NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
440269 |
2k8e   |
15943 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2k8e
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 173
_TA_constraint_stats_list.Viol_count 472
_TA_constraint_stats_list.Viol_total 14229.54
_TA_constraint_stats_list.Viol_max 5.68
_TA_constraint_stats_list.Viol_rms 0.67
_TA_constraint_stats_list.Viol_average_all_restraints 0.21
_TA_constraint_stats_list.Viol_average_violations_only 1.51
_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 14 GLY C 1 15 VAL N 1 15 VAL CA 1 15 VAL C 175.00 -29.00 -87.77 -112.33 -64.75 . . 0 "[ . 1 . 2]"
2 . 1 15 VAL N 1 15 VAL CA 1 15 VAL C 1 16 ILE N 122.00 158.00 149.70 124.54 160.90 2.90 16 0 "[ . 1 . 2]"
3 . 1 15 VAL C 1 16 ILE N 1 16 ILE CA 1 16 ILE C 173.00 -39.00 -81.44 -105.67 -64.83 . . 0 "[ . 1 . 2]"
4 . 1 16 ILE N 1 16 ILE CA 1 16 ILE C 1 17 MET N 90.00 -174.00 143.83 88.26 170.71 1.74 12 0 "[ . 1 . 2]"
5 . 1 16 ILE C 1 17 MET N 1 17 MET CA 1 17 MET C 173.00 -27.00 -94.59 -81.60 -85.31 . . 0 "[ . 1 . 2]"
6 . 1 17 MET N 1 17 MET CA 1 17 MET C 1 18 ALA N 97.00 -175.00 118.09 94.99 -179.66 2.01 14 0 "[ . 1 . 2]"
7 . 1 17 MET C 1 18 ALA N 1 18 ALA CA 1 18 ALA C -170.00 -26.00 -94.30 -105.08 -116.07 . . 0 "[ . 1 . 2]"
8 . 1 18 ALA N 1 18 ALA CA 1 18 ALA C 1 19 GLY N 75.00 -141.00 97.62 73.33 149.82 1.67 19 0 "[ . 1 . 2]"
9 . 1 19 GLY C 1 20 TRP N 1 20 TRP CA 1 20 TRP C 157.00 -91.00 -150.50 -141.08 -145.16 . . 0 "[ . 1 . 2]"
10 . 1 20 TRP N 1 20 TRP CA 1 20 TRP C 1 21 PHE N 149.00 173.00 156.40 157.38 155.52 0.68 6 0 "[ . 1 . 2]"
11 . 1 20 TRP C 1 21 PHE N 1 21 PHE CA 1 21 PHE C -162.00 -90.00 -97.76 -110.57 -86.95 3.05 9 0 "[ . 1 . 2]"
12 . 1 21 PHE N 1 21 PHE CA 1 21 PHE C 1 22 GLU N 123.00 171.00 145.90 118.83 157.58 4.17 6 0 "[ . 1 . 2]"
13 . 1 21 PHE C 1 22 GLU N 1 22 GLU CA 1 22 GLU C -165.00 -93.00 -125.99 -138.58 -91.97 1.03 10 0 "[ . 1 . 2]"
14 . 1 22 GLU N 1 22 GLU CA 1 22 GLU C 1 23 LEU N 102.00 162.00 112.83 110.49 110.09 . . 0 "[ . 1 . 2]"
15 . 1 22 GLU C 1 23 LEU N 1 23 LEU CA 1 23 LEU C -153.00 -83.00 -84.22 -83.37 -85.52 4.72 9 0 "[ . 1 . 2]"
16 . 1 23 LEU N 1 23 LEU CA 1 23 LEU C 1 24 SER N 100.00 144.00 102.08 95.94 128.74 4.06 2 0 "[ . 1 . 2]"
17 . 1 23 LEU C 1 24 SER N 1 24 SER CA 1 24 SER C -180.00 -80.00 -110.42 -116.84 -122.62 . . 0 "[ . 1 . 2]"
18 . 1 24 SER N 1 24 SER CA 1 24 SER C 1 25 LYS N 126.00 -178.00 160.91 155.06 152.61 0.62 2 0 "[ . 1 . 2]"
