NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
426362 |
2h60   |
cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2h60
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 168
_TA_constraint_stats_list.Viol_count 355
_TA_constraint_stats_list.Viol_total 1702.80
_TA_constraint_stats_list.Viol_max 10.97
_TA_constraint_stats_list.Viol_rms 0.43
_TA_constraint_stats_list.Viol_average_all_restraints 0.08
_TA_constraint_stats_list.Viol_average_violations_only 0.44
_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 LYS N 1 11 LYS CA 1 11 LYS C 1 12 MET N -47.80 -33.20 -39.03 -48.03 -33.14 0.23 5 0 "[ . 1 ]"
2 . 1 11 LYS C 1 12 MET N 1 12 MET CA 1 12 MET C -65.50 -57.30 -58.73 -63.23 -54.96 2.34 1 0 "[ . 1 ]"
3 . 1 12 MET N 1 12 MET CA 1 12 MET C 1 13 LYS N -49.40 -38.20 -46.27 -48.78 -49.31 0.56 1 0 "[ . 1 ]"
4 . 1 12 MET C 1 13 LYS N 1 13 LYS CA 1 13 LYS C -66.20 -53.40 -60.79 -64.44 -56.31 . . 0 "[ . 1 ]"
5 . 1 13 LYS N 1 13 LYS CA 1 13 LYS C 1 14 LYS N -51.00 -34.60 -39.03 -37.51 -38.98 . . 0 "[ . 1 ]"
6 . 1 13 LYS C 1 14 LYS N 1 14 LYS CA 1 14 LYS C -66.10 -57.10 -61.78 -61.56 -63.36 0.32 7 0 "[ . 1 ]"
7 . 1 14 LYS N 1 14 LYS CA 1 14 LYS C 1 15 ILE N -45.90 -32.70 -41.26 -44.49 -39.43 . . 0 "[ . 1 ]"
8 . 1 14 LYS C 1 15 ILE N 1 15 ILE CA 1 15 ILE C -72.80 -61.20 -68.29 -65.66 -66.70 . . 0 "[ . 1 ]"
9 . 1 15 ILE N 1 15 ILE CA 1 15 ILE C 1 16 VAL N -49.40 -40.40 -48.87 -46.80 -47.40 0.48 8 0 "[ . 1 ]"
10 . 1 15 ILE C 1 16 VAL N 1 16 VAL CA 1 16 VAL C -70.30 -60.70 -65.28 -68.73 -61.96 . . 0 "[ . 1 ]"
11 . 1 16 VAL N 1 16 VAL CA 1 16 VAL C 1 17 ASP N -49.60 -38.40 -43.21 -44.57 -48.71 0.02 8 0 "[ . 1 ]"
12 . 1 16 VAL C 1 17 ASP N 1 17 ASP CA 1 17 ASP C -67.50 -56.30 -59.92 -58.04 -59.51 0.09 2 0 "[ . 1 ]"
13 . 1 17 ASP N 1 17 ASP CA 1 17 ASP C 1 18 ALA N -45.70 -35.70 -41.56 -38.33 -39.81 . . 0 "[ . 1 ]"
14 . 1 17 ASP C 1 18 ALA N 1 18 ALA CA 1 18 ALA C -71.80 -61.00 -65.42 -68.77 -60.31 0.69 4 0 "[ . 1 ]"
15 . 1 18 ALA N 1 18 ALA CA 1 18 ALA C 1 19 VAL N -43.40 -33.40 -41.57 -43.63 -39.35 0.23 10 0 "[ . 1 ]"
16 . 1 18 ALA C 1 19 VAL N 1 19 VAL CA 1 19 VAL C -74.50 -63.90 -71.79 -74.62 -67.18 0.12 4 0 "[ . 1 ]"
17 . 1 19 VAL N 1 19 VAL CA 1 19 VAL C 1 20 ILE N -48.10 -41.30 -47.42 -48.11 -48.83 0.73 1 0 "[ . 1 ]"
