NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
606584 |
5kiz   |
30118 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_5kiz
save_dihedral_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 502
_TA_constraint_stats_list.Viol_total 11706.61
_TA_constraint_stats_list.Viol_max 4.98
_TA_constraint_stats_list.Viol_rms 0.54
_TA_constraint_stats_list.Viol_average_all_restraints 0.16
_TA_constraint_stats_list.Viol_average_violations_only 1.17
_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 4 LEU C 1 5 ASP N 1 5 ASP CA 1 5 ASP C -74.88 -48.78 -73.30 -76.78 -61.68 1.90 15 0 "[ . 1 . 2]"
2 . 1 5 ASP C 1 6 SER N 1 6 SER CA 1 6 SER C -125.53 -55.25 -76.16 -78.17 -80.12 4.98 9 0 "[ . 1 . 2]"
3 . 1 7 LYS C 1 8 THR N 1 8 THR CA 1 8 THR C -158.80 -96.88 -147.70 -151.08 -151.25 . . 0 "[ . 1 . 2]"
4 . 1 8 THR C 1 9 PHE N 1 9 PHE CA 1 9 PHE C -165.51 -111.39 -146.22 -150.56 -142.85 . . 0 "[ . 1 . 2]"
5 . 1 9 PHE C 1 10 LEU N 1 10 LEU CA 1 10 LEU C -138.80 -70.96 -72.30 -77.74 -70.28 0.68 6 0 "[ . 1 . 2]"
6 . 1 10 LEU C 1 11 SER N 1 11 SER CA 1 11 SER C -171.23 -91.09 -152.70 -156.94 -140.65 . . 0 "[ . 1 . 2]"
7 . 1 11 SER C 1 12 ARG N 1 12 ARG CA 1 12 ARG C -179.22 -93.34 -131.13 -136.14 -124.79 . . 0 "[ . 1 . 2]"
8 . 1 12 ARG C 1 13 PHE N 1 13 PHE CA 1 13 PHE C -149.77 -120.89 -121.32 -120.39 -120.60 1.60 2 0 "[ . 1 . 2]"
9 . 1 13 PHE C 1 14 SER N 1 14 SER CA 1 14 SER C -151.21 -49.83 -80.91 -95.62 -68.05 . . 0 "[ . 1 . 2]"
10 . 1 14 SER C 1 15 MET N 1 15 MET CA 1 15 MET C -108.16 -31.30 -62.95 -61.43 -63.33 . . 0 "[ . 1 . 2]"
11 . 1 16 ASP C 1 17 MET N 1 17 MET CA 1 17 MET C 36.21 78.73 63.92 58.34 68.54 . . 0 "[ . 1 . 2]"
12 . 1 17 MET C 1 18 LYS N 1 18 LYS CA 1 18 LYS C -140.66 -60.50 -101.16 -99.74 -100.49 . . 0 "[ . 1 . 2]"
13 . 1 19 PHE C 1 20 THR N 1 20 THR CA 1 20 THR C -123.49 -69.45 -115.56 -118.93 -110.38 . . 0 "[ . 1 . 2]"
14 . 1 20 THR C 1 21 TYR N 1 21 TYR CA 1 21 TYR C 163.43 -88.41 -150.97 -151.27 -152.03 . . 0 "[ . 1 . 2]"
15 . 1 21 TYR C 1 22 CYS N 1 22 CYS CA 1 22 CYS C -158.66 -58.78 -151.76 -151.22 -151.33 . . 0 "[ . 1 . 2]"
16 . 1 23 ASP C 1 24 ASP N 1 24 ASP CA 1 24 ASP C -71.32 -49.22 -61.47 -66.44 -50.79 . . 0 "[ . 1 . 2]"
17 . 1 24 ASP C 1 25 ARG N 1 25 ARG CA 1 25 ARG C -79.73 -47.73 -51.83 -51.19 -51.70 0.34 6 0 "[ . 1 . 2]"
18 . 1 25 ARG C 1 26 ILE N 1 26 ILE CA 1 26 ILE C -72.06 -52.06 -50.10 -50.17 -50.26 2.65 17 0 "[ . 1 . 2]"
19 . 1 26 ILE C 1 27 THR N 1 27 THR CA 1 27 THR C -74.08 -54.08 -75.66 -75.68 -75.88 2.18 1 0 "[ . 1 . 2]"