19 . 1 24 SER C 1 25 LYS N 1 25 LYS CA 1 25 LYS C -161.00 -97.00 -116.29 -146.48 -94.66 2.34 11 0 "[ . 1 . 2]"
20 . 1 25 LYS N 1 25 LYS CA 1 25 LYS C 1 26 SER N 107.00 167.00 150.45 143.69 141.33 . . 0 "[ . 1 . 2]"
21 . 1 27 SER C 1 28 ASP N 1 28 ASP CA 1 28 ASP C -114.00 -70.00 -87.10 -92.55 -95.63 1.15 11 0 "[ . 1 . 2]"
22 . 1 28 ASP N 1 28 ASP CA 1 28 ASP C 1 29 ASN N -19.00 37.00 7.48 -16.74 26.37 . . 0 "[ . 1 . 2]"
23 . 1 30 GLN C 1 31 PHE N 1 31 PHE CA 1 31 PHE C 175.00 -85.00 -90.48 -100.88 -84.84 0.16 10 0 "[ . 1 . 2]"
24 . 1 31 PHE N 1 31 PHE CA 1 31 PHE C 1 32 ARG N 118.00 -178.00 131.27 128.92 125.15 2.28 14 0 "[ . 1 . 2]"
25 . 1 31 PHE C 1 32 ARG N 1 32 ARG CA 1 32 ARG C -156.00 -108.00 -147.76 -157.43 -130.18 1.43 19 0 "[ . 1 . 2]"
26 . 1 32 ARG N 1 32 ARG CA 1 32 ARG C 1 33 PHE N 118.00 174.00 129.43 127.34 121.63 2.30 17 0 "[ . 1 . 2]"
27 . 1 32 ARG C 1 33 PHE N 1 33 PHE CA 1 33 PHE C -157.00 -93.00 -95.75 -98.82 -99.18 3.03 4 0 "[ . 1 . 2]"
28 . 1 33 PHE N 1 33 PHE CA 1 33 PHE C 1 34 VAL N 128.00 172.00 135.16 141.06 138.26 3.90 16 0 "[ . 1 . 2]"
29 . 1 33 PHE C 1 34 VAL N 1 34 VAL CA 1 34 VAL C -156.00 -108.00 -110.52 -125.77 -105.38 2.62 8 0 "[ . 1 . 2]"
30 . 1 34 VAL N 1 34 VAL CA 1 34 VAL C 1 35 LEU N 134.00 170.00 136.86 132.33 131.72 3.73 8 0 "[ . 1 . 2]"
31 . 1 34 VAL C 1 35 LEU N 1 35 LEU CA 1 35 LEU C -150.00 -86.00 -100.76 -88.39 -89.77 . . 0 "[ . 1 . 2]"
32 . 1 35 LEU N 1 35 LEU CA 1 35 LEU C 1 36 LYS N 110.00 146.00 115.70 108.04 125.27 1.96 2 0 "[ . 1 . 2]"
33 . 1 35 LEU C 1 36 LYS N 1 36 LYS CA 1 36 LYS C -147.00 -87.00 -106.70 -111.54 -112.81 . . 0 "[ . 1 . 2]"
34 . 1 36 LYS N 1 36 LYS CA 1 36 LYS C 1 37 ALA N 110.00 178.00 137.71 114.86 153.95 . . 0 "[ . 1 . 2]"
35 . 1 36 LYS C 1 37 ALA N 1 37 ALA CA 1 37 ALA C -155.00 -51.00 -73.25 -75.40 -76.62 . . 0 "[ . 1 . 2]"
36 . 1 37 ALA N 1 37 ALA CA 1 37 ALA C 1 38 GLY N 147.00 -177.00 177.89 166.75 -173.75 3.25 1 0 "[ . 1 . 2]"
37 . 1 38 GLY C 1 39 ASN N 1 39 ASN CA 1 39 ASN C -108.00 -64.00 -76.30 -81.26 -84.34 0.27 7 0 "[ . 1 . 2]"
38 . 1 39 ASN N 1 39 ASN CA 1 39 ASN C 1 40 GLY N -22.00 22.00 -11.94 -24.35 8.10 2.35 5 0 "[ . 1 . 2]"
39 . 1 39 ASN C 1 40 GLY N 1 40 GLY CA 1 40 GLY C 80.00 104.00 86.97 79.16 105.34 1.34 16 0 "[ . 1 . 2]"
40 . 1 40 GLY N 1 40 GLY CA 1 40 GLY C 1 41 GLU N -22.00 14.00 3.69 10.88 8.40 1.50 5 0 "[ . 1 . 2]"