18 . 1 19 VAL C 1 20 ILE N 1 20 ILE CA 1 20 ILE C -66.40 -56.80 -63.62 -66.77 -58.60 0.37 10 0 "[ . 1 ]"
19 . 1 20 ILE N 1 20 ILE CA 1 20 ILE C 1 21 LYS N -49.40 -35.20 -36.17 -35.94 -38.21 0.65 10 0 "[ . 1 ]"
20 . 1 20 ILE C 1 21 LYS N 1 21 LYS CA 1 21 LYS C -79.70 -59.10 -60.50 -59.05 -60.93 0.72 9 0 "[ . 1 ]"
21 . 1 21 LYS N 1 21 LYS CA 1 21 LYS C 1 22 TYR N -41.30 -24.70 -29.09 -32.39 -24.53 0.17 8 0 "[ . 1 ]"
22 . 1 22 TYR C 1 23 LYS N 1 23 LYS CA 1 23 LYS C -115.30 -93.30 -103.92 -105.07 -109.39 1.49 1 0 "[ . 1 ]"
23 . 1 23 LYS N 1 23 LYS CA 1 23 LYS C 1 24 ASP N 115.40 179.40 121.06 115.25 135.25 0.15 2 0 "[ . 1 ]"
24 . 1 23 LYS C 1 24 ASP N 1 24 ASP CA 1 24 ASP C -130.30 -63.30 -78.80 -89.99 -67.07 . . 0 "[ . 1 ]"
25 . 1 24 ASP N 1 24 ASP CA 1 24 ASP C 1 25 SER N 117.70 144.70 119.04 116.90 126.11 0.80 8 0 "[ . 1 ]"
26 . 1 25 SER C 1 26 SER N 1 26 SER CA 1 26 SER C -83.60 -67.20 -83.30 -83.78 -84.50 0.90 1 0 "[ . 1 ]"
27 . 1 26 SER N 1 26 SER CA 1 26 SER C 1 27 SER N -41.60 -10.00 -21.61 -25.04 -14.67 . . 0 "[ . 1 ]"
28 . 1 26 SER C 1 27 SER N 1 27 SER CA 1 27 SER C -116.70 -86.10 -88.63 -87.43 -87.50 0.27 10 0 "[ . 1 ]"
29 . 1 27 SER N 1 27 SER CA 1 27 SER C 1 28 GLY N -19.20 11.80 -19.34 -19.89 -18.25 0.69 11 0 "[ . 1 ]"
30 . 1 30 GLN C 1 31 LEU N 1 31 LEU CA 1 31 LEU C -63.80 -54.40 -58.39 -61.01 -62.07 0.42 8 0 "[ . 1 ]"
31 . 1 31 LEU N 1 31 LEU CA 1 31 LEU C 1 32 SER N -46.60 -35.80 -35.39 -38.78 -32.75 3.05 1 0 "[ . 1 ]"
32 . 1 31 LEU C 1 32 SER N 1 32 SER CA 1 32 SER C -100.00 -20.00 -68.20 -67.80 -68.08 . . 0 "[ . 1 ]"
33 . 1 32 SER N 1 32 SER CA 1 32 SER C 1 33 GLU N -100.00 0.00 -3.74 -7.40 -8.11 0.12 4 0 "[ . 1 ]"
34 . 1 32 SER C 1 33 GLU N 1 33 GLU CA 1 33 GLU C -81.30 -57.50 -57.01 -57.31 -56.50 1.00 10 0 "[ . 1 ]"
35 . 1 33 GLU N 1 33 GLU CA 1 33 GLU C 1 34 VAL N -43.70 -15.90 -25.70 -28.63 -18.94 . . 0 "[ . 1 ]"
36 . 1 33 GLU C 1 34 VAL N 1 34 VAL CA 1 34 VAL C -77.20 -61.60 -64.89 -66.51 -70.14 0.82 11 0 "[ . 1 ]"
37 . 1 34 VAL N 1 34 VAL CA 1 34 VAL C 1 35 PHE N -30.80 -2.20 -27.30 -22.69 -26.04 0.19 11 0 "[ . 1 ]"
38 . 1 36 ILE C 1 37 GLN N 1 37 GLN CA 1 37 GLN C -154.50 -114.10 -122.01 -116.09 -121.23 0.51 2 0 "[ . 1 ]"
39 . 1 37 GLN N 1 37 GLN CA 1 37 GLN C 1 38 LEU N 110.80 162.40 126.72 110.85 153.30 . . 0 "[ . 1 ]"