20 . 1 27 THR C 1 28 GLU N 1 28 GLU CA 1 28 GLU C -92.47 -47.97 -72.90 -75.89 -70.25 . . 0 "[ . 1 . 2]"
21 . 1 28 GLU C 1 29 LEU N 1 29 LEU CA 1 29 LEU C -107.65 -57.63 -96.19 -93.67 -93.80 . . 0 "[ . 1 . 2]"
22 . 1 29 LEU C 1 30 ILE N 1 30 ILE CA 1 30 ILE C -124.33 -80.01 -124.04 -125.19 -122.09 0.86 10 0 "[ . 1 . 2]"
23 . 1 30 ILE C 1 31 GLY N 1 31 GLY CA 1 31 GLY C 47.74 100.62 104.21 103.75 103.67 4.62 8 0 "[ . 1 . 2]"
24 . 1 31 GLY C 1 32 TYR N 1 32 TYR CA 1 32 TYR C -121.07 -56.73 -81.81 -83.64 -76.97 . . 0 "[ . 1 . 2]"
25 . 1 32 TYR C 1 33 HIS N 1 33 HIS CA 1 33 HIS C -118.55 -40.95 -75.93 -84.85 -71.38 . . 0 "[ . 1 . 2]"
26 . 1 33 HIS C 1 34 PRO N 1 34 PRO CA 1 34 PRO C -63.34 -39.34 -48.44 -53.07 -46.36 . . 0 "[ . 1 . 2]"
27 . 1 34 PRO C 1 35 GLU N 1 35 GLU CA 1 35 GLU C -77.78 -55.18 -66.10 -69.88 -71.74 0.10 4 0 "[ . 1 . 2]"
28 . 1 35 GLU C 1 36 GLU N 1 36 GLU CA 1 36 GLU C -107.75 -39.09 -70.38 -71.35 -71.74 . . 0 "[ . 1 . 2]"
29 . 1 36 GLU C 1 37 LEU N 1 37 LEU CA 1 37 LEU C -96.42 -47.54 -96.53 -97.32 -97.62 2.00 9 0 "[ . 1 . 2]"
30 . 1 38 LEU C 1 39 GLY N 1 39 GLY CA 1 39 GLY C 64.84 120.66 120.80 120.68 119.48 1.26 20 0 "[ . 1 . 2]"
31 . 1 40 ARG C 1 41 SER N 1 41 SER CA 1 41 SER C -145.06 -19.54 -115.81 -115.28 -116.76 . . 0 "[ . 1 . 2]"
32 . 1 41 SER C 1 42 ALA N 1 42 ALA CA 1 42 ALA C -74.08 -42.20 -71.42 -73.24 -73.89 0.90 3 0 "[ . 1 . 2]"
33 . 1 42 ALA C 1 43 SER N 1 43 SER CA 1 43 SER C -101.36 -45.38 -57.39 -56.26 -58.55 . . 0 "[ . 1 . 2]"
34 . 1 43 SER C 1 44 GLU N 1 44 GLU CA 1 44 GLU C -90.69 -43.25 -66.72 -68.44 -69.65 . . 0 "[ . 1 . 2]"
35 . 1 44 GLU C 1 45 PHE N 1 45 PHE CA 1 45 PHE C -119.63 -75.27 -103.13 -106.53 -107.42 . . 0 "[ . 1 . 2]"
36 . 1 46 TRP C 1 47 HIS N 1 47 HIS CA 1 47 HIS C -95.29 -45.03 -52.29 -53.95 -54.42 . . 0 "[ . 1 . 2]"
37 . 1 47 HIS C 1 48 ALA N 1 48 ALA CA 1 48 ALA C -70.29 -43.93 -52.46 -60.18 -43.59 0.34 13 0 "[ . 1 . 2]"
38 . 1 48 ALA C 1 49 LEU N 1 49 LEU CA 1 49 LEU C -85.78 -55.02 -75.91 -83.28 -70.05 . . 0 "[ . 1 . 2]"
39 . 1 49 LEU C 1 50 ASP N 1 50 ASP CA 1 50 ASP C -135.31 -41.17 -126.58 -136.60 -101.69 1.29 18 0 "[ . 1 . 2]"
40 . 1 50 ASP C 1 51 SER N 1 51 SER CA 1 51 SER C -73.90 -43.78 -60.64 -60.18 -60.94 . . 0 "[ . 1 . 2]"
41 . 1 51 SER C 1 52 GLU N 1 52 GLU CA 1 52 GLU C -76.83 -55.53 -61.88 -58.32 -60.65 0.29 19 0 "[ . 1 . 2]"
42 . 1 52 GLU C 1 53 ASN N 1 53 ASN CA 1 53 ASN C -74.07 -54.07 -57.59 -55.20 -55.95 0.02 16 0 "[ . 1 . 2]"
43 . 1 53 ASN C 1 54 MET N 1 54 MET CA 1 54 MET C -76.45 -56.45 -61.87 -76.92 -55.23 1.22 14 0 "[ . 1 . 2]"
