NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
454384 |
2yud   |
cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2yud
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 178
_TA_constraint_stats_list.Viol_count 342
_TA_constraint_stats_list.Viol_total 2031.49
_TA_constraint_stats_list.Viol_max 2.42
_TA_constraint_stats_list.Viol_rms 0.16
_TA_constraint_stats_list.Viol_average_all_restraints 0.03
_TA_constraint_stats_list.Viol_average_violations_only 0.30
_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 PHI 1 17 SER C 1 18 LYS N 1 18 LYS CA 1 18 LYS C -95.30 -35.30 -50.68 -50.84 -50.36 . . 0 "[ . 1 . 2]"
2 PSI 1 18 LYS N 1 18 LYS CA 1 18 LYS C 1 19 LEU N -67.60 -7.60 -43.10 -42.71 -42.99 . . 0 "[ . 1 . 2]"
3 PHI 1 18 LYS C 1 19 LEU N 1 19 LEU CA 1 19 LEU C -92.20 -32.20 -62.99 -63.66 -58.91 . . 0 "[ . 1 . 2]"
4 PSI 1 19 LEU N 1 19 LEU CA 1 19 LEU C 1 20 LYS N -72.10 -12.10 -46.22 -47.27 -44.89 . . 0 "[ . 1 . 2]"
5 PHI 1 19 LEU C 1 20 LYS N 1 20 LYS CA 1 20 LYS C -93.90 -33.90 -72.98 -72.45 -72.61 . . 0 "[ . 1 . 2]"
6 PSI 1 20 LYS N 1 20 LYS CA 1 20 LYS C 1 21 TYR N -67.30 -7.30 -13.00 -12.95 -13.11 . . 0 "[ . 1 . 2]"
7 PHI 1 20 LYS C 1 21 TYR N 1 21 TYR CA 1 21 TYR C -96.50 -36.50 -86.02 -86.54 -85.00 . . 0 "[ . 1 . 2]"
8 PSI 1 21 TYR N 1 21 TYR CA 1 21 TYR C 1 22 VAL N -71.70 -11.60 -41.35 -41.38 -41.41 . . 0 "[ . 1 . 2]"
9 PHI 1 21 TYR C 1 22 VAL N 1 22 VAL CA 1 22 VAL C -102.00 -42.00 -58.70 -59.00 -58.12 . . 0 "[ . 1 . 2]"
10 PSI 1 22 VAL N 1 22 VAL CA 1 22 VAL C 1 23 LEU N -70.00 -10.00 -20.30 -20.25 -20.29 . . 0 "[ . 1 . 2]"
11 PHI 1 22 VAL C 1 23 LEU N 1 23 LEU CA 1 23 LEU C -116.50 -56.50 -117.26 -117.44 -116.96 0.94 2 0 "[ . 1 . 2]"
12 PSI 1 23 LEU N 1 23 LEU CA 1 23 LEU C 1 24 GLN N -38.20 21.80 7.31 7.20 7.13 . . 0 "[ . 1 . 2]"
13 PHI 1 26 ALA C 1 27 ARG N 1 27 ARG CA 1 27 ARG C -151.90 -91.90 -101.03 -98.02 -99.77 0.06 15 0 "[ . 1 . 2]"
14 PSI 1 27 ARG N 1 27 ARG CA 1 27 ARG C 1 28 PHE N 124.90 -175.10 137.40 156.45 135.70 0.13 12 0 "[ . 1 . 2]"
15 PHI 1 27 ARG C 1 28 PHE N 1 28 PHE CA 1 28 PHE C -149.90 -90.00 -106.24 -138.82 -90.14 . . 0 "[ . 1 . 2]"