40 . 1 37 GLN C 1 38 LEU N 1 38 LEU CA 1 38 LEU C -104.00 -73.00 -99.07 -104.36 -76.83 0.36 4 0 "[ . 1 ]"
41 . 1 38 LEU N 1 38 LEU CA 1 38 LEU C 1 39 PRO N 116.50 141.10 134.51 118.65 141.94 0.84 4 0 "[ . 1 ]"
42 . 1 39 PRO C 1 40 SER N 1 40 SER CA 1 40 SER C -121.30 -72.70 -87.91 -89.15 -90.49 . . 0 "[ . 1 ]"
43 . 1 40 SER N 1 40 SER CA 1 40 SER C 1 41 ARG N 138.50 176.90 151.88 137.92 165.19 0.58 7 0 "[ . 1 ]"
44 . 1 40 SER C 1 41 ARG N 1 41 ARG CA 1 41 ARG C -64.80 -52.40 -58.41 -58.47 -60.18 . . 0 "[ . 1 ]"
45 . 1 41 ARG N 1 41 ARG CA 1 41 ARG C 1 42 LYS N -44.80 -18.80 -38.91 -36.13 -38.13 . . 0 "[ . 1 ]"
46 . 1 41 ARG C 1 42 LYS N 1 42 LYS CA 1 42 LYS C -74.20 -54.20 -67.15 -65.90 -69.25 . . 0 "[ . 1 ]"
47 . 1 42 LYS N 1 42 LYS CA 1 42 LYS C 1 43 GLU N -43.90 -19.90 -32.86 -33.36 -33.87 . . 0 "[ . 1 ]"
48 . 1 42 LYS C 1 43 GLU N 1 43 GLU CA 1 43 GLU C -100.60 -66.00 -69.45 -79.86 -65.91 0.09 4 0 "[ . 1 ]"
49 . 1 43 GLU N 1 43 GLU CA 1 43 GLU C 1 44 LEU N -49.00 -9.00 -41.62 -47.21 -33.62 . . 0 "[ . 1 ]"
50 . 1 43 GLU C 1 44 LEU N 1 44 LEU CA 1 44 LEU C -152.00 -96.00 -134.66 -135.40 -139.99 . . 0 "[ . 1 ]"
51 . 1 44 LEU N 1 44 LEU CA 1 44 LEU C 1 45 PRO N 60.00 118.00 72.50 66.28 80.40 . . 0 "[ . 1 ]"
52 . 1 44 LEU C 1 45 PRO N 1 45 PRO CA 1 45 PRO C -62.40 -50.60 -59.13 -57.33 -60.21 0.32 8 0 "[ . 1 ]"
53 . 1 45 PRO N 1 45 PRO CA 1 45 PRO C 1 46 GLU N -40.80 -16.80 -32.85 -38.87 -23.29 . . 0 "[ . 1 ]"
54 . 1 45 PRO C 1 46 GLU N 1 46 GLU CA 1 46 GLU C -66.90 -62.90 -62.49 -62.91 -61.81 1.09 1 0 "[ . 1 ]"
55 . 1 46 GLU N 1 46 GLU CA 1 46 GLU C 1 47 TYR N -48.50 -31.50 -36.30 -34.60 -38.37 . . 0 "[ . 1 ]"
56 . 1 46 GLU C 1 47 TYR N 1 47 TYR CA 1 47 TYR C -70.60 -54.60 -62.31 -70.26 -58.83 . . 0 "[ . 1 ]"
57 . 1 47 TYR N 1 47 TYR CA 1 47 TYR C 1 48 TYR N -49.00 -37.40 -44.40 -49.02 -37.40 0.02 2 0 "[ . 1 ]"
58 . 1 47 TYR C 1 48 TYR N 1 48 TYR CA 1 48 TYR C -65.30 -54.70 -63.75 -65.87 -59.69 0.57 6 0 "[ . 1 ]"
59 . 1 48 TYR N 1 48 TYR CA 1 48 TYR C 1 49 GLU N -47.00 -27.40 -36.06 -39.10 -40.88 0.04 10 0 "[ . 1 ]"
60 . 1 48 TYR C 1 49 GLU N 1 49 GLU CA 1 49 GLU C -86.80 -62.80 -72.24 -74.24 -75.31 . . 0 "[ . 1 ]"
61 . 1 49 GLU N 1 49 GLU CA 1 49 GLU C 1 50 LEU N -49.50 -23.50 -43.08 -32.13 -34.16 . . 0 "[ . 1 ]"