41 . 1 40 GLY C 1 41 GLU N 1 41 GLU CA 1 41 GLU C -123.00 -39.00 -90.82 -117.36 -69.85 . . 0 "[ . 1 . 2]"
42 . 1 41 GLU N 1 41 GLU CA 1 41 GLU C 1 42 THR N 74.00 -170.00 129.47 130.43 126.76 . . 0 "[ . 1 . 2]"
43 . 1 41 GLU C 1 42 THR N 1 42 THR CA 1 42 THR C -84.00 -56.00 -70.04 -79.10 -61.84 . . 0 "[ . 1 . 2]"
44 . 1 42 THR N 1 42 THR CA 1 42 THR C 1 43 ILE N 124.00 160.00 122.74 121.64 121.51 5.68 18 1 "[ . 1 . + 2]"
45 . 1 42 THR C 1 43 ILE N 1 43 ILE CA 1 43 ILE C -132.00 -77.00 -105.38 -92.35 -97.39 0.43 16 0 "[ . 1 . 2]"
46 . 1 43 ILE N 1 43 ILE CA 1 43 ILE C 1 44 LEU N -40.00 0.00 -23.00 -19.87 -20.50 . . 0 "[ . 1 . 2]"
47 . 1 43 ILE C 1 44 LEU N 1 44 LEU CA 1 44 LEU C 179.00 -117.00 -149.64 -165.59 -132.18 . . 0 "[ . 1 . 2]"
48 . 1 44 LEU N 1 44 LEU CA 1 44 LEU C 1 45 THR N 121.00 153.00 143.49 118.37 154.91 2.63 2 0 "[ . 1 . 2]"
49 . 1 44 LEU C 1 45 THR N 1 45 THR CA 1 45 THR C -156.00 -76.00 -141.59 -119.63 -132.74 . . 0 "[ . 1 . 2]"
50 . 1 45 THR N 1 45 THR CA 1 45 THR C 1 46 SER N 102.00 142.00 119.62 122.07 119.06 . . 0 "[ . 1 . 2]"
51 . 1 47 GLU C 1 48 LEU N 1 48 LEU CA 1 48 LEU C -151.00 -47.00 -78.32 -92.00 -64.07 . . 0 "[ . 1 . 2]"
52 . 1 48 LEU N 1 48 LEU CA 1 48 LEU C 1 49 TYR N 116.00 172.00 115.66 113.21 113.03 4.64 16 0 "[ . 1 . 2]"
53 . 1 50 THR C 1 51 SER N 1 51 SER CA 1 51 SER C 179.00 -85.00 -128.51 -113.75 -119.33 . . 0 "[ . 1 . 2]"
54 . 1 51 SER N 1 51 SER CA 1 51 SER C 1 52 LYS N 134.00 -178.00 146.11 132.59 159.50 1.41 15 0 "[ . 1 . 2]"
55 . 1 51 SER C 1 52 LYS N 1 52 LYS CA 1 52 LYS C -72.00 -52.00 -66.65 -63.65 -64.63 3.08 7 0 "[ . 1 . 2]"
56 . 1 52 LYS N 1 52 LYS CA 1 52 LYS C 1 53 THR N -64.00 -20.00 -29.43 -43.18 -24.51 . . 0 "[ . 1 . 2]"
57 . 1 52 LYS C 1 53 THR N 1 53 THR CA 1 53 THR C -75.00 -51.00 -61.94 -57.39 -57.63 0.03 3 0 "[ . 1 . 2]"
58 . 1 53 THR N 1 53 THR CA 1 53 THR C 1 54 SER N -47.00 -27.00 -37.18 -36.41 -36.69 0.36 3 0 "[ . 1 . 2]"
59 . 1 53 THR C 1 54 SER N 1 54 SER CA 1 54 SER C -79.00 -59.00 -68.85 -76.56 -63.13 . . 0 "[ . 1 . 2]"
60 . 1 54 SER N 1 54 SER CA 1 54 SER C 1 55 ALA N -49.00 -25.00 -34.21 -30.05 -31.65 . . 0 "[ . 1 . 2]"
61 . 1 54 SER C 1 55 ALA N 1 55 ALA CA 1 55 ALA C -75.00 -55.00 -71.68 -76.56 -65.58 1.56 2 0 "[ . 1 . 2]"
62 . 1 55 ALA N 1 55 ALA CA 1 55 ALA C 1 56 GLU N -49.00 -29.00 -33.63 -40.20 -28.53 0.47 13 0 "[ . 1 . 2]"
63 . 1 55 ALA C 1 56 GLU N 1 56 GLU CA 1 56 GLU C -73.00 -53.00 -69.37 -74.32 -63.64 1.32 11 0 "[ . 1 . 2]"
