NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
406384 |
1xmw   |
cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1xmw
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 193
_TA_constraint_stats_list.Viol_count 649
_TA_constraint_stats_list.Viol_total 7986.77
_TA_constraint_stats_list.Viol_max 5.05
_TA_constraint_stats_list.Viol_rms 0.56
_TA_constraint_stats_list.Viol_average_all_restraints 0.18
_TA_constraint_stats_list.Viol_average_violations_only 0.82
_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 8 TYR C 1 9 LYS N 1 9 LYS CA 1 9 LYS C -129.00 -69.00 -107.58 -127.21 -94.75 . . 0 "[ . 1 .]"
2 . 1 9 LYS N 1 9 LYS CA 1 9 LYS C 1 10 VAL N 97.00 157.00 157.43 150.23 158.45 1.45 1 0 "[ . 1 .]"
3 . 1 9 LYS C 1 10 VAL N 1 10 VAL CA 1 10 VAL C -145.00 -85.00 -138.66 -125.45 -133.93 0.95 4 0 "[ . 1 .]"
4 . 1 10 VAL N 1 10 VAL CA 1 10 VAL C 1 11 SER N 102.00 162.00 135.87 138.77 138.32 . . 0 "[ . 1 .]"
5 . 1 10 VAL C 1 11 SER N 1 11 SER CA 1 11 SER C -149.00 -89.00 -144.75 -147.94 -148.35 0.55 10 0 "[ . 1 .]"
6 . 1 11 SER N 1 11 SER CA 1 11 SER C 1 12 ILE N 91.00 151.00 90.56 90.36 90.24 0.95 3 0 "[ . 1 .]"
7 . 1 11 SER C 1 12 ILE N 1 12 ILE CA 1 12 ILE C -135.00 -75.00 -89.73 -96.96 -80.48 . . 0 "[ . 1 .]"
8 . 1 12 ILE N 1 12 ILE CA 1 12 ILE C 1 13 SER N 95.00 155.00 135.57 137.35 137.09 . . 0 "[ . 1 .]"
9 . 1 12 ILE C 1 13 SER N 1 13 SER CA 1 13 SER C -124.00 -64.00 -124.48 -124.28 -124.35 1.32 8 0 "[ . 1 .]"
10 . 1 13 SER N 1 13 SER CA 1 13 SER C 1 14 GLY N 91.00 151.00 102.90 90.78 110.45 0.22 6 0 "[ . 1 .]"
11 . 1 15 THR C 1 16 SER N 1 16 SER CA 1 16 SER C -139.00 -79.00 -117.75 -126.20 -99.33 . . 0 "[ . 1 .]"
12 . 1 16 SER N 1 16 SER CA 1 16 SER C 1 17 VAL N 103.00 163.00 154.02 145.96 158.86 . . 0 "[ . 1 .]"
13 . 1 16 SER C 1 17 VAL N 1 17 VAL CA 1 17 VAL C -159.00 -99.00 -141.38 -139.86 -140.37 . . 0 "[ . 1 .]"
14 . 1 17 VAL N 1 17 VAL CA 1 17 VAL C 1 18 GLU N 105.00 165.00 107.57 104.74 111.39 0.26 10 0 "[ . 1 .]"
15 . 1 17 VAL C 1 18 GLU N 1 18 GLU CA 1 18 GLU C -139.00 -79.00 -105.08 -107.13 -107.57 . . 0 "[ . 1 .]"
16 . 1 18 GLU N 1 18 GLU CA 1 18 GLU C 1 19 LEU N 97.00 157.00 111.31 113.30 112.09 . . 0 "[ . 1 .]"
17 . 1 18 GLU C 1 19 LEU N 1 19 LEU CA 1 19 LEU C -139.00 -79.00 -106.63 -113.73 -99.13 . . 0 "[ . 1 .]"
18 . 1 19 LEU N 1 19 LEU CA 1 19 LEU C 1 20 THR N 106.00 166.00 133.00 146.45 137.04 . . 0 "[ . 1 .]"
19 . 1 19 LEU C 1 20 THR N 1 20 THR CA 1 20 THR C -117.00 -57.00 -92.63 -109.20 -86.77 . . 0 "[ . 1 .]"
20 . 1 20 THR N 1 20 THR CA 1 20 THR C 1 21 CYS N 98.00 158.00 114.12 105.56 117.55 . . 0 "[ . 1 .]"
21 . 1 24 ASP C 1 25 SER N 1 25 SER CA 1 25 SER C -115.00 -55.00 -75.13 -87.05 -62.83 . . 0 "[ . 1 .]"
22 . 1 25 SER N 1 25 SER CA 1 25 SER C 1 26 ASP N 93.00 153.00 132.30 128.34 136.48 . . 0 "[ . 1 .]"
23 . 1 25 SER C 1 26 ASP N 1 26 ASP CA 1 26 ASP C -115.00 -55.00 -115.50 -115.38 -115.50 0.87 5 0 "[ . 1 .]"