62 . 1 49 GLU C 1 50 LEU N 1 50 LEU CA 1 50 LEU C -100.00 -20.00 -74.57 -89.12 -60.20 . . 0 "[ . 1 ]"
63 . 1 50 LEU N 1 50 LEU CA 1 50 LEU C 1 51 ILE N -100.00 0.00 -49.90 -65.12 -35.30 . . 0 "[ . 1 ]"
64 . 1 54 PRO C 1 55 VAL N 1 55 VAL CA 1 55 VAL C -124.80 -82.80 -118.09 -124.34 -102.01 . . 0 "[ . 1 ]"
65 . 1 55 VAL N 1 55 VAL CA 1 55 VAL C 1 56 ASP N 116.30 154.70 143.77 151.10 150.61 . . 0 "[ . 1 ]"
66 . 1 55 VAL C 1 56 ASP N 1 56 ASP CA 1 56 ASP C -126.50 -66.50 -121.58 -126.87 -115.93 0.37 3 0 "[ . 1 ]"
67 . 1 56 ASP N 1 56 ASP CA 1 56 ASP C 1 57 PHE N 114.00 179.00 170.77 165.17 176.20 . . 0 "[ . 1 ]"
68 . 1 56 ASP C 1 57 PHE N 1 57 PHE CA 1 57 PHE C -62.70 -54.30 -59.56 -60.45 -60.87 0.51 3 0 "[ . 1 ]"
69 . 1 57 PHE N 1 57 PHE CA 1 57 PHE C 1 58 LYS N -44.60 -31.60 -35.28 -34.28 -34.89 0.26 11 0 "[ . 1 ]"
70 . 1 57 PHE C 1 58 LYS N 1 58 LYS CA 1 58 LYS C -71.00 -59.00 -65.27 -71.13 -59.13 0.13 2 0 "[ . 1 ]"
71 . 1 58 LYS N 1 58 LYS CA 1 58 LYS C 1 59 LYS N -47.70 -35.70 -43.09 -48.02 -38.88 0.32 11 0 "[ . 1 ]"
72 . 1 58 LYS C 1 59 LYS N 1 59 LYS CA 1 59 LYS C -69.70 -63.10 -63.06 -64.67 -60.35 2.75 1 0 "[ . 1 ]"
73 . 1 59 LYS N 1 59 LYS CA 1 59 LYS C 1 60 ILE N -50.80 -30.80 -44.25 -43.51 -44.31 . . 0 "[ . 1 ]"
74 . 1 59 LYS C 1 60 ILE N 1 60 ILE CA 1 60 ILE C -71.50 -60.90 -67.58 -71.49 -61.04 . . 0 "[ . 1 ]"
75 . 1 60 ILE N 1 60 ILE CA 1 60 ILE C 1 61 LYS N -52.00 -37.40 -45.27 -37.24 -41.72 0.16 2 0 "[ . 1 ]"
76 . 1 60 ILE C 1 61 LYS N 1 61 LYS CA 1 61 LYS C -65.30 -59.30 -61.83 -65.86 -59.29 0.56 2 0 "[ . 1 ]"
77 . 1 61 LYS N 1 61 LYS CA 1 61 LYS C 1 62 GLU N -46.30 -34.70 -40.83 -44.62 -36.19 . . 0 "[ . 1 ]"
78 . 1 61 LYS C 1 62 GLU N 1 62 GLU CA 1 62 GLU C -71.40 -61.60 -70.56 -71.84 -67.52 0.44 10 0 "[ . 1 ]"
79 . 1 62 GLU N 1 62 GLU CA 1 62 GLU C 1 63 ARG N -48.50 -34.50 -40.75 -34.33 -37.84 0.17 2 0 "[ . 1 ]"
80 . 1 62 GLU C 1 63 ARG N 1 63 ARG CA 1 63 ARG C -65.40 -58.40 -64.78 -65.98 -60.61 0.58 2 0 "[ . 1 ]"
81 . 1 63 ARG N 1 63 ARG CA 1 63 ARG C 1 64 ILE N -46.40 -35.00 -46.66 -46.77 -47.69 1.29 1 0 "[ . 1 ]"
82 . 1 63 ARG C 1 64 ILE N 1 64 ILE CA 1 64 ILE C -68.00 -56.60 -61.99 -67.63 -57.88 . . 0 "[ . 1 ]"
83 . 1 64 ILE N 1 64 ILE CA 1 64 ILE C 1 65 ARG N -48.30 -26.30 -26.82 -29.11 -25.60 0.70 3 0 "[ . 1 ]"