64 . 1 56 GLU N 1 56 GLU CA 1 56 GLU C 1 57 LYS N -51.00 -31.00 -37.83 -40.33 -42.69 1.63 14 0 "[ . 1 . 2]"
65 . 1 56 GLU C 1 57 LYS N 1 57 LYS CA 1 57 LYS C -76.00 -56.00 -69.92 -78.09 -61.07 2.09 2 0 "[ . 1 . 2]"
66 . 1 57 LYS N 1 57 LYS CA 1 57 LYS C 1 58 GLY N -56.00 -24.00 -31.92 -44.00 -22.45 1.55 20 0 "[ . 1 . 2]"
67 . 1 57 LYS C 1 58 GLY N 1 58 GLY CA 1 58 GLY C -76.00 -56.00 -62.22 -66.39 -58.18 . . 0 "[ . 1 . 2]"
68 . 1 58 GLY N 1 58 GLY CA 1 58 GLY C 1 59 ILE N -49.00 -29.00 -47.12 -41.91 -45.97 2.13 1 0 "[ . 1 . 2]"
69 . 1 58 GLY C 1 59 ILE N 1 59 ILE CA 1 59 ILE C -75.00 -55.00 -69.80 -74.68 -64.16 . . 0 "[ . 1 . 2]"
70 . 1 59 ILE N 1 59 ILE CA 1 59 ILE C 1 60 ALA N -52.00 -32.00 -34.54 -33.07 -33.59 0.52 10 0 "[ . 1 . 2]"
71 . 1 59 ILE C 1 60 ALA N 1 60 ALA CA 1 60 ALA C -73.00 -53.00 -62.66 -68.10 -58.11 . . 0 "[ . 1 . 2]"
72 . 1 60 ALA N 1 60 ALA CA 1 60 ALA C 1 61 SER N -52.00 -32.00 -35.78 -34.64 -35.74 1.04 17 0 "[ . 1 . 2]"
73 . 1 60 ALA C 1 61 SER N 1 61 SER CA 1 61 SER C -75.00 -55.00 -73.26 -71.66 -73.14 1.09 20 0 "[ . 1 . 2]"
74 . 1 61 SER N 1 61 SER CA 1 61 SER C 1 62 VAL N -55.00 -27.00 -46.04 -55.71 -39.50 0.71 9 0 "[ . 1 . 2]"
75 . 1 61 SER C 1 62 VAL N 1 62 VAL CA 1 62 VAL C -88.00 -48.00 -64.72 -63.90 -64.59 . . 0 "[ . 1 . 2]"
76 . 1 62 VAL N 1 62 VAL CA 1 62 VAL C 1 63 ARG N -53.00 -29.00 -31.72 -29.11 -29.23 1.05 17 0 "[ . 1 . 2]"
77 . 1 62 VAL C 1 63 ARG N 1 63 ARG CA 1 63 ARG C -78.00 -46.00 -68.26 -70.60 -73.91 0.29 13 0 "[ . 1 . 2]"
78 . 1 63 ARG N 1 63 ARG CA 1 63 ARG C 1 64 SER N -54.00 -34.00 -41.82 -55.85 -32.99 1.85 2 0 "[ . 1 . 2]"
79 . 1 63 ARG C 1 64 SER N 1 64 SER CA 1 64 SER C -98.00 -50.00 -73.28 -70.21 -72.26 . . 0 "[ . 1 . 2]"
80 . 1 64 SER N 1 64 SER CA 1 64 SER C 1 65 ASN N -59.00 5.00 -28.04 -28.49 -30.72 . . 0 "[ . 1 . 2]"
81 . 1 64 SER C 1 65 ASN N 1 65 ASN CA 1 65 ASN C -143.00 -43.00 -101.17 -99.57 -100.94 . . 0 "[ . 1 . 2]"
82 . 1 65 ASN N 1 65 ASN CA 1 65 ASN C 1 66 SER N -82.00 18.00 7.10 -8.40 18.47 0.47 7 0 "[ . 1 . 2]"
83 . 1 68 GLN C 1 69 GLU N 1 69 GLU CA 1 69 GLU C -66.00 -46.00 -63.28 -68.13 -55.55 2.13 12 0 "[ . 1 . 2]"
84 . 1 69 GLU N 1 69 GLU CA 1 69 GLU C 1 70 GLU N -69.00 -5.00 -24.05 -24.24 -26.70 . . 0 "[ . 1 . 2]"
85 . 1 69 GLU C 1 70 GLU N 1 70 GLU CA 1 70 GLU C -85.00 -45.00 -64.55 -74.87 -78.54 . . 0 "[ . 1 . 2]"