24 . 1 26 ASP N 1 26 ASP CA 1 26 ASP C 1 27 GLU N 102.00 162.00 125.70 123.33 128.99 . . 0 "[ . 1 .]"
25 . 1 28 ASN C 1 29 LEU N 1 29 LEU CA 1 29 LEU C -120.00 -60.00 -60.04 -60.72 -59.69 0.31 10 0 "[ . 1 .]"
26 . 1 29 LEU N 1 29 LEU CA 1 29 LEU C 1 30 LYS N 91.00 151.00 114.66 114.21 109.13 . . 0 "[ . 1 .]"
27 . 1 29 LEU C 1 30 LYS N 1 30 LYS CA 1 30 LYS C -150.00 -90.00 -95.40 -124.22 -89.47 0.53 4 0 "[ . 1 .]"
28 . 1 30 LYS N 1 30 LYS CA 1 30 LYS C 1 31 TRP N 118.00 178.00 127.63 117.29 140.57 0.71 2 0 "[ . 1 .]"
29 . 1 30 LYS C 1 31 TRP N 1 31 TRP CA 1 31 TRP C -142.00 -82.00 -100.10 -92.54 -93.07 . . 0 "[ . 1 .]"
30 . 1 31 TRP N 1 31 TRP CA 1 31 TRP C 1 32 GLU N 114.00 174.00 167.63 148.47 174.66 0.66 1 0 "[ . 1 .]"
31 . 1 31 TRP C 1 32 GLU N 1 32 GLU CA 1 32 GLU C -151.00 -91.00 -142.68 -145.57 -147.42 0.30 3 0 "[ . 1 .]"
32 . 1 32 GLU N 1 32 GLU CA 1 32 GLU C 1 33 LYS N 104.00 164.00 142.81 118.70 159.76 . . 0 "[ . 1 .]"
33 . 1 32 GLU C 1 33 LYS N 1 33 LYS CA 1 33 LYS C -137.00 -77.00 -128.13 -132.56 -136.76 0.30 9 0 "[ . 1 .]"
34 . 1 33 LYS N 1 33 LYS CA 1 33 LYS C 1 34 ASN N 93.00 153.00 115.07 103.70 133.57 . . 0 "[ . 1 .]"
35 . 1 33 LYS C 1 34 ASN N 1 34 ASN CA 1 34 ASN C 30.00 90.00 52.89 50.75 55.12 . . 0 "[ . 1 .]"
36 . 1 34 ASN N 1 34 ASN CA 1 34 ASN C 1 35 GLY N 3.00 63.00 31.55 33.21 30.20 0.20 10 0 "[ . 1 .]"
37 . 1 35 GLY C 1 36 GLN N 1 36 GLN CA 1 36 GLN C -142.00 -82.00 -115.74 -87.57 -118.69 0.40 2 0 "[ . 1 .]"
38 . 1 36 GLN N 1 36 GLN CA 1 36 GLN C 1 37 GLU N 101.00 161.00 120.68 103.49 161.22 0.22 10 0 "[ . 1 .]"
39 . 1 36 GLN C 1 37 GLU N 1 37 GLU CA 1 37 GLU C -112.00 -52.00 -68.48 -62.89 -68.16 . . 0 "[ . 1 .]"
40 . 1 37 GLU N 1 37 GLU CA 1 37 GLU C 1 38 LEU N 94.00 154.00 146.44 148.91 146.51 0.14 8 0 "[ . 1 .]"
41 . 1 37 GLU C 1 38 LEU N 1 38 LEU CA 1 38 LEU C -133.00 -73.00 -115.60 -118.57 -125.11 0.07 5 0 "[ . 1 .]"
42 . 1 38 LEU N 1 38 LEU CA 1 38 LEU C 1 39 PRO N 93.00 153.00 100.42 96.71 93.50 0.77 12 0 "[ . 1 .]"
43 . 1 42 HIS C 1 43 ASP N 1 43 ASP CA 1 43 ASP C -140.00 -80.00 -94.39 -110.26 -85.95 . . 0 "[ . 1 .]"
44 . 1 43 ASP N 1 43 ASP CA 1 43 ASP C 1 44 LYS N 100.00 160.00 156.97 155.34 154.06 0.74 11 0 "[ . 1 .]"
45 . 1 44 LYS C 1 45 HIS N 1 45 HIS CA 1 45 HIS C -140.00 -80.00 -103.69 -94.03 -100.48 . . 0 "[ . 1 .]"
46 . 1 45 HIS N 1 45 HIS CA 1 45 HIS C 1 46 LEU N 100.00 160.00 137.26 113.39 160.45 0.45 8 0 "[ . 1 .]"
47 . 1 45 HIS C 1 46 LEU N 1 46 LEU CA 1 46 LEU C -131.00 -71.00 -107.84 -96.74 -100.56 . . 0 "[ . 1 .]"