44 . 1 54 MET C 1 55 THR N 1 55 THR CA 1 55 THR C -73.86 -53.86 -64.95 -63.47 -64.19 0.63 4 0 "[ . 1 . 2]"
45 . 1 55 THR C 1 56 LYS N 1 56 LYS CA 1 56 LYS C -75.25 -55.07 -63.14 -69.65 -56.47 . . 0 "[ . 1 . 2]"
46 . 1 56 LYS C 1 57 SER N 1 57 SER CA 1 57 SER C -75.66 -55.66 -60.25 -59.74 -59.95 0.48 10 0 "[ . 1 . 2]"
47 . 1 57 SER C 1 58 HIS N 1 58 HIS CA 1 58 HIS C -72.00 -52.00 -66.86 -61.63 -63.76 1.25 9 0 "[ . 1 . 2]"
48 . 1 58 HIS C 1 59 GLN N 1 59 GLN CA 1 59 GLN C -74.80 -54.80 -68.67 -75.15 -59.68 0.35 11 0 "[ . 1 . 2]"
49 . 1 59 GLN C 1 60 ASN N 1 60 ASN CA 1 60 ASN C -75.13 -51.07 -74.25 -68.25 -69.77 2.62 13 0 "[ . 1 . 2]"
50 . 1 62 CYS C 1 63 THR N 1 63 THR CA 1 63 THR C -108.64 -39.30 -54.70 -79.49 -45.90 . . 0 "[ . 1 . 2]"
51 . 1 63 THR C 1 64 LYS N 1 64 LYS CA 1 64 LYS C -107.94 -76.18 -101.30 -110.23 -75.69 2.29 9 0 "[ . 1 . 2]"
52 . 1 64 LYS C 1 65 GLY N 1 65 GLY CA 1 65 GLY C 45.56 104.06 86.02 77.96 97.54 . . 0 "[ . 1 . 2]"
53 . 1 65 GLY C 1 66 GLN N 1 66 GLN CA 1 66 GLN C -156.09 -48.41 -154.70 -160.40 -143.58 4.31 19 0 "[ . 1 . 2]"
54 . 1 66 GLN C 1 67 VAL N 1 67 VAL CA 1 67 VAL C -149.48 -99.68 -141.60 -150.17 -124.28 0.69 6 0 "[ . 1 . 2]"
55 . 1 67 VAL C 1 68 VAL N 1 68 VAL CA 1 68 VAL C -164.59 -93.93 -125.97 -139.38 -105.02 . . 0 "[ . 1 . 2]"
56 . 1 70 GLY C 1 71 GLN N 1 71 GLN CA 1 71 GLN C -144.41 -53.25 -60.91 -74.58 -51.61 1.64 10 0 "[ . 1 . 2]"
57 . 1 71 GLN C 1 72 TYR N 1 72 TYR CA 1 72 TYR C -173.57 -101.99 -120.68 -114.57 -119.58 . . 0 "[ . 1 . 2]"
58 . 1 72 TYR C 1 73 ARG N 1 73 ARG CA 1 73 ARG C -159.48 -86.88 -98.94 -109.68 -86.26 0.62 9 0 "[ . 1 . 2]"
59 . 1 73 ARG C 1 74 MET N 1 74 MET CA 1 74 MET C -141.12 -102.94 -112.16 -112.27 -112.64 0.11 20 0 "[ . 1 . 2]"
60 . 1 74 MET C 1 75 LEU N 1 75 LEU CA 1 75 LEU C -118.01 -61.61 -62.39 -61.62 -61.69 0.32 4 0 "[ . 1 . 2]"
61 . 1 76 ALA C 1 77 LYS N 1 77 LYS CA 1 77 LYS C -77.06 -43.96 -47.49 -45.44 -45.95 . . 0 "[ . 1 . 2]"
62 . 1 77 LYS C 1 78 HIS N 1 78 HIS CA 1 78 HIS C -105.79 -63.03 -100.96 -106.41 -93.67 0.62 12 0 "[ . 1 . 2]"
63 . 1 80 GLY C 1 81 TYR N 1 81 TYR CA 1 81 TYR C -173.07 -109.61 -160.09 -162.47 -157.98 . . 0 "[ . 1 . 2]"
64 . 1 81 TYR C 1 82 VAL N 1 82 VAL CA 1 82 VAL C -159.46 -96.86 -160.87 -161.91 -159.96 2.45 9 0 "[ . 1 . 2]"
65 . 1 82 VAL C 1 83 TRP N 1 83 TRP CA 1 83 TRP C -140.61 -82.17 -115.97 -113.81 -114.08 . . 0 "[ . 1 . 2]"
66 . 1 83 TRP C 1 84 LEU N 1 84 LEU CA 1 84 LEU C -157.91 -82.37 -148.43 -149.36 -152.54 . . 0 "[ . 1 . 2]"
67 . 1 84 LEU C 1 85 GLU N 1 85 GLU CA 1 85 GLU C 178.10 -99.08 -106.01 -111.47 -114.02 0.27 6 0 "[ . 1 . 2]"