86 . 1 70 GLU N 1 70 GLU CA 1 70 GLU C 1 71 ARG N -40.00 -4.00 -30.72 -40.80 -14.47 0.80 8 0 "[ . 1 . 2]"
87 . 1 70 GLU C 1 71 ARG N 1 71 ARG CA 1 71 ARG C -127.00 -71.00 -80.42 -96.03 -70.78 0.22 4 0 "[ . 1 . 2]"
88 . 1 71 ARG N 1 71 ARG CA 1 71 ARG C 1 72 TYR N -33.00 31.00 -17.71 -16.29 -19.99 . . 0 "[ . 1 . 2]"
89 . 1 71 ARG C 1 72 TYR N 1 72 TYR CA 1 72 TYR C -143.00 -39.00 -83.28 -129.17 -60.82 . . 0 "[ . 1 . 2]"
90 . 1 72 TYR N 1 72 TYR CA 1 72 TYR C 1 73 GLU N 98.00 158.00 121.04 145.77 138.63 2.22 13 0 "[ . 1 . 2]"
91 . 1 72 TYR C 1 73 GLU N 1 73 GLU CA 1 73 GLU C -159.00 -99.00 -101.25 -137.91 -94.60 4.40 4 0 "[ . 1 . 2]"
92 . 1 73 GLU N 1 73 GLU CA 1 73 GLU C 1 74 LYS N 90.00 157.00 110.24 137.76 117.76 . . 0 "[ . 1 . 2]"
93 . 1 73 GLU C 1 74 LYS N 1 74 LYS CA 1 74 LYS C -113.00 -61.00 -78.93 -73.72 -75.99 . . 0 "[ . 1 . 2]"
94 . 1 74 LYS N 1 74 LYS CA 1 74 LYS C 1 75 LYS N 106.00 158.00 116.21 112.00 105.41 4.64 16 0 "[ . 1 . 2]"
95 . 1 74 LYS C 1 75 LYS N 1 75 LYS CA 1 75 LYS C -155.00 -71.00 -126.70 -111.90 -119.71 0.77 3 0 "[ . 1 . 2]"
96 . 1 75 LYS N 1 75 LYS CA 1 75 LYS C 1 76 THR N 99.00 -165.00 150.86 115.32 173.22 . . 0 "[ . 1 . 2]"
97 . 1 75 LYS C 1 76 THR N 1 76 THR CA 1 76 THR C -126.00 -94.00 -111.20 -123.55 -126.30 2.26 1 0 "[ . 1 . 2]"
98 . 1 76 THR N 1 76 THR CA 1 76 THR C 1 77 ALA N 112.00 140.00 120.80 117.26 116.48 1.55 9 0 "[ . 1 . 2]"
99 . 1 76 THR C 1 77 ALA N 1 77 ALA CA 1 77 ALA C -165.00 -33.00 -65.55 -65.04 -65.18 . . 0 "[ . 1 . 2]"
100 . 1 77 ALA N 1 77 ALA CA 1 77 ALA C 1 78 SER N 98.00 -154.00 160.31 163.05 161.40 . . 0 "[ . 1 . 2]"
101 . 1 77 ALA C 1 78 SER N 1 78 SER CA 1 78 SER C -73.00 -53.00 -65.27 -65.38 -67.08 . . 0 "[ . 1 . 2]"
102 . 1 78 SER N 1 78 SER CA 1 78 SER C 1 79 ASN N -39.00 -7.00 -18.59 -30.06 -8.17 . . 0 "[ . 1 . 2]"
103 . 1 78 SER C 1 79 ASN N 1 79 ASN CA 1 79 ASN C -103.00 -67.00 -79.68 -90.36 -66.90 0.10 9 0 "[ . 1 . 2]"
104 . 1 79 ASN N 1 79 ASN CA 1 79 ASN C 1 80 GLY N -23.00 33.00 -0.22 9.71 4.90 0.75 6 0 "[ . 1 . 2]"
105 . 1 79 ASN C 1 80 GLY N 1 80 GLY CA 1 80 GLY C 57.00 109.00 81.61 77.94 75.33 . . 0 "[ . 1 . 2]"
106 . 1 80 GLY N 1 80 GLY CA 1 80 GLY C 1 81 LYS N -20.00 52.00 13.45 -16.02 34.13 . . 0 "[ . 1 . 2]"
107 . 1 80 GLY C 1 81 LYS N 1 81 LYS CA 1 81 LYS C -123.00 -51.00 -96.56 -101.41 -104.70 . . 0 "[ . 1 . 2]"
108 . 1 81 LYS N 1 81 LYS CA 1 81 LYS C 1 82 PHE N 125.00 177.00 139.64 141.33 132.81 3.18 12 0 "[ . 1 . 2]"