48 . 1 46 LEU N 1 46 LEU CA 1 46 LEU C 1 47 VAL N 91.00 151.00 92.74 90.93 90.83 0.17 1 0 "[ . 1 .]"
49 . 1 46 LEU C 1 47 VAL N 1 47 VAL CA 1 47 VAL C -130.00 -70.00 -84.63 -86.92 -82.41 . . 0 "[ . 1 .]"
50 . 1 47 VAL N 1 47 VAL CA 1 47 VAL C 1 48 LEU N 92.00 152.00 129.68 131.36 131.11 . . 0 "[ . 1 .]"
51 . 1 47 VAL C 1 48 LEU N 1 48 LEU CA 1 48 LEU C -121.00 -61.00 -115.27 -116.83 -117.01 . . 0 "[ . 1 .]"
52 . 1 48 LEU N 1 48 LEU CA 1 48 LEU C 1 49 GLN N 103.00 163.00 102.87 102.23 104.34 0.77 9 0 "[ . 1 .]"
53 . 1 48 LEU C 1 49 GLN N 1 49 GLN CA 1 49 GLN C -134.00 -74.00 -74.35 -73.73 -73.90 0.48 10 0 "[ . 1 .]"
54 . 1 49 GLN N 1 49 GLN CA 1 49 GLN C 1 50 ASP N 106.00 166.00 144.19 143.99 143.38 . . 0 "[ . 1 .]"
55 . 1 50 ASP C 1 51 PHE N 1 51 PHE CA 1 51 PHE C -113.00 -53.00 -72.12 -86.60 -61.35 . . 0 "[ . 1 .]"
56 . 1 51 PHE N 1 51 PHE CA 1 51 PHE C 1 52 SER N 97.00 157.00 111.69 95.85 154.24 1.15 10 0 "[ . 1 .]"
57 . 1 51 PHE C 1 52 SER N 1 52 SER CA 1 52 SER C -136.00 -76.00 -92.12 -136.83 -75.10 0.90 4 0 "[ . 1 .]"
58 . 1 52 SER N 1 52 SER CA 1 52 SER C 1 53 GLU N 95.00 155.00 127.38 111.62 109.11 . . 0 "[ . 1 .]"
59 . 1 52 SER C 1 53 GLU N 1 53 GLU CA 1 53 GLU C -97.00 -37.00 -64.83 -81.91 -49.08 . . 0 "[ . 1 .]"
60 . 1 53 GLU N 1 53 GLU CA 1 53 GLU C 1 54 VAL N -53.00 7.00 -14.43 -22.90 -28.08 0.21 4 0 "[ . 1 .]"
61 . 1 53 GLU C 1 54 VAL N 1 54 VAL CA 1 54 VAL C -97.00 -37.00 -79.11 -97.48 -52.44 0.48 15 0 "[ . 1 .]"
62 . 1 54 VAL N 1 54 VAL CA 1 54 VAL C 1 55 GLU N -65.00 -5.00 -55.22 -65.46 -65.49 0.93 7 0 "[ . 1 .]"
63 . 1 54 VAL C 1 55 GLU N 1 55 GLU CA 1 55 GLU C -105.00 -45.00 -103.87 -106.21 -79.98 1.21 7 0 "[ . 1 .]"
64 . 1 55 GLU N 1 55 GLU CA 1 55 GLU C 1 56 ASP N -65.00 -5.00 -22.10 -28.78 -4.70 0.30 15 0 "[ . 1 .]"
65 . 1 55 GLU C 1 56 ASP N 1 56 ASP CA 1 56 ASP C -132.00 -72.00 -84.99 -72.75 -76.13 0.48 5 0 "[ . 1 .]"
66 . 1 56 ASP N 1 56 ASP CA 1 56 ASP C 1 57 SER N -36.00 24.00 -15.40 -36.29 21.45 0.29 15 0 "[ . 1 .]"
67 . 1 58 GLY C 1 59 TYR N 1 59 TYR CA 1 59 TYR C -135.00 -75.00 -94.34 -108.47 -84.90 . . 0 "[ . 1 .]"
68 . 1 59 TYR N 1 59 TYR CA 1 59 TYR C 1 60 TYR N 95.00 155.00 153.26 140.22 155.57 0.57 6 0 "[ . 1 .]"
69 . 1 59 TYR C 1 60 TYR N 1 60 TYR CA 1 60 TYR C -156.00 -96.00 -144.45 -145.73 -147.76 0.14 12 0 "[ . 1 .]"
70 . 1 60 TYR N 1 60 TYR CA 1 60 TYR C 1 61 VAL N 117.00 177.00 135.98 125.29 143.66 . . 0 "[ . 1 .]"
71 . 1 60 TYR C 1 61 VAL N 1 61 VAL CA 1 61 VAL C -156.00 -96.00 -155.41 -154.65 -155.99 1.20 7 0 "[ . 1 .]"