16 PSI 1 28 PHE N 1 28 PHE CA 1 28 PHE C 1 29 PHE N 118.20 178.20 133.75 123.82 144.47 . . 0 "[ . 1 . 2]"
17 PHI 1 28 PHE C 1 29 PHE N 1 29 PHE CA 1 29 PHE C -166.80 -106.80 -124.97 -124.45 -126.00 . . 0 "[ . 1 . 2]"
18 PSI 1 29 PHE N 1 29 PHE CA 1 29 PHE C 1 30 LEU N 114.90 174.90 115.72 117.44 115.23 0.10 13 0 "[ . 1 . 2]"
19 PHI 1 29 PHE C 1 30 LEU N 1 30 LEU CA 1 30 LEU C -141.10 -81.10 -84.25 -89.45 -80.99 0.11 1 0 "[ . 1 . 2]"
20 PSI 1 30 LEU N 1 30 LEU CA 1 30 LEU C 1 31 ILE N 92.60 152.60 119.94 112.24 130.75 . . 0 "[ . 1 . 2]"
21 PHI 1 30 LEU C 1 31 ILE N 1 31 ILE CA 1 31 ILE C -140.20 -80.20 -114.70 -109.82 -111.98 . . 0 "[ . 1 . 2]"
22 PSI 1 31 ILE N 1 31 ILE CA 1 31 ILE C 1 32 LYS N 84.20 144.20 122.23 122.58 122.20 . . 0 "[ . 1 . 2]"
23 PHI 1 31 ILE C 1 32 LYS N 1 32 LYS CA 1 32 LYS C -141.30 -81.30 -99.51 -102.89 -105.52 . . 0 "[ . 1 . 2]"
24 PSI 1 32 LYS N 1 32 LYS CA 1 32 LYS C 1 33 SER N 122.40 -177.60 136.36 122.38 149.93 0.02 19 0 "[ . 1 . 2]"
25 PHI 1 32 LYS C 1 33 SER N 1 33 SER CA 1 33 SER C -143.30 -83.30 -113.19 -138.21 -83.39 . . 0 "[ . 1 . 2]"
26 PSI 1 33 SER N 1 33 SER CA 1 33 SER C 1 34 ASN N 125.20 -174.80 170.89 125.19 -174.75 0.05 16 0 "[ . 1 . 2]"
27 PHI 1 35 ASN C 1 36 HIS N 1 36 HIS CA 1 36 HIS C -90.60 -30.60 -77.50 -71.94 -78.74 0.04 17 0 "[ . 1 . 2]"
28 PSI 1 36 HIS N 1 36 HIS CA 1 36 HIS C 1 37 GLU N -71.80 -11.80 -28.03 -32.65 -24.42 . . 0 "[ . 1 . 2]"
29 PHI 1 36 HIS C 1 37 GLU N 1 37 GLU CA 1 37 GLU C -96.40 -36.40 -52.11 -53.85 -51.88 . . 0 "[ . 1 . 2]"
30 PSI 1 37 GLU N 1 37 GLU CA 1 37 GLU C 1 38 ASN N -70.80 -10.80 -44.96 -54.26 -40.41 . . 0 "[ . 1 . 2]"
31 PHI 1 37 GLU C 1 38 ASN N 1 38 ASN CA 1 38 ASN C -95.70 -35.70 -58.15 -58.33 -58.57 . . 0 "[ . 1 . 2]"
32 PSI 1 38 ASN N 1 38 ASN CA 1 38 ASN C 1 39 VAL N -72.80 -12.80 -50.39 -49.48 -50.65 . . 0 "[ . 1 . 2]"
33 PHI 1 38 ASN C 1 39 VAL N 1 39 VAL CA 1 39 VAL C -96.70 -36.70 -56.81 -63.69 -51.71 . . 0 "[ . 1 . 2]"
34 PSI 1 39 VAL N 1 39 VAL CA 1 39 VAL C 1 40 SER N -72.90 -12.90 -57.71 -62.50 -50.61 . . 0 "[ . 1 . 2]"