84 . 1 64 ILE C 1 65 ARG N 1 65 ARG CA 1 65 ARG C -67.40 -53.20 -56.69 -55.08 -55.71 . . 0 "[ . 1 ]"
85 . 1 65 ARG N 1 65 ARG CA 1 65 ARG C 1 66 ASN N -49.80 -23.20 -33.29 -35.53 -29.95 . . 0 "[ . 1 ]"
86 . 1 65 ARG C 1 66 ASN N 1 66 ASN CA 1 66 ASN C -104.00 -81.20 -94.81 -95.55 -96.99 . . 0 "[ . 1 ]"
87 . 1 66 ASN N 1 66 ASN CA 1 66 ASN C 1 67 HIS N -28.90 12.30 12.93 12.67 14.13 1.83 1 0 "[ . 1 ]"
88 . 1 67 HIS C 1 68 LYS N 1 68 LYS CA 1 68 LYS C -79.90 -62.90 -79.54 -80.38 -76.85 0.48 6 0 "[ . 1 ]"
89 . 1 68 LYS N 1 68 LYS CA 1 68 LYS C 1 69 TYR N -46.00 -20.00 -43.72 -41.64 -44.84 0.41 1 0 "[ . 1 ]"
90 . 1 71 SER C 1 72 LEU N 1 72 LEU CA 1 72 LEU C -74.00 -54.00 -65.33 -66.43 -70.13 . . 0 "[ . 1 ]"
91 . 1 72 LEU N 1 72 LEU CA 1 72 LEU C 1 73 ASN N -47.90 -21.50 -31.41 -40.36 -24.53 . . 0 "[ . 1 ]"
92 . 1 72 LEU C 1 73 ASN N 1 73 ASN CA 1 73 ASN C -70.60 -54.20 -58.43 -57.93 -59.00 . . 0 "[ . 1 ]"
93 . 1 73 ASN N 1 73 ASN CA 1 73 ASN C 1 74 ASP N -44.30 -36.30 -41.39 -44.54 -36.23 0.24 7 0 "[ . 1 ]"
94 . 1 73 ASN C 1 74 ASP N 1 74 ASP CA 1 74 ASP C -74.40 -60.40 -62.99 -67.23 -59.63 0.77 1 0 "[ . 1 ]"
95 . 1 74 ASP N 1 74 ASP CA 1 74 ASP C 1 75 LEU N -52.60 -34.00 -47.61 -45.70 -46.60 0.48 3 0 "[ . 1 ]"
96 . 1 74 ASP C 1 75 LEU N 1 75 LEU CA 1 75 LEU C -71.30 -55.70 -63.92 -62.03 -63.52 . . 0 "[ . 1 ]"
97 . 1 75 LEU N 1 75 LEU CA 1 75 LEU C 1 76 GLU N -49.20 -36.60 -44.65 -49.24 -36.71 0.04 6 0 "[ . 1 ]"
98 . 1 75 LEU C 1 76 GLU N 1 76 GLU CA 1 76 GLU C -67.60 -58.00 -59.87 -63.46 -57.39 0.61 7 0 "[ . 1 ]"
99 . 1 76 GLU N 1 76 GLU CA 1 76 GLU C 1 77 LYS N -48.50 -34.50 -45.77 -48.99 -40.57 0.49 7 0 "[ . 1 ]"
100 . 1 76 GLU C 1 77 LYS N 1 77 LYS CA 1 77 LYS C -64.00 -57.20 -61.37 -60.20 -60.92 0.10 2 0 "[ . 1 ]"
101 . 1 77 LYS N 1 77 LYS CA 1 77 LYS C 1 78 ASP N -47.10 -31.10 -36.30 -38.37 -38.40 . . 0 "[ . 1 ]"
102 . 1 77 LYS C 1 78 ASP N 1 78 ASP CA 1 78 ASP C -71.10 -63.90 -65.17 -63.88 -65.20 0.47 2 0 "[ . 1 ]"
103 . 1 78 ASP N 1 78 ASP CA 1 78 ASP C 1 79 VAL N -47.80 -34.60 -46.40 -48.13 -41.60 0.33 11 0 "[ . 1 ]"
104 . 1 78 ASP C 1 79 VAL N 1 79 VAL CA 1 79 VAL C -66.80 -57.20 -62.86 -66.87 -59.07 0.07 2 0 "[ . 1 ]"
105 . 1 79 VAL N 1 79 VAL CA 1 79 VAL C 1 80 MET N -46.20 -40.80 -45.42 -46.46 -47.84 1.64 1 0 "[ . 1 ]"