109 . 1 81 LYS C 1 82 PHE N 1 82 PHE CA 1 82 PHE C -144.00 -76.00 -96.82 -126.30 -77.49 . . 0 "[ . 1 . 2]"
110 . 1 82 PHE N 1 82 PHE CA 1 82 PHE C 1 83 TYR N 129.00 177.00 130.44 126.52 125.79 4.86 19 0 "[ . 1 . 2]"
111 . 1 82 PHE C 1 83 TYR N 1 83 TYR CA 1 83 TYR C -150.00 -94.00 -145.28 -152.83 -129.65 2.83 2 0 "[ . 1 . 2]"
112 . 1 83 TYR N 1 83 TYR CA 1 83 TYR C 1 84 PHE N 115.00 -177.00 173.07 176.51 175.52 . . 0 "[ . 1 . 2]"
113 . 1 83 TYR C 1 84 PHE N 1 84 PHE CA 1 84 PHE C -168.00 -100.00 -133.58 -141.87 -144.56 . . 0 "[ . 1 . 2]"
114 . 1 84 PHE N 1 84 PHE CA 1 84 PHE C 1 85 ASN N 136.00 180.00 148.47 157.41 150.35 2.78 18 0 "[ . 1 . 2]"
115 . 1 84 PHE C 1 85 ASN N 1 85 ASN CA 1 85 ASN C -153.00 -101.00 -124.26 -149.77 -99.31 1.69 11 0 "[ . 1 . 2]"
116 . 1 85 ASN N 1 85 ASN CA 1 85 ASN C 1 86 LEU N 105.00 165.00 123.91 129.51 125.38 4.28 15 0 "[ . 1 . 2]"
117 . 1 85 ASN C 1 86 LEU N 1 86 LEU CA 1 86 LEU C -163.00 -73.00 -87.72 -135.10 -76.68 . . 0 "[ . 1 . 2]"
118 . 1 86 LEU N 1 86 LEU CA 1 86 LEU C 1 87 LYS N 89.00 149.00 117.26 140.11 129.30 . . 0 "[ . 1 . 2]"
119 . 1 86 LEU C 1 87 LYS N 1 87 LYS CA 1 87 LYS C -163.00 -87.00 -99.74 -127.93 -84.46 2.54 3 0 "[ . 1 . 2]"
120 . 1 87 LYS N 1 87 LYS CA 1 87 LYS C 1 88 ALA N 139.00 -173.00 148.36 158.83 156.85 3.03 6 0 "[ . 1 . 2]"
121 . 1 88 ALA C 1 89 ALA N 1 89 ALA CA 1 89 ALA C -71.00 -41.00 -65.45 -71.15 -59.55 0.15 18 0 "[ . 1 . 2]"
122 . 1 89 ALA N 1 89 ALA CA 1 89 ALA C 1 90 ASN N -51.00 -9.00 -20.04 -23.71 -26.07 0.05 6 0 "[ . 1 . 2]"
123 . 1 89 ALA C 1 90 ASN N 1 90 ASN CA 1 90 ASN C -113.00 -67.00 -84.55 -74.80 -79.56 . . 0 "[ . 1 . 2]"
124 . 1 90 ASN N 1 90 ASN CA 1 90 ASN C 1 91 HIS N -33.00 47.00 6.64 -16.72 24.42 . . 0 "[ . 1 . 2]"
125 . 1 92 GLN C 1 93 ILE N 1 93 ILE CA 1 93 ILE C -159.00 -31.00 -82.34 -106.63 -67.39 . . 0 "[ . 1 . 2]"
126 . 1 93 ILE N 1 93 ILE CA 1 93 ILE C 1 94 ILE N 100.00 159.00 104.97 104.08 100.73 3.13 12 0 "[ . 1 . 2]"
127 . 1 93 ILE C 1 94 ILE N 1 94 ILE CA 1 94 ILE C -124.00 -80.00 -86.74 -126.83 -75.66 4.34 6 0 "[ . 1 . 2]"
128 . 1 94 ILE N 1 94 ILE CA 1 94 ILE C 1 95 GLY N -34.00 -2.00 -8.18 -8.98 -10.58 0.85 18 0 "[ . 1 . 2]"
129 . 1 95 GLY C 1 96 SER N 1 96 SER CA 1 96 SER C -170.00 -90.00 -125.70 -166.70 -88.52 1.48 16 0 "[ . 1 . 2]"
130 . 1 96 SER N 1 96 SER CA 1 96 SER C 1 97 SER N 114.00 166.00 129.54 112.43 169.72 3.72 14 0 "[ . 1 . 2]"