72 . 1 61 VAL N 1 61 VAL CA 1 61 VAL C 1 62 CYS N 116.00 176.00 154.89 143.16 167.07 . . 0 "[ . 1 .]"
73 . 1 61 VAL C 1 62 CYS N 1 62 CYS CA 1 62 CYS C -142.00 -82.00 -138.36 -132.79 -137.55 0.35 12 0 "[ . 1 .]"
74 . 1 62 CYS N 1 62 CYS CA 1 62 CYS C 1 63 TYR N 121.00 -179.00 156.31 141.91 168.79 . . 0 "[ . 1 .]"
75 . 1 62 CYS C 1 63 TYR N 1 63 TYR CA 1 63 TYR C -156.00 -96.00 -156.10 -150.16 -153.17 2.21 7 0 "[ . 1 .]"
76 . 1 63 TYR N 1 63 TYR CA 1 63 TYR C 1 64 THR N 124.00 -176.00 164.77 150.56 179.26 . . 0 "[ . 1 .]"
77 . 1 63 TYR C 1 64 THR N 1 64 THR CA 1 64 THR C -139.00 -79.00 -129.93 -140.64 -122.41 1.64 2 0 "[ . 1 .]"
78 . 1 64 THR N 1 64 THR CA 1 64 THR C 1 65 PRO N 111.00 171.00 169.58 164.03 171.63 0.63 9 0 "[ . 1 .]"
79 . 1 65 PRO N 1 65 PRO CA 1 65 PRO C 1 66 ALA N -49.00 11.00 -13.08 -25.32 -8.58 . . 0 "[ . 1 .]"
80 . 1 65 PRO C 1 66 ALA N 1 66 ALA CA 1 66 ALA C -129.00 -69.00 -114.22 -121.65 -126.87 0.13 1 0 "[ . 1 .]"
81 . 1 66 ALA N 1 66 ALA CA 1 66 ALA C 1 67 SER N -26.00 34.00 -22.52 -2.33 -12.44 0.78 8 0 "[ . 1 .]"
82 . 1 66 ALA C 1 67 SER N 1 67 SER CA 1 67 SER C -119.00 -59.00 -116.80 -115.09 -117.09 0.63 10 0 "[ . 1 .]"
83 . 1 67 SER N 1 67 SER CA 1 67 SER C 1 68 ASN N 103.00 163.00 105.44 119.61 108.38 1.14 11 0 "[ . 1 .]"
84 . 1 67 SER C 1 68 ASN N 1 68 ASN CA 1 68 ASN C -111.00 -51.00 -104.12 -50.36 -106.08 1.30 9 0 "[ . 1 .]"
85 . 1 68 ASN N 1 68 ASN CA 1 68 ASN C 1 69 LYS N 111.00 171.00 115.77 173.37 108.97 4.45 2 0 "[ . 1 .]"
86 . 1 68 ASN C 1 69 LYS N 1 69 LYS CA 1 69 LYS C -124.00 -64.00 -118.95 -61.03 -125.77 3.91 2 0 "[ . 1 .]"
87 . 1 69 LYS N 1 69 LYS CA 1 69 LYS C 1 70 ASN N 97.00 157.00 116.47 103.84 157.94 0.94 13 0 "[ . 1 .]"
88 . 1 69 LYS C 1 70 ASN N 1 70 ASN CA 1 70 ASN C -125.00 -65.00 -71.58 -64.75 -64.84 0.60 12 0 "[ . 1 .]"
89 . 1 70 ASN N 1 70 ASN CA 1 70 ASN C 1 71 THR N 101.00 161.00 105.32 163.13 99.12 5.05 13 1 "[ . 1 + .]"
90 . 1 70 ASN C 1 71 THR N 1 71 THR CA 1 71 THR C -137.00 -77.00 -132.43 -75.52 -138.68 4.49 15 0 "[ . 1 .]"
91 . 1 71 THR N 1 71 THR CA 1 71 THR C 1 72 TYR N 99.00 159.00 120.79 159.16 134.91 1.31 2 0 "[ . 1 .]"
92 . 1 71 THR C 1 72 TYR N 1 72 TYR CA 1 72 TYR C -153.00 -93.00 -104.76 -95.31 -98.95 1.09 12 0 "[ . 1 .]"
93 . 1 72 TYR N 1 72 TYR CA 1 72 TYR C 1 73 LEU N 109.00 169.00 145.68 153.15 151.61 . . 0 "[ . 1 .]"
94 . 1 72 TYR C 1 73 LEU N 1 73 LEU CA 1 73 LEU C -143.00 -83.00 -129.11 -129.69 -130.92 . . 0 "[ . 1 .]"
95 . 1 73 LEU N 1 73 LEU CA 1 73 LEU C 1 74 TYR N 97.00 157.00 127.99 126.32 124.93 . . 0 "[ . 1 .]"
