 -52.83 . . 0 "[ . 1 . 2 ]"
172 . 1 77 ILE N 1 77 ILE CA 1 77 ILE CB 1 77 ILE CG1 -90.00 -30.00 -60.97 -61.63 -56.75 . . 0 "[ . 1 . 2 ]"
173 . 1 78 THR N 1 78 THR CA 1 78 THR CB 1 78 THR OG1 -90.00 -30.00 -49.69 -50.14 -49.18 . . 0 "[ . 1 . 2 ]"
174 . 1 80 VAL N 1 80 VAL CA 1 80 VAL CB 1 80 VAL CG1 150.00 -150.00 179.57 179.60 179.52 . . 0 "[ . 1 . 2 ]"
175 . 1 81 THR N 1 81 THR CA 1 81 THR CB 1 81 THR OG1 30.00 90.00 52.22 52.19 52.18 . . 0 "[ . 1 . 2 ]"
176 . 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG 1 17 LEU CD1 150.00 -150.00 163.04 157.61 172.65 . . 0 "[ . 1 . 2 ]"
177 . 1 20 LEU CA 1 20 LEU CB 1 20 LEU CG 1 20 LEU CD1 150.00 -150.00 162.71 157.72 168.19 . . 0 "[ . 1 . 2 ]"
178 . 1 26 PRO CA 1 26 PRO CB 1 26 PRO CG 1 26 PRO CD 35.00 55.00 33.90 33.94 33.90 1.28 19 0 "[ . 1 . 2 ]"
179 . 1 27 PRO CA 1 27 PRO CB 1 27 PRO CG 1 27 PRO CD 35.00 55.00 33.28 33.27 33.24 1.85 18 0 "[ . 1 . 2 ]"
180 . 1 25 LEU CA 1 25 LEU CB 1 25 LEU CG 1 25 LEU CD1 150.00 -150.00 166.66 161.90 168.42 . . 0 "[ . 1 . 2 ]"
181 . 1 33 ILE CA 1 33 ILE CB 1 33 ILE CG1 1 33 ILE CD1 -90.00 -30.00 -60.07 -60.68 -59.66 . . 0 "[ . 1 . 2 ]"
182 . 1 35 ILE CA 1 35 ILE CB 1 35 ILE CG1 1 35 ILE CD1 150.00 -150.00 162.37 163.48 163.44 . . 0 "[ . 1 . 2 ]"
183 . 1 37 LEU CA 1 37 LEU CB 1 37 LEU CG 1 37 LEU CD1 150.00 -150.00 166.36 160.03 169.20 . . 0 "[ . 1 . 2 ]"
184 . 1 50 ILE CA 1 50 ILE CB 1 50 ILE CG1 1 50 ILE CD1 150.00 -150.00 166.99 167.00 166.75 . . 0 "[ . 1 . 2 ]"
185 . 1 66 PRO CA 1 66 PRO CB 1 66 PRO CG 1 66 PRO CD -55.00 -35.00 -34.06 -34.14 -33.99 1.01 3 0 "[ . 1 . 2 ]"
186 . 1 68 PRO CA 1 68 PRO CB 1 68 PRO CG 1 68 PRO CD -55.00 -35.00 -34.13 -34.27 -34.00 1.00 12 0 "[ . 1 . 2 ]"
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