131 . 1 98 GLN C 1 99 MET N 1 99 MET CA 1 99 MET C 173.00 -75.00 -110.99 174.33 -72.90 2.10 6 0 "[ . 1 . 2]"
132 . 1 99 MET N 1 99 MET CA 1 99 MET C 1 100 TYR N 120.00 176.00 123.75 115.27 155.08 4.73 2 0 "[ . 1 . 2]"
133 . 1 99 MET C 1 100 TYR N 1 100 TYR CA 1 100 TYR C -102.00 -54.00 -98.65 -105.13 -83.51 3.13 12 0 "[ . 1 . 2]"
134 . 1 100 TYR N 1 100 TYR CA 1 100 TYR C 1 101 ALA N 105.00 169.00 140.54 104.16 163.50 0.84 14 0 "[ . 1 . 2]"
135 . 1 102 THR C 1 103 ALA N 1 103 ALA CA 1 103 ALA C -85.00 -49.00 -71.47 -86.05 -65.50 1.05 12 0 "[ . 1 . 2]"
136 . 1 103 ALA N 1 103 ALA CA 1 103 ALA C 1 104 GLN N -56.00 -16.00 -26.00 -25.77 -27.51 . . 0 "[ . 1 . 2]"
137 . 1 103 ALA C 1 104 GLN N 1 104 GLN CA 1 104 GLN C -76.00 -56.00 -66.05 -79.80 -58.82 3.80 18 0 "[ . 1 . 2]"
138 . 1 104 GLN N 1 104 GLN CA 1 104 GLN C 1 105 SER N -50.00 -30.00 -35.16 -45.11 -28.58 1.42 14 0 "[ . 1 . 2]"
139 . 1 104 GLN C 1 105 SER N 1 105 SER CA 1 105 SER C -80.00 -52.00 -71.00 -69.26 -71.27 . . 0 "[ . 1 . 2]"
140 . 1 105 SER N 1 105 SER CA 1 105 SER C 1 106 ARG N -55.00 -23.00 -26.92 -40.48 -18.46 4.54 12 0 "[ . 1 . 2]"
141 . 1 105 SER C 1 106 ARG N 1 106 ARG CA 1 106 ARG C -76.00 -52.00 -66.94 -76.87 -55.99 0.87 16 0 "[ . 1 . 2]"
142 . 1 106 ARG N 1 106 ARG CA 1 106 ARG C 1 107 GLU N -57.00 -29.00 -41.14 -56.84 -26.83 2.17 19 0 "[ . 1 . 2]"
143 . 1 106 ARG C 1 107 GLU N 1 107 GLU CA 1 107 GLU C -75.00 -55.00 -69.46 -76.91 -58.50 1.91 2 0 "[ . 1 . 2]"
144 . 1 107 GLU N 1 107 GLU CA 1 107 GLU C 1 108 THR N -49.00 -29.00 -38.23 -32.97 -34.61 1.74 14 0 "[ . 1 . 2]"
145 . 1 107 GLU C 1 108 THR N 1 108 THR CA 1 108 THR C -75.00 -55.00 -65.41 -76.23 -59.47 1.23 12 0 "[ . 1 . 2]"
146 . 1 108 THR N 1 108 THR CA 1 108 THR C 1 109 GLY N -62.00 -22.00 -36.41 -45.95 -28.72 . . 0 "[ . 1 . 2]"
147 . 1 108 THR C 1 109 GLY N 1 109 GLY CA 1 109 GLY C -76.00 -52.00 -64.91 -71.42 -61.14 . . 0 "[ . 1 . 2]"
148 . 1 109 GLY N 1 109 GLY CA 1 109 GLY C 1 110 ILE N -52.00 -28.00 -41.29 -38.10 -40.00 . . 0 "[ . 1 . 2]"
149 . 1 109 GLY C 1 110 ILE N 1 110 ILE CA 1 110 ILE C -78.00 -54.00 -60.17 -76.77 -55.09 . . 0 "[ . 1 . 2]"
150 . 1 110 ILE N 1 110 ILE CA 1 110 ILE C 1 111 ALA N -51.00 -27.00 -46.83 -52.37 -38.07 1.37 8 0 "[ . 1 . 2]"
151 . 1 110 ILE C 1 111 ALA N 1 111 ALA CA 1 111 ALA C -75.00 -55.00 -63.94 -63.33 -64.59 . . 0 "[ . 1 . 2]"
152 . 1 111 ALA N 1 111 ALA CA 1 111 ALA C 1 112 SER N -51.00 -27.00 -35.39 -32.79 -34.92 0.17 18 0 "[ . 1 . 2]"