96 . 1 73 LEU C 1 74 TYR N 1 74 TYR CA 1 74 TYR C -146.00 -86.00 -91.50 -85.49 -85.53 0.51 2 0 "[ . 1 .]"
97 . 1 74 TYR N 1 74 TYR CA 1 74 TYR C 1 75 LEU N 96.00 156.00 104.45 95.53 95.40 0.60 1 0 "[ . 1 .]"
98 . 1 74 TYR C 1 75 LEU N 1 75 LEU CA 1 75 LEU C -138.00 -78.00 -98.89 -89.17 -90.11 . . 0 "[ . 1 .]"
99 . 1 75 LEU N 1 75 LEU CA 1 75 LEU C 1 76 LYS N 99.00 159.00 118.19 103.34 138.30 . . 0 "[ . 1 .]"
100 . 1 75 LEU C 1 76 LYS N 1 76 LYS CA 1 76 LYS C -136.00 -76.00 -127.26 -118.30 -123.55 . . 0 "[ . 1 .]"
101 . 1 76 LYS N 1 76 LYS CA 1 76 LYS C 1 77 ALA N 100.00 160.00 99.33 98.46 99.87 1.54 4 0 "[ . 1 .]"
102 . 1 76 LYS C 1 77 ALA N 1 77 ALA CA 1 77 ALA C -144.00 -84.00 -126.09 -137.12 -114.20 . . 0 "[ . 1 .]"
103 . 1 77 ALA N 1 77 ALA CA 1 77 ALA C 1 78 ARG N 114.00 174.00 161.12 139.13 171.20 . . 0 "[ . 1 .]"
104 . 1 77 ALA C 1 78 ARG N 1 78 ARG CA 1 78 ARG C -132.00 -72.00 -127.35 -132.49 -107.72 0.49 4 0 "[ . 1 .]"
105 . 1 78 ARG N 1 78 ARG CA 1 78 ARG C 1 79 VAL N 101.00 161.00 122.16 123.75 119.85 . . 0 "[ . 1 .]"
106 . 1 78 ARG C 1 79 VAL N 1 79 VAL CA 1 79 VAL C -144.00 -84.00 -145.70 -146.14 -145.00 2.14 10 0 "[ . 1 .]"
107 . 1 79 VAL N 1 79 VAL CA 1 79 VAL C 1 80 GLY N 120.00 180.00 116.29 116.40 116.38 4.05 5 0 "[ . 1 .]"
108 . 1 113 ALA C 1 114 LEU N 1 114 LEU CA 1 114 LEU C -155.00 -95.00 -99.96 -95.83 -100.50 0.65 12 0 "[ . 1 .]"
109 . 1 114 LEU N 1 114 LEU CA 1 114 LEU C 1 115 GLU N 108.00 168.00 154.67 155.57 154.57 . . 0 "[ . 1 .]"
110 . 1 114 LEU C 1 115 GLU N 1 115 GLU CA 1 115 GLU C -157.00 -97.00 -158.16 -158.19 -158.34 1.96 13 0 "[ . 1 .]"
111 . 1 115 GLU N 1 115 GLU CA 1 115 GLU C 1 116 VAL N 114.00 174.00 162.09 158.05 146.85 . . 0 "[ . 1 .]"
112 . 1 115 GLU C 1 116 VAL N 1 116 VAL CA 1 116 VAL C -137.00 -77.00 -131.16 -137.25 -106.41 0.25 8 0 "[ . 1 .]"
113 . 1 116 VAL N 1 116 VAL CA 1 116 VAL C 1 117 LEU N 90.00 150.00 139.83 141.13 140.43 . . 0 "[ . 1 .]"
114 . 1 116 VAL C 1 117 LEU N 1 117 LEU CA 1 117 LEU C -143.00 -83.00 -132.74 -138.02 -127.39 . . 0 "[ . 1 .]"
115 . 1 117 LEU N 1 117 LEU CA 1 117 LEU C 1 118 GLU N 106.00 166.00 152.74 140.36 164.69 . . 0 "[ . 1 .]"
116 . 1 117 LEU C 1 118 GLU N 1 118 GLU CA 1 118 GLU C -127.00 -67.00 -112.77 -109.70 -111.64 . . 0 "[ . 1 .]"
117 . 1 118 GLU N 1 118 GLU CA 1 118 GLU C 1 119 ALA N 101.00 161.00 105.49 104.77 103.82 0.07 1 0 "[ . 1 .]"
118 . 1 118 GLU C 1 119 ALA N 1 119 ALA CA 1 119 ALA C -131.00 -71.00 -127.40 -130.89 -124.33 . . 0 "[ . 1 .]"
119 . 1 119 ALA N 1 119 ALA CA 1 119 ALA C 1 120 GLU N 98.00 158.00 146.15 149.38 148.41 . . 0 "[ . 1 .]"
120 . 1 119 ALA C 1 120 GLU N 1 120 GLU CA 1 120 GLU C 27.00 87.00 51.23 51.77 51.62 . . 0 "[ . 1 .]"