68 . 1 85 GLU C 1 86 THR N 1 86 THR CA 1 86 THR C -159.26 -96.98 -109.23 -107.95 -110.09 . . 0 "[ . 1 . 2]"
69 . 1 86 THR C 1 87 GLN N 1 87 GLN CA 1 87 GLN C -145.07 -82.91 -95.26 -97.43 -98.41 . . 0 "[ . 1 . 2]"
70 . 1 87 GLN C 1 88 MET N 1 88 MET CA 1 88 MET C -151.77 -93.01 -110.73 -118.70 -98.52 . . 0 "[ . 1 . 2]"
71 . 1 88 MET C 1 89 THR N 1 89 THR CA 1 89 THR C -161.13 -95.53 -132.65 -144.43 -126.11 . . 0 "[ . 1 . 2]"
72 . 1 89 THR C 1 90 VAL N 1 90 VAL CA 1 90 VAL C -120.55 -70.63 -76.54 -76.92 -77.87 0.24 9 0 "[ . 1 . 2]"
73 . 1 90 VAL C 1 91 ILE N 1 91 ILE CA 1 91 ILE C -140.87 -68.15 -101.00 -104.78 -97.18 . . 0 "[ . 1 . 2]"
74 . 1 91 ILE C 1 92 TYR N 1 92 TYR CA 1 92 TYR C -136.98 -58.30 -81.50 -86.90 -75.29 . . 0 "[ . 1 . 2]"
75 . 1 92 TYR C 1 93 ASN N 1 93 ASN CA 1 93 ASN C -111.19 -46.27 -79.66 -84.13 -88.48 . . 0 "[ . 1 . 2]"
76 . 1 93 ASN C 1 94 PRO N 1 94 PRO CA 1 94 PRO C -74.34 -35.28 -51.40 -56.79 -46.41 . . 0 "[ . 1 . 2]"
77 . 1 94 PRO C 1 95 ARG N 1 95 ARG CA 1 95 ARG C -82.54 -50.20 -79.64 -79.12 -80.17 1.59 15 0 "[ . 1 . 2]"
78 . 1 95 ARG C 1 96 ASN N 1 96 ASN CA 1 96 ASN C -124.99 -79.81 -123.29 -126.34 -113.08 1.35 13 0 "[ . 1 . 2]"
79 . 1 96 ASN C 1 97 LEU N 1 97 LEU CA 1 97 LEU C 44.46 73.42 57.39 54.62 61.20 . . 0 "[ . 1 . 2]"
80 . 1 97 LEU C 1 98 GLN N 1 98 GLN CA 1 98 GLN C -140.11 -55.73 -108.05 -103.68 -104.58 . . 0 "[ . 1 . 2]"
81 . 1 99 PRO C 1 100 GLN N 1 100 GLN CA 1 100 GLN C -123.85 -69.11 -105.28 -123.49 -86.86 . . 0 "[ . 1 . 2]"
82 . 1 100 GLN C 1 101 CYS N 1 101 CYS CA 1 101 CYS C 167.16 -117.68 -135.68 -138.90 -142.95 1.83 13 0 "[ . 1 . 2]"
83 . 1 101 CYS C 1 102 ILE N 1 102 ILE CA 1 102 ILE C -154.15 -98.77 -112.65 -126.86 -98.72 0.05 17 0 "[ . 1 . 2]"
84 . 1 102 ILE C 1 103 MET N 1 103 MET CA 1 103 MET C -148.74 -75.26 -84.88 -85.53 -86.05 0.54 19 0 "[ . 1 . 2]"
85 . 1 103 MET C 1 104 ALA N 1 104 ALA CA 1 104 ALA C -135.65 -107.51 -114.05 -117.19 -108.94 . . 0 "[ . 1 . 2]"
86 . 1 104 ALA C 1 105 VAL N 1 105 VAL CA 1 105 VAL C -126.93 -90.65 -105.77 -105.98 -106.76 . . 0 "[ . 1 . 2]"
87 . 1 105 VAL C 1 106 ASN N 1 106 ASN CA 1 106 ASN C -146.56 -93.10 -107.09 -108.57 -108.57 . . 0 "[ . 1 . 2]"
88 . 1 106 ASN C 1 107 TYR N 1 107 TYR CA 1 107 TYR C -148.08 -56.92 -146.12 -148.72 -142.22 0.64 6 0 "[ . 1 . 2]"
89 . 1 107 TYR C 1 108 VAL N 1 108 VAL CA 1 108 VAL C -107.41 -60.17 -95.03 -93.75 -93.93 . . 0 "[ . 1 . 2]"
90 . 1 108 VAL C 1 109 LEU N 1 109 LEU CA 1 109 LEU C -124.92 -78.24 -81.90 -83.41 -83.81 0.84 15 0 "[ . 1 . 2]"