153 . 1 111 ALA C 1 112 SER N 1 112 SER CA 1 112 SER C -76.00 -56.00 -72.58 -75.52 -76.01 0.15 4 0 "[ . 1 . 2]"
154 . 1 112 SER N 1 112 SER CA 1 112 SER C 1 113 VAL N -52.00 -28.00 -43.34 -38.27 -41.53 1.12 13 0 "[ . 1 . 2]"
155 . 1 112 SER C 1 113 VAL N 1 113 VAL CA 1 113 VAL C -85.00 -53.00 -68.04 -75.91 -59.28 . . 0 "[ . 1 . 2]"
156 . 1 113 VAL N 1 113 VAL CA 1 113 VAL C 1 114 LYS N -54.00 -26.00 -31.99 -39.01 -24.72 1.28 19 0 "[ . 1 . 2]"
157 . 1 113 VAL C 1 114 LYS N 1 114 LYS CA 1 114 LYS C -69.00 -49.00 -67.65 -67.53 -69.17 2.27 18 0 "[ . 1 . 2]"
158 . 1 114 LYS N 1 114 LYS CA 1 114 LYS C 1 115 ALA N -56.00 -36.00 -42.30 -35.02 -37.81 2.90 18 0 "[ . 1 . 2]"
159 . 1 114 LYS C 1 115 ALA N 1 115 ALA CA 1 115 ALA C -96.00 -48.00 -76.26 -93.49 -67.24 . . 0 "[ . 1 . 2]"
160 . 1 115 ALA N 1 115 ALA CA 1 115 ALA C 1 116 ASN N -51.00 -7.00 -42.45 -50.17 -51.06 0.71 18 0 "[ . 1 . 2]"
161 . 1 115 ALA C 1 116 ASN N 1 116 ASN CA 1 116 ASN C -127.00 -83.00 -94.29 -89.22 -89.28 . . 0 "[ . 1 . 2]"
162 . 1 116 ASN N 1 116 ASN CA 1 116 ASN C 1 117 GLY N -37.00 3.00 -12.09 -4.15 -7.47 . . 0 "[ . 1 . 2]"
163 . 1 120 GLN C 1 121 THR N 1 121 THR CA 1 121 THR C -157.00 -37.00 -88.93 -147.12 -61.93 . . 0 "[ . 1 . 2]"
164 . 1 121 THR C 1 122 VAL N 1 122 VAL CA 1 122 VAL C -134.00 -86.00 -105.27 -134.73 -85.48 0.73 19 0 "[ . 1 . 2]"
165 . 1 122 VAL N 1 122 VAL CA 1 122 VAL C 1 123 LYS N 98.00 142.00 126.59 97.50 144.35 2.35 13 0 "[ . 1 . 2]"
166 . 1 122 VAL C 1 123 LYS N 1 123 LYS CA 1 123 LYS C -139.00 -79.00 -98.68 -126.23 -77.54 1.46 6 0 "[ . 1 . 2]"
167 . 1 123 LYS N 1 123 LYS CA 1 123 LYS C 1 124 ASP N 76.00 148.00 114.69 82.12 148.36 0.36 20 0 "[ . 1 . 2]"
168 . 1 123 LYS C 1 124 ASP N 1 124 ASP CA 1 124 ASP C -104.00 -72.00 -79.26 -106.24 -70.01 2.24 20 0 "[ . 1 . 2]"
169 . 1 124 ASP N 1 124 ASP CA 1 124 ASP C 1 125 ASN N 98.00 142.00 103.65 94.45 138.77 3.55 2 0 "[ . 1 . 2]"
170 . 1 126 THR C 1 127 GLY N 1 127 GLY CA 1 127 GLY C 67.00 115.00 93.06 112.58 102.96 0.80 15 0 "[ . 1 . 2]"
171 . 1 127 GLY N 1 127 GLY CA 1 127 GLY C 1 128 SER N -48.00 56.00 7.33 -48.80 56.73 0.80 13 0 "[ . 1 . 2]"
172 . 1 127 GLY C 1 128 SER N 1 128 SER CA 1 128 SER C -152.00 -32.00 -89.04 -75.80 -77.90 . . 0 "[ . 1 . 2]"
173 . 1 128 SER N 1 128 SER CA 1 128 SER C 1 129 ASN N 75.00 -173.00 118.39 73.23 -173.76 1.77 12 0 "[ . 1 . 2]"
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