121 . 1 120 GLU N 1 120 GLU CA 1 120 GLU C 1 121 ASP N 9.00 69.00 50.57 44.59 68.02 . . 0 "[ . 1 .]"
122 . 1 121 ASP C 1 122 LYS N 1 122 LYS CA 1 122 LYS C -143.00 -83.00 -131.24 -139.50 -126.99 . . 0 "[ . 1 .]"
123 . 1 122 LYS N 1 122 LYS CA 1 122 LYS C 1 123 VAL N 120.00 180.00 155.89 159.10 154.76 . . 0 "[ . 1 .]"
124 . 1 122 LYS C 1 123 VAL N 1 123 VAL CA 1 123 VAL C -136.00 -76.00 -128.64 -136.27 -122.27 0.27 12 0 "[ . 1 .]"
125 . 1 123 VAL N 1 123 VAL CA 1 123 VAL C 1 124 ILE N 81.00 141.00 137.80 128.79 141.35 0.35 4 0 "[ . 1 .]"
126 . 1 123 VAL C 1 124 ILE N 1 124 ILE CA 1 124 ILE C -144.00 -84.00 -139.51 -131.88 -136.20 0.14 12 0 "[ . 1 .]"
127 . 1 124 ILE N 1 124 ILE CA 1 124 ILE C 1 125 LEU N 101.00 161.00 151.73 149.59 154.24 . . 0 "[ . 1 .]"
128 . 1 124 ILE C 1 125 LEU N 1 125 LEU CA 1 125 LEU C -147.00 -87.00 -100.59 -102.07 -104.73 . . 0 "[ . 1 .]"
129 . 1 125 LEU N 1 125 LEU CA 1 125 LEU C 1 126 LYS N 114.00 174.00 133.67 141.58 131.77 . . 0 "[ . 1 .]"
130 . 1 125 LEU C 1 126 LYS N 1 126 LYS CA 1 126 LYS C -152.00 -92.00 -120.15 -131.63 -103.29 . . 0 "[ . 1 .]"
131 . 1 126 LYS N 1 126 LYS CA 1 126 LYS C 1 127 CYS N 116.00 176.00 132.87 126.42 152.35 . . 0 "[ . 1 .]"
132 . 1 126 LYS C 1 127 CYS N 1 127 CYS CA 1 127 CYS C -140.00 -80.00 -134.32 -142.43 -122.86 2.43 5 0 "[ . 1 .]"
133 . 1 127 CYS N 1 127 CYS CA 1 127 CYS C 1 128 ASN N 121.00 -179.00 163.49 158.07 -179.58 . . 0 "[ . 1 .]"
134 . 1 130 SER C 1 131 ILE N 1 131 ILE CA 1 131 ILE C -135.00 -75.00 -94.96 -93.89 -95.37 . . 0 "[ . 1 .]"
135 . 1 131 ILE N 1 131 ILE CA 1 131 ILE C 1 132 THR N 98.00 158.00 136.27 132.68 128.77 . . 0 "[ . 1 .]"
136 . 1 131 ILE C 1 132 THR N 1 132 THR CA 1 132 THR C -139.00 -79.00 -88.43 -110.45 -78.56 0.44 14 0 "[ . 1 .]"
137 . 1 132 THR N 1 132 THR CA 1 132 THR C 1 133 LEU N 101.00 161.00 119.18 105.33 132.31 . . 0 "[ . 1 .]"
138 . 1 132 THR C 1 133 LEU N 1 133 LEU CA 1 133 LEU C -116.00 -56.00 -81.98 -82.20 -85.30 . . 0 "[ . 1 .]"
139 . 1 133 LEU N 1 133 LEU CA 1 133 LEU C 1 134 LEU N 101.00 161.00 105.01 105.24 105.15 0.68 4 0 "[ . 1 .]"
140 . 1 133 LEU C 1 134 LEU N 1 134 LEU CA 1 134 LEU C -120.00 -60.00 -75.04 -91.83 -69.43 . . 0 "[ . 1 .]"
141 . 1 134 LEU N 1 134 LEU CA 1 134 LEU C 1 135 GLN N -68.00 -8.00 -60.63 -61.18 -62.31 . . 0 "[ . 1 .]"
142 . 1 136 GLY C 1 137 THR N 1 137 THR CA 1 137 THR C -112.00 -52.00 -58.63 -76.43 -50.65 1.35 10 0 "[ . 1 .]"
143 . 1 137 THR N 1 137 THR CA 1 137 THR C 1 138 ALA N 96.00 156.00 96.11 95.53 95.32 1.07 9 0 "[ . 1 .]"
144 . 1 139 GLY C 1 140 GLN N 1 140 GLN CA 1 140 GLN C -148.00 -88.00 -146.32 -149.12 -149.29 1.32 1 0 "[ . 1 .]"