91 . 1 109 LEU C 1 110 SER N 1 110 SER CA 1 110 SER C 166.74 -67.90 -157.34 -159.14 -159.67 . . 0 "[ . 1 . 2]"
92 . 1 110 SER C 1 111 GLU N 1 111 GLU CA 1 111 GLU C -130.40 -52.06 -79.75 -85.42 -74.37 . . 0 "[ . 1 . 2]"
93 . 1 112 ILE C 1 113 GLU N 1 113 GLU CA 1 113 GLU C -148.27 -50.29 -116.21 -128.43 -132.10 . . 0 "[ . 1 . 2]"
94 . 1 5 ASP N 1 5 ASP CA 1 5 ASP C 1 6 SER N -51.36 -1.76 -25.14 -22.42 -26.90 4.95 9 0 "[ . 1 . 2]"
95 . 1 6 SER N 1 6 SER CA 1 6 SER C 1 7 LYS N -45.35 26.63 -13.21 17.39 -1.23 3.18 9 0 "[ . 1 . 2]"
96 . 1 8 THR N 1 8 THR CA 1 8 THR C 1 9 PHE N 146.79 174.05 144.68 145.42 145.08 2.75 10 0 "[ . 1 . 2]"
97 . 1 9 PHE N 1 9 PHE CA 1 9 PHE C 1 10 LEU N 113.12 163.90 122.67 123.61 123.08 . . 0 "[ . 1 . 2]"
98 . 1 10 LEU N 1 10 LEU CA 1 10 LEU C 1 11 SER N 121.56 158.24 152.11 155.37 154.81 . . 0 "[ . 1 . 2]"
99 . 1 11 SER N 1 11 SER CA 1 11 SER C 1 12 ARG N 144.67 169.71 160.18 158.52 157.31 . . 0 "[ . 1 . 2]"
100 . 1 12 ARG N 1 12 ARG CA 1 12 ARG C 1 13 PHE N 121.87 171.43 139.99 133.58 149.50 . . 0 "[ . 1 . 2]"
101 . 1 13 PHE N 1 13 PHE CA 1 13 PHE C 1 14 SER N 124.29 166.59 152.86 153.30 151.73 . . 0 "[ . 1 . 2]"
102 . 1 14 SER N 1 14 SER CA 1 14 SER C 1 15 MET N 115.50 -146.02 173.61 168.59 160.71 . . 0 "[ . 1 . 2]"
103 . 1 15 MET N 1 15 MET CA 1 15 MET C 1 16 ASP N -60.25 25.05 -13.14 -32.57 15.60 . . 0 "[ . 1 . 2]"
104 . 1 17 MET N 1 17 MET CA 1 17 MET C 1 18 LYS N 11.39 65.37 37.44 36.22 33.24 . . 0 "[ . 1 . 2]"
105 . 1 18 LYS N 1 18 LYS CA 1 18 LYS C 1 19 PHE N 73.13 -157.69 143.05 143.71 143.40 . . 0 "[ . 1 . 2]"
106 . 1 20 THR N 1 20 THR CA 1 20 THR C 1 21 TYR N -39.40 21.58 -23.11 -27.81 -18.84 . . 0 "[ . 1 . 2]"
107 . 1 21 TYR N 1 21 TYR CA 1 21 TYR C 1 22 CYS N 127.30 151.68 146.46 144.94 148.80 . . 0 "[ . 1 . 2]"
108 . 1 22 CYS N 1 22 CYS CA 1 22 CYS C 1 23 ASP N 118.32 144.02 143.40 136.21 145.46 1.44 14 0 "[ . 1 . 2]"
109 . 1 24 ASP N 1 24 ASP CA 1 24 ASP C 1 25 ARG N -45.88 -17.02 -18.73 -17.96 -20.36 2.88 8 0 "[ . 1 . 2]"
110 . 1 25 ARG N 1 25 ARG CA 1 25 ARG C 1 26 ILE N -64.38 -13.56 -31.05 -34.53 -23.05 . . 0 "[ . 1 . 2]"
111 . 1 26 ILE N 1 26 ILE CA 1 26 ILE C 1 27 THR N -52.75 -32.75 -36.20 -36.58 -36.76 . . 0 "[ . 1 . 2]"
112 . 1 27 THR N 1 27 THR CA 1 27 THR C 1 28 GLU N -51.41 -28.15 -27.00 -26.68 -26.74 1.96 6 0 "[ . 1 . 2]"
113 . 1 28 GLU N 1 28 GLU CA 1 28 GLU C 1 29 LEU N -55.51 -16.73 -41.37 -44.74 -35.93 . . 0 "[ . 1 . 2]"
114 . 1 29 LEU N 1 29 LEU CA 1 29 LEU C 1 30 ILE N -61.53 -3.49 -28.31 -27.67 -28.68 . . 0 "[ . 1 . 2]"
115 . 1 30 ILE N 1 30 ILE CA 1 30 ILE C 1 31 GLY N -37.71 15.09 -35.89 -36.37 -36.61 . . 0 "[ . 1 . 2]"