106 . 1 79 VAL C 1 80 MET N 1 80 MET CA 1 80 MET C -68.00 -59.40 -64.05 -60.28 -62.66 0.29 5 0 "[ . 1 ]"
107 . 1 80 MET N 1 80 MET CA 1 80 MET C 1 81 LEU N -47.20 -34.20 -41.54 -46.55 -37.87 . . 0 "[ . 1 ]"
108 . 1 80 MET C 1 81 LEU N 1 81 LEU CA 1 81 LEU C -68.50 -60.90 -63.34 -61.67 -62.93 . . 0 "[ . 1 ]"
109 . 1 81 LEU N 1 81 LEU CA 1 81 LEU C 1 82 LEU N -46.60 -39.00 -40.42 -39.89 -40.58 0.36 5 0 "[ . 1 ]"
110 . 1 81 LEU C 1 82 LEU N 1 82 LEU CA 1 82 LEU C -67.10 -60.30 -60.91 -59.61 -59.89 0.69 2 0 "[ . 1 ]"
111 . 1 82 LEU N 1 82 LEU CA 1 82 LEU C 1 83 CYS N -45.70 -38.30 -43.28 -46.08 -38.20 0.38 6 0 "[ . 1 ]"
112 . 1 82 LEU C 1 83 CYS N 1 83 CYS CA 1 83 CYS C -65.30 -61.30 -62.06 -64.74 -59.09 2.21 1 0 "[ . 1 ]"
113 . 1 83 CYS N 1 83 CYS CA 1 83 CYS C 1 84 GLN N -46.90 -40.10 -44.31 -47.02 -39.64 0.46 10 0 "[ . 1 ]"
114 . 1 83 CYS C 1 84 GLN N 1 84 GLN CA 1 84 GLN C -66.10 -56.10 -63.17 -66.47 -57.07 0.37 9 0 "[ . 1 ]"
115 . 1 84 GLN N 1 84 GLN CA 1 84 GLN C 1 85 ASN N -50.40 -33.80 -41.15 -40.55 -42.77 . . 0 "[ . 1 ]"
116 . 1 84 GLN C 1 85 ASN N 1 85 ASN CA 1 85 ASN C -74.40 -61.40 -62.35 -69.19 -60.59 0.81 1 0 "[ . 1 ]"
117 . 1 85 ASN N 1 85 ASN CA 1 85 ASN C 1 86 ALA N -43.70 -24.50 -36.60 -30.40 -32.60 0.05 11 0 "[ . 1 ]"
118 . 1 85 ASN C 1 86 ALA N 1 86 ALA CA 1 86 ALA C -77.10 -57.10 -67.14 -74.42 -59.02 . . 0 "[ . 1 ]"
119 . 1 86 ALA N 1 86 ALA CA 1 86 ALA C 1 87 GLN N -46.40 -36.60 -41.98 -44.99 -38.13 . . 0 "[ . 1 ]"
120 . 1 86 ALA C 1 87 GLN N 1 87 GLN CA 1 87 GLN C -70.80 -61.20 -65.41 -64.56 -66.34 0.56 2 0 "[ . 1 ]"
121 . 1 87 GLN N 1 87 GLN CA 1 87 GLN C 1 88 THR N -49.40 -29.00 -34.34 -46.35 -28.55 0.45 3 0 "[ . 1 ]"
122 . 1 87 GLN C 1 88 THR N 1 88 THR CA 1 88 THR C -78.00 -60.20 -65.12 -76.03 -60.15 0.05 5 0 "[ . 1 ]"
123 . 1 88 THR N 1 88 THR CA 1 88 THR C 1 89 PHE N -53.40 -24.80 -31.89 -31.30 -35.40 0.19 9 0 "[ . 1 ]"
124 . 1 88 THR C 1 89 PHE N 1 89 PHE CA 1 89 PHE C -102.60 -68.60 -88.61 -87.79 -89.30 . . 0 "[ . 1 ]"
125 . 1 89 PHE N 1 89 PHE CA 1 89 PHE C 1 90 ASN N -45.60 -17.80 -38.50 -37.89 -41.38 . . 0 "[ . 1 ]"
126 . 1 91 LEU C 1 92 GLU N 1 92 GLU CA 1 92 GLU C -83.10 -50.30 -74.31 -81.75 -84.24 1.14 1 0 "[ . 1 ]"