145 . 1 140 GLN N 1 140 GLN CA 1 140 GLN C 1 141 GLU N 104.00 164.00 144.16 131.82 155.09 . . 0 "[ . 1 .]"
146 . 1 140 GLN C 1 141 GLU N 1 141 GLU CA 1 141 GLU C -111.00 -51.00 -68.09 -60.09 -61.80 . . 0 "[ . 1 .]"
147 . 1 141 GLU N 1 141 GLU CA 1 141 GLU C 1 142 VAL N 97.00 157.00 123.57 94.51 157.43 2.49 7 0 "[ . 1 .]"
148 . 1 142 VAL C 1 143 SER N 1 143 SER CA 1 143 SER C -112.00 -52.00 -76.63 -101.57 -106.72 0.27 13 0 "[ . 1 .]"
149 . 1 143 SER N 1 143 SER CA 1 143 SER C 1 144 ASP N -58.00 2.00 -40.03 4.00 -30.57 2.29 2 0 "[ . 1 .]"
150 . 1 146 LYS C 1 147 THR N 1 147 THR CA 1 147 THR C -144.00 -84.00 -136.70 -126.27 -128.91 1.39 4 0 "[ . 1 .]"
151 . 1 147 THR N 1 147 THR CA 1 147 THR C 1 148 LEU N 118.00 178.00 147.65 156.49 150.86 0.50 4 0 "[ . 1 .]"
152 . 1 147 THR C 1 148 LEU N 1 148 LEU CA 1 148 LEU C -154.00 -94.00 -111.01 -143.87 -93.11 0.89 12 0 "[ . 1 .]"
153 . 1 148 LEU N 1 148 LEU CA 1 148 LEU C 1 149 ASN N 109.00 169.00 146.76 148.69 148.22 . . 0 "[ . 1 .]"
154 . 1 148 LEU C 1 149 ASN N 1 149 ASN CA 1 149 ASN C -123.00 -63.00 -120.04 -118.15 -119.58 1.16 12 0 "[ . 1 .]"
155 . 1 149 ASN N 1 149 ASN CA 1 149 ASN C 1 150 LEU N 94.00 154.00 98.11 93.87 110.32 0.13 6 0 "[ . 1 .]"
156 . 1 151 GLY C 1 152 LYS N 1 152 LYS CA 1 152 LYS C -110.00 -50.00 -83.86 -90.69 -95.71 . . 0 "[ . 1 .]"
157 . 1 152 LYS N 1 152 LYS CA 1 152 LYS C 1 153 ARG N 117.00 177.00 170.34 176.26 172.94 0.42 9 0 "[ . 1 .]"
158 . 1 152 LYS C 1 153 ARG N 1 153 ARG CA 1 153 ARG C -92.00 -32.00 -92.61 -92.61 -92.67 0.90 8 0 "[ . 1 .]"
159 . 1 153 ARG N 1 153 ARG CA 1 153 ARG C 1 154 ILE N -58.00 2.00 -18.08 -18.28 -19.28 . . 0 "[ . 1 .]"
160 . 1 153 ARG C 1 154 ILE N 1 154 ILE CA 1 154 ILE C -131.00 -71.00 -74.48 -82.91 -70.70 0.30 10 0 "[ . 1 .]"
161 . 1 154 ILE N 1 154 ILE CA 1 154 ILE C 1 155 GLU N -27.00 33.00 -6.56 -7.38 -7.71 . . 0 "[ . 1 .]"
162 . 1 157 PRO C 1 158 ARG N 1 158 ARG CA 1 158 ARG C -152.00 -92.00 -148.74 -146.35 -149.42 0.75 13 0 "[ . 1 .]"
163 . 1 158 ARG N 1 158 ARG CA 1 158 ARG C 1 159 GLY N 108.00 168.00 120.81 107.90 135.33 0.10 10 0 "[ . 1 .]"
164 . 1 159 GLY C 1 160 MET N 1 160 MET CA 1 160 MET C -150.00 -90.00 -131.77 -128.10 -140.70 0.33 7 0 "[ . 1 .]"
165 . 1 160 MET N 1 160 MET CA 1 160 MET C 1 161 TYR N 103.00 163.00 150.58 140.41 156.71 . . 0 "[ . 1 .]"
166 . 1 160 MET C 1 161 TYR N 1 161 TYR CA 1 161 TYR C -157.00 -97.00 -144.16 -143.68 -144.17 . . 0 "[ . 1 .]"
167 . 1 161 TYR N 1 161 TYR CA 1 161 TYR C 1 162 GLN N 105.00 165.00 124.39 116.03 137.57 . . 0 "[ . 1 .]"
168 . 1 161 TYR C 1 162 GLN N 1 162 GLN CA 1 162 GLN C -150.00 -90.00 -99.64 -98.08 -99.07 . . 0 "[ . 1 .]"
169 . 1 162 GLN N 1 162 GLN CA 1 162 GLN C 1 163 CYS N 109.00 169.00 158.11 141.20 169.95 0.95 15 0 "[ . 1 .]"