116 . 1 31 GLY N 1 31 GLY CA 1 31 GLY C 1 32 TYR N -10.52 58.72 -1.90 -9.98 1.18 . . 0 "[ . 1 . 2]"
117 . 1 32 TYR N 1 32 TYR CA 1 32 TYR C 1 33 HIS N 132.54 160.62 141.09 134.97 154.72 . . 0 "[ . 1 . 2]"
118 . 1 33 HIS N 1 33 HIS CA 1 33 HIS C 1 34 PRO N 101.01 -174.31 139.60 139.65 139.54 . . 0 "[ . 1 . 2]"
119 . 1 34 PRO N 1 34 PRO CA 1 34 PRO C 1 35 GLU N -49.21 -25.73 -47.96 -49.95 -45.01 0.74 16 0 "[ . 1 . 2]"
120 . 1 35 GLU N 1 35 GLU CA 1 35 GLU C 1 36 GLU N -48.83 -2.59 -21.49 -32.11 -16.63 . . 0 "[ . 1 . 2]"
121 . 1 36 GLU N 1 36 GLU CA 1 36 GLU C 1 37 LEU N -57.94 -7.66 -23.30 -29.12 -20.64 . . 0 "[ . 1 . 2]"
122 . 1 37 LEU N 1 37 LEU CA 1 37 LEU C 1 38 LEU N -56.76 -3.44 -28.79 -28.59 -29.12 . . 0 "[ . 1 . 2]"
123 . 1 39 GLY N 1 39 GLY CA 1 39 GLY C 1 40 ARG N -26.86 32.44 -6.06 -11.46 4.74 . . 0 "[ . 1 . 2]"
124 . 1 41 SER N 1 41 SER CA 1 41 SER C 1 42 ALA N 99.73 -172.63 150.98 144.14 158.07 . . 0 "[ . 1 . 2]"
125 . 1 42 ALA N 1 42 ALA CA 1 42 ALA C 1 43 SER N -48.09 -11.79 -34.75 -44.07 -25.03 . . 0 "[ . 1 . 2]"
126 . 1 43 SER N 1 43 SER CA 1 43 SER C 1 44 GLU N -45.19 8.15 -17.83 -23.63 -11.73 . . 0 "[ . 1 . 2]"
127 . 1 44 GLU N 1 44 GLU CA 1 44 GLU C 1 45 PHE N -56.62 1.54 -35.30 -31.13 -32.19 . . 0 "[ . 1 . 2]"
128 . 1 45 PHE N 1 45 PHE CA 1 45 PHE C 1 46 TRP N -19.47 18.27 -1.85 -13.42 19.02 0.75 11 0 "[ . 1 . 2]"
129 . 1 47 HIS N 1 47 HIS CA 1 47 HIS C 1 48 ALA N 113.49 150.19 120.71 123.28 122.81 . . 0 "[ . 1 . 2]"
130 . 1 48 ALA N 1 48 ALA CA 1 48 ALA C 1 49 LEU N -56.94 -11.58 -43.28 -43.80 -44.80 . . 0 "[ . 1 . 2]"
131 . 1 49 LEU N 1 49 LEU CA 1 49 LEU C 1 50 ASP N -60.22 6.64 1.46 6.59 4.15 1.09 7 0 "[ . 1 . 2]"
132 . 1 50 ASP N 1 50 ASP CA 1 50 ASP C 1 51 SER N -75.05 25.05 -18.43 -37.74 -7.19 . . 0 "[ . 1 . 2]"
133 . 1 51 SER N 1 51 SER CA 1 51 SER C 1 52 GLU N -60.11 -28.07 -37.94 -55.11 -27.98 0.09 4 0 "[ . 1 . 2]"
134 . 1 52 GLU N 1 52 GLU CA 1 52 GLU C 1 53 ASN N -53.92 -33.92 -55.10 -51.53 -54.02 2.95 8 0 "[ . 1 . 2]"
135 . 1 53 ASN N 1 53 ASN CA 1 53 ASN C 1 54 MET N -54.92 -34.92 -44.35 -52.43 -37.85 . . 0 "[ . 1 . 2]"
136 . 1 54 MET N 1 54 MET CA 1 54 MET C 1 55 THR N -52.97 -21.95 -31.45 -35.72 -38.56 3.76 8 0 "[ . 1 . 2]"
137 . 1 55 THR N 1 55 THR CA 1 55 THR C 1 56 LYS N -54.01 -34.01 -40.85 -45.64 -33.82 0.19 5 0 "[ . 1 . 2]"
138 . 1 56 LYS N 1 56 LYS CA 1 56 LYS C 1 57 SER N -51.49 -29.21 -27.75 -28.42 -28.58 3.37 16 0 "[ . 1 . 2]"
139 . 1 57 SER N 1 57 SER CA 1 57 SER C 1 58 HIS N -51.62 -30.76 -45.97 -51.74 -40.82 0.12 15 0 "[ . 1 . 2]"