127 . 1 92 GLU N 1 92 GLU CA 1 92 GLU C 1 93 GLY N 130.50 143.50 130.90 130.12 133.86 0.38 4 0 "[ . 1 ]"
128 . 1 94 SER C 1 95 LEU N 1 95 LEU CA 1 95 LEU C -62.50 -54.50 -59.54 -58.21 -59.21 . . 0 "[ . 1 ]"
129 . 1 95 LEU N 1 95 LEU CA 1 95 LEU C 1 96 ILE N -46.50 -30.70 -41.51 -46.39 -34.52 . . 0 "[ . 1 ]"
130 . 1 95 LEU C 1 96 ILE N 1 96 ILE CA 1 96 ILE C -65.80 -56.60 -61.28 -59.86 -61.00 0.06 5 0 "[ . 1 ]"
131 . 1 96 ILE N 1 96 ILE CA 1 96 ILE C 1 97 TYR N -49.40 -39.80 -41.68 -41.44 -42.01 0.25 9 0 "[ . 1 ]"
132 . 1 96 ILE C 1 97 TYR N 1 97 TYR CA 1 97 TYR C -66.20 -59.40 -60.83 -62.66 -59.24 0.16 1 0 "[ . 1 ]"
133 . 1 97 TYR N 1 97 TYR CA 1 97 TYR C 1 98 GLU N -49.20 -38.20 -45.34 -48.79 -40.22 . . 0 "[ . 1 ]"
134 . 1 97 TYR C 1 98 GLU N 1 98 GLU CA 1 98 GLU C -67.30 -61.30 -61.19 -62.81 -60.25 1.05 1 0 "[ . 1 ]"
135 . 1 98 GLU N 1 98 GLU CA 1 98 GLU C 1 99 ASP N -47.90 -36.30 -40.65 -41.01 -42.12 0.22 3 0 "[ . 1 ]"
136 . 1 98 GLU C 1 99 ASP N 1 99 ASP CA 1 99 ASP C -71.10 -57.30 -60.38 -61.97 -62.60 0.55 5 0 "[ . 1 ]"
137 . 1 99 ASP N 1 99 ASP CA 1 99 ASP C 1 100 SER N -51.20 -35.00 -40.92 -44.01 -35.76 . . 0 "[ . 1 ]"
138 . 1 99 ASP C 1 100 SER N 1 100 SER CA 1 100 SER C -70.00 -60.00 -62.88 -62.18 -65.42 0.49 2 0 "[ . 1 ]"
139 . 1 100 SER N 1 100 SER CA 1 100 SER C 1 101 ILE N -44.40 -33.60 -39.38 -42.55 -34.16 . . 0 "[ . 1 ]"
140 . 1 100 SER C 1 101 ILE N 1 101 ILE CA 1 101 ILE C -71.60 -62.40 -65.65 -66.80 -70.51 0.10 6 0 "[ . 1 ]"
141 . 1 101 ILE N 1 101 ILE CA 1 101 ILE C 1 102 VAL N -47.90 -39.10 -45.51 -44.70 -46.13 0.32 9 0 "[ . 1 ]"
142 . 1 101 ILE C 1 102 VAL N 1 102 VAL CA 1 102 VAL C -66.60 -60.20 -62.09 -66.84 -58.87 1.33 1 0 "[ . 1 ]"
143 . 1 102 VAL N 1 102 VAL CA 1 102 VAL C 1 103 LEU N -48.80 -41.20 -45.91 -48.07 -48.34 0.39 6 0 "[ . 1 ]"
144 . 1 102 VAL C 1 103 LEU N 1 103 LEU CA 1 103 LEU C -63.50 -56.50 -60.30 -63.91 -56.12 0.41 5 0 "[ . 1 ]"
145 . 1 103 LEU N 1 103 LEU CA 1 103 LEU C 1 104 GLN N -45.50 -37.50 -42.20 -45.52 -48.52 3.02 1 0 "[ . 1 ]"
146 . 1 103 LEU C 1 104 GLN N 1 104 GLN CA 1 104 GLN C -65.70 -59.10 -62.57 -65.86 -57.78 1.32 1 0 "[ . 1 ]"
147 . 1 104 GLN N 1 104 GLN CA 1 104 GLN C 1 105 SER N -46.20 -38.00 -43.14 -44.62 -45.43 . . 0 "[ . 1 ]"
148 . 1 104 GLN C 1 105 SER N 1 105 SER CA 1 105 SER C -72.60 -60.00 -62.04 -66.94 -59.91 0.09 8 0 "[ . 1 ]"