170 . 1 162 GLN C 1 163 CYS N 1 163 CYS CA 1 163 CYS C -143.00 -83.00 -108.05 -143.80 -82.54 0.80 4 0 "[ . 1 .]"
171 . 1 163 CYS N 1 163 CYS CA 1 163 CYS C 1 164 GLY N 120.00 180.00 170.88 161.79 -179.66 0.34 12 0 "[ . 1 .]"
172 . 1 163 CYS C 1 164 GLY N 1 164 GLY CA 1 164 GLY C -142.00 -82.00 -90.10 -98.62 -82.50 . . 0 "[ . 1 .]"
173 . 1 164 GLY N 1 164 GLY CA 1 164 GLY C 1 165 GLU N 109.00 169.00 140.99 124.64 169.12 0.12 10 0 "[ . 1 .]"
174 . 1 164 GLY C 1 165 GLU N 1 165 GLU CA 1 165 GLU C -127.00 -67.00 -100.80 -127.79 -66.85 0.79 7 0 "[ . 1 .]"
175 . 1 165 GLU N 1 165 GLU CA 1 165 GLU C 1 166 ASN N 124.00 -176.00 155.26 163.19 129.06 0.48 12 0 "[ . 1 .]"
176 . 1 166 ASN C 1 167 ALA N 1 167 ALA CA 1 167 ALA C -108.00 -48.00 -104.03 -108.91 -57.18 0.91 6 0 "[ . 1 .]"
177 . 1 167 ALA N 1 167 ALA CA 1 167 ALA C 1 168 LYS N -49.00 11.00 -20.42 -17.81 -21.80 0.31 4 0 "[ . 1 .]"
178 . 1 168 LYS C 1 169 SER N 1 169 SER CA 1 169 SER C -132.00 -72.00 -80.70 -132.37 -71.05 0.95 13 0 "[ . 1 .]"
179 . 1 169 SER N 1 169 SER CA 1 169 SER C 1 170 PHE N 84.00 144.00 136.04 144.24 138.39 0.51 6 0 "[ . 1 .]"
180 . 1 169 SER C 1 170 PHE N 1 170 PHE CA 1 170 PHE C -138.00 -78.00 -121.44 -138.76 -98.98 0.76 14 0 "[ . 1 .]"
181 . 1 170 PHE N 1 170 PHE CA 1 170 PHE C 1 171 THR N 104.00 164.00 149.42 140.46 161.67 . . 0 "[ . 1 .]"
182 . 1 170 PHE C 1 171 THR N 1 171 THR CA 1 171 THR C -141.00 -81.00 -139.16 -133.26 -136.84 0.38 6 0 "[ . 1 .]"
183 . 1 171 THR N 1 171 THR CA 1 171 THR C 1 172 LEU N 97.00 157.00 138.88 97.80 152.62 . . 0 "[ . 1 .]"
184 . 1 171 THR C 1 172 LEU N 1 172 LEU CA 1 172 LEU C -157.00 -97.00 -135.36 -133.56 -135.15 . . 0 "[ . 1 .]"
185 . 1 172 LEU N 1 172 LEU CA 1 172 LEU C 1 173 GLN N 106.00 166.00 140.05 137.09 135.50 . . 0 "[ . 1 .]"
186 . 1 172 LEU C 1 173 GLN N 1 173 GLN CA 1 173 GLN C -141.00 -81.00 -119.94 -115.21 -116.11 . . 0 "[ . 1 .]"
187 . 1 173 GLN N 1 173 GLN CA 1 173 GLN C 1 174 VAL N 95.00 155.00 129.29 101.69 152.09 . . 0 "[ . 1 .]"
188 . 1 173 GLN C 1 174 VAL N 1 174 VAL CA 1 174 VAL C -137.00 -77.00 -103.44 -120.07 -120.27 0.27 15 0 "[ . 1 .]"
189 . 1 174 VAL N 1 174 VAL CA 1 174 VAL C 1 175 TYR N 102.00 162.00 144.26 137.55 149.59 . . 0 "[ . 1 .]"
190 . 1 174 VAL C 1 175 TYR N 1 175 TYR CA 1 175 TYR C -153.00 -93.00 -146.61 -141.96 -142.32 2.27 4 0 "[ . 1 .]"
191 . 1 175 TYR N 1 175 TYR CA 1 175 TYR C 1 176 TYR N 95.00 155.00 96.87 94.28 109.12 0.72 6 0 "[ . 1 .]"
192 . 1 175 TYR C 1 176 TYR N 1 176 TYR CA 1 176 TYR C -133.00 -73.00 -92.08 -88.46 -90.03 . . 0 "[ . 1 .]"
193 . 1 176 TYR N 1 176 TYR CA 1 176 TYR C 1 177 ARG N 103.00 163.00 118.33 125.62 117.77 0.64 15 0 "[ . 1 .]"
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