140 . 1 58 HIS N 1 58 HIS CA 1 58 HIS C 1 59 GLN N -56.57 -27.59 -30.26 -33.49 -33.87 1.73 9 0 "[ . 1 . 2]"
141 . 1 59 GLN N 1 59 GLN CA 1 59 GLN C 1 60 ASN N -55.32 -21.84 -33.02 -31.16 -32.70 . . 0 "[ . 1 . 2]"
142 . 1 62 CYS N 1 62 CYS CA 1 62 CYS C 1 63 THR N -55.56 -18.36 -21.78 -40.19 -16.58 1.78 9 0 "[ . 1 . 2]"
143 . 1 63 THR N 1 63 THR CA 1 63 THR C 1 64 LYS N -65.75 5.39 -62.42 -68.34 -50.64 2.59 9 0 "[ . 1 . 2]"
144 . 1 64 LYS N 1 64 LYS CA 1 64 LYS C 1 65 GLY N -29.82 14.42 4.70 -26.66 15.61 1.19 11 0 "[ . 1 . 2]"
145 . 1 65 GLY N 1 65 GLY CA 1 65 GLY C 1 66 GLN N -4.72 60.12 -0.60 7.00 5.54 4.69 19 0 "[ . 1 . 2]"
146 . 1 66 GLN N 1 66 GLN CA 1 66 GLN C 1 67 VAL N 121.32 175.74 166.16 145.46 177.72 1.98 10 0 "[ . 1 . 2]"
147 . 1 67 VAL N 1 67 VAL CA 1 67 VAL C 1 68 VAL N 106.00 179.20 143.02 156.16 147.94 . . 0 "[ . 1 . 2]"
148 . 1 68 VAL N 1 68 VAL CA 1 68 VAL C 1 69 SER N 100.73 163.31 118.90 131.50 125.56 0.97 12 0 "[ . 1 . 2]"
149 . 1 71 GLN N 1 71 GLN CA 1 71 GLN C 1 72 TYR N 83.82 -172.28 108.92 86.58 130.77 . . 0 "[ . 1 . 2]"
150 . 1 72 TYR N 1 72 TYR CA 1 72 TYR C 1 73 ARG N 106.72 -170.40 168.37 158.70 179.82 . . 0 "[ . 1 . 2]"
151 . 1 73 ARG N 1 73 ARG CA 1 73 ARG C 1 74 MET N 98.93 167.57 128.71 130.48 129.28 . . 0 "[ . 1 . 2]"
152 . 1 74 MET N 1 74 MET CA 1 74 MET C 1 75 LEU N 114.42 150.52 141.68 140.55 139.75 . . 0 "[ . 1 . 2]"
153 . 1 75 LEU N 1 75 LEU CA 1 75 LEU C 1 76 ALA N 104.17 142.11 140.80 138.41 142.75 0.64 12 0 "[ . 1 . 2]"
154 . 1 77 LYS N 1 77 LYS CA 1 77 LYS C 1 78 HIS N -53.07 -12.17 -46.83 -48.35 -49.12 . . 0 "[ . 1 . 2]"
155 . 1 78 HIS N 1 78 HIS CA 1 78 HIS C 1 79 GLY N -31.49 27.49 25.48 20.64 28.50 1.01 15 0 "[ . 1 . 2]"
156 . 1 81 TYR N 1 81 TYR CA 1 81 TYR C 1 82 VAL N 137.65 177.71 174.28 174.25 174.03 . . 0 "[ . 1 . 2]"
157 . 1 82 VAL N 1 82 VAL CA 1 82 VAL C 1 83 TRP N 113.05 172.31 163.05 160.30 167.47 . . 0 "[ . 1 . 2]"
158 . 1 83 TRP N 1 83 TRP CA 1 83 TRP C 1 84 LEU N 108.07 158.45 117.29 115.70 119.31 . . 0 "[ . 1 . 2]"
159 . 1 84 LEU N 1 84 LEU CA 1 84 LEU C 1 85 GLU N 133.46 -177.36 152.01 146.71 158.45 . . 0 "[ . 1 . 2]"
160 . 1 85 GLU N 1 85 GLU CA 1 85 GLU C 1 86 THR N 120.50 151.04 134.31 126.15 144.48 . . 0 "[ . 1 . 2]"
161 . 1 86 THR N 1 86 THR CA 1 86 THR C 1 87 GLN N 100.97 150.23 117.01 105.51 124.53 . . 0 "[ . 1 . 2]"
162 . 1 87 GLN N 1 87 GLN CA 1 87 GLN C 1 88 MET N 108.25 141.43 119.51 127.17 123.36 . . 0 "[ . 1 . 2]"
163 . 1 88 MET N 1 88 MET CA 1 88 MET C 1 89 THR N 122.86 163.24 135.37 127.79 144.11 . . 0 "[ . 1 . 2]"