149 . 1 105 SER N 1 105 SER CA 1 105 SER C 1 106 VAL N -48.50 -30.50 -46.38 -43.91 -44.65 0.20 11 0 "[ . 1 ]"
150 . 1 105 SER C 1 106 VAL N 1 106 VAL CA 1 106 VAL C -73.80 -60.40 -66.88 -73.39 -60.40 0.00 8 0 "[ . 1 ]"
151 . 1 106 VAL N 1 106 VAL CA 1 106 VAL C 1 107 PHE N -46.30 -37.90 -42.04 -46.35 -38.30 0.05 2 0 "[ . 1 ]"
152 . 1 106 VAL C 1 107 PHE N 1 107 PHE CA 1 107 PHE C -66.70 -55.70 -61.76 -60.60 -61.73 0.39 10 0 "[ . 1 ]"
153 . 1 107 PHE N 1 107 PHE CA 1 107 PHE C 1 108 THR N -44.70 -32.90 -41.75 -45.12 -37.58 0.42 5 0 "[ . 1 ]"
154 . 1 107 PHE C 1 108 THR N 1 108 THR CA 1 108 THR C -68.90 -61.90 -62.79 -66.62 -60.70 1.20 1 0 "[ . 1 ]"
155 . 1 108 THR N 1 108 THR CA 1 108 THR C 1 109 SER N -47.70 -33.10 -40.59 -41.33 -43.32 . . 0 "[ . 1 ]"
156 . 1 108 THR C 1 109 SER N 1 109 SER CA 1 109 SER C -66.20 -61.20 -62.88 -62.16 -62.86 0.19 3 0 "[ . 1 ]"
157 . 1 109 SER N 1 109 SER CA 1 109 SER C 1 110 VAL N -43.90 -34.90 -42.43 -44.59 -37.97 0.69 11 0 "[ . 1 ]"
158 . 1 109 SER C 1 110 VAL N 1 110 VAL CA 1 110 VAL C -72.80 -62.20 -67.05 -70.56 -62.87 . . 0 "[ . 1 ]"
159 . 1 110 VAL N 1 110 VAL CA 1 110 VAL C 1 111 ARG N -49.60 -38.00 -48.10 -50.12 -45.83 0.52 9 0 "[ . 1 ]"
160 . 1 110 VAL C 1 111 ARG N 1 111 ARG CA 1 111 ARG C -69.60 -54.80 -60.01 -66.81 -55.68 . . 0 "[ . 1 ]"
161 . 1 111 ARG N 1 111 ARG CA 1 111 ARG C 1 112 GLN N -48.80 -32.40 -42.03 -45.74 -50.12 1.32 1 0 "[ . 1 ]"
162 . 1 111 ARG C 1 112 GLN N 1 112 GLN CA 1 112 GLN C -67.20 -56.20 -63.75 -60.35 -64.61 0.45 9 0 "[ . 1 ]"
163 . 1 112 GLN N 1 112 GLN CA 1 112 GLN C 1 113 LYS N -51.30 -28.30 -44.58 -38.42 -42.66 . . 0 "[ . 1 ]"
164 . 1 112 GLN C 1 113 LYS N 1 113 LYS CA 1 113 LYS C -68.40 -61.00 -65.84 -68.67 -60.78 0.27 10 0 "[ . 1 ]"
165 . 1 113 LYS N 1 113 LYS CA 1 113 LYS C 1 114 ILE N -50.70 -29.50 -46.25 -49.02 -61.67 10.97 1 1 "[+ . 1 ]"
166 . 1 113 LYS C 1 114 ILE N 1 114 ILE CA 1 114 ILE C -80.90 -56.90 -60.32 -73.37 -46.30 10.60 1 1 "[+ . 1 ]"
167 . 1 114 ILE N 1 114 ILE CA 1 114 ILE C 1 115 GLU N -47.20 -35.80 -41.81 -47.55 -35.23 0.57 11 0 "[ . 1 ]"
168 . 1 114 ILE C 1 115 GLU N 1 115 GLU CA 1 115 GLU C -69.10 -53.10 -68.42 -69.69 -72.80 3.70 1 0 "[ . 1 ]"
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