164 . 1 89 THR N 1 89 THR CA 1 89 THR C 1 90 VAL N 113.97 149.91 131.98 134.46 133.67 . . 0 "[ . 1 . 2]"
165 . 1 90 VAL N 1 90 VAL CA 1 90 VAL C 1 91 ILE N 108.59 136.69 121.69 120.35 119.63 . . 0 "[ . 1 . 2]"
166 . 1 91 ILE N 1 91 ILE CA 1 91 ILE C 1 92 TYR N 87.07 157.89 106.76 102.18 109.79 . . 0 "[ . 1 . 2]"
167 . 1 92 TYR N 1 92 TYR CA 1 92 TYR C 1 93 ASN N 92.20 168.22 152.86 144.46 161.78 . . 0 "[ . 1 . 2]"
168 . 1 93 ASN N 1 93 ASN CA 1 93 ASN C 1 94 PRO N 87.31 177.07 118.87 121.79 120.86 . . 0 "[ . 1 . 2]"
169 . 1 94 PRO N 1 94 PRO CA 1 94 PRO C 1 95 ARG N -48.81 -21.07 -20.90 -20.06 -20.26 1.32 7 0 "[ . 1 . 2]"
170 . 1 95 ARG N 1 95 ARG CA 1 95 ARG C 1 96 ASN N -53.10 -1.72 -46.32 -54.10 -40.22 1.00 11 0 "[ . 1 . 2]"
171 . 1 96 ASN N 1 96 ASN CA 1 96 ASN C 1 97 LEU N -22.38 34.04 -5.43 -3.10 -4.02 . . 0 "[ . 1 . 2]"
172 . 1 97 LEU N 1 97 LEU CA 1 97 LEU C 1 98 GLN N 15.39 59.27 45.12 44.51 43.09 . . 0 "[ . 1 . 2]"
173 . 1 98 GLN N 1 98 GLN CA 1 98 GLN C 1 99 PRO N 86.73 176.39 128.72 127.96 127.20 . . 0 "[ . 1 . 2]"
174 . 1 100 GLN N 1 100 GLN CA 1 100 GLN C 1 101 CYS N -63.25 -3.81 -48.44 -60.91 -26.52 . . 0 "[ . 1 . 2]"
175 . 1 101 CYS N 1 101 CYS CA 1 101 CYS C 1 102 ILE N 150.36 174.78 165.20 166.04 162.06 0.32 19 0 "[ . 1 . 2]"
176 . 1 102 ILE N 1 102 ILE CA 1 102 ILE C 1 103 MET N 93.51 161.71 125.44 117.12 134.99 . . 0 "[ . 1 . 2]"
177 . 1 103 MET N 1 103 MET CA 1 103 MET C 1 104 ALA N 108.37 146.67 107.35 107.53 107.49 2.16 5 0 "[ . 1 . 2]"
178 . 1 104 ALA N 1 104 ALA CA 1 104 ALA C 1 105 VAL N 113.58 154.20 122.95 118.04 126.53 . . 0 "[ . 1 . 2]"
179 . 1 105 VAL N 1 105 VAL CA 1 105 VAL C 1 106 ASN N 115.42 141.50 114.56 116.72 115.25 2.34 6 0 "[ . 1 . 2]"
180 . 1 106 ASN N 1 106 ASN CA 1 106 ASN C 1 107 TYR N 127.60 156.70 135.80 135.30 134.48 . . 0 "[ . 1 . 2]"
181 . 1 107 TYR N 1 107 TYR CA 1 107 TYR C 1 108 VAL N 88.58 174.92 135.23 133.29 136.84 . . 0 "[ . 1 . 2]"
182 . 1 108 VAL N 1 108 VAL CA 1 108 VAL C 1 109 LEU N 87.42 150.12 132.75 127.72 136.80 . . 0 "[ . 1 . 2]"
183 . 1 109 LEU N 1 109 LEU CA 1 109 LEU C 1 110 SER N -50.79 0.29 -28.42 -25.31 -25.77 . . 0 "[ . 1 . 2]"
184 . 1 110 SER N 1 110 SER CA 1 110 SER C 1 111 GLU N 93.56 -146.92 155.22 164.14 161.39 . . 0 "[ . 1 . 2]"
185 . 1 112 ILE N 1 112 ILE CA 1 112 ILE C 1 113 GLU N 108.13 147.75 147.03 150.06 148.62 2.31 2 0 "[ . 1 . 2]"
186 . 1 113 GLU N 1 113 GLU CA 1 113 GLU C 1 114 LYS N 96.88 157.16 107.70 93.76 122.87 3.12 5 0 "[ . 1 . 2]"
stop_
save_
Contact the webmaster for help, if required. Friday, May 10, 2024 4:27:42 AM GMT (wattos1)