35 PHI 1 39 VAL C 1 40 SER N 1 40 SER CA 1 40 SER C -93.30 -33.30 -53.71 -54.38 -54.60 . . 0 "[ . 1 . 2]"
36 PSI 1 40 SER N 1 40 SER CA 1 40 SER C 1 41 LEU N -70.10 -10.10 -50.10 -49.35 -49.94 . . 0 "[ . 1 . 2]"
37 PHI 1 40 SER C 1 41 LEU N 1 41 LEU CA 1 41 LEU C -94.60 -34.60 -56.91 -56.90 -57.55 . . 0 "[ . 1 . 2]"
38 PSI 1 41 LEU N 1 41 LEU CA 1 41 LEU C 1 42 ALA N -69.40 -9.40 -42.87 -41.68 -42.26 . . 0 "[ . 1 . 2]"
39 PHI 1 41 LEU C 1 42 ALA N 1 42 ALA CA 1 42 ALA C -105.00 -45.00 -65.21 -72.38 -59.39 . . 0 "[ . 1 . 2]"
40 PSI 1 42 ALA N 1 42 ALA CA 1 42 ALA C 1 43 LYS N -56.00 4.00 -34.15 -34.64 -34.87 . . 0 "[ . 1 . 2]"
41 PHI 1 42 ALA C 1 43 LYS N 1 43 LYS CA 1 43 LYS C -92.40 -32.40 -79.46 -78.53 -79.39 . . 0 "[ . 1 . 2]"
42 PSI 1 43 LYS N 1 43 LYS CA 1 43 LYS C 1 44 ALA N -69.60 -9.60 -23.61 -25.58 -21.98 . . 0 "[ . 1 . 2]"
43 PHI 1 43 LYS C 1 44 ALA N 1 44 ALA CA 1 44 ALA C -99.60 -39.60 -78.23 -86.13 -73.09 . . 0 "[ . 1 . 2]"
44 PSI 1 44 ALA N 1 44 ALA CA 1 44 ALA C 1 45 LYS N -59.60 0.40 -51.07 -51.35 -51.94 . . 0 "[ . 1 . 2]"
45 PHI 1 46 GLY C 1 47 VAL N 1 47 VAL CA 1 47 VAL C -169.70 -109.70 -135.00 -140.90 -127.70 . . 0 "[ . 1 . 2]"
46 PSI 1 47 VAL N 1 47 VAL CA 1 47 VAL C 1 48 TRP N 129.50 -170.50 -178.21 -177.87 -178.06 . . 0 "[ . 1 . 2]"
47 PHI 1 47 VAL C 1 48 TRP N 1 48 TRP CA 1 48 TRP C -169.80 -109.80 -166.96 -167.42 -167.83 . . 0 "[ . 1 . 2]"
48 PSI 1 48 TRP N 1 48 TRP CA 1 48 TRP C 1 49 SER N 114.50 174.50 118.00 116.31 119.65 . . 0 "[ . 1 . 2]"
49 PHI 1 48 TRP C 1 49 SER N 1 49 SER CA 1 49 SER C -163.50 -103.50 -103.52 -103.51 -103.52 0.14 7 0 "[ . 1 . 2]"
50 PSI 1 49 SER N 1 49 SER CA 1 49 SER C 1 50 THR N 98.10 158.10 145.88 146.21 145.73 . . 0 "[ . 1 . 2]"
51 PHI 1 49 SER C 1 50 THR N 1 50 THR CA 1 50 THR C -154.40 -94.40 -154.49 -154.52 -154.55 0.21 20 0 "[ . 1 . 2]"
52 PSI 1 50 THR N 1 50 THR CA 1 50 THR C 1 51 LEU N 114.80 174.80 175.66 175.71 175.67 1.11 16 0 "[ . 1 . 2]"
53 PHI 1 52 PRO C 1 53 VAL N 1 53 VAL CA 1 53 VAL C -94.00 -34.00 -56.55 -57.36 -55.40 . . 0 "[ . 1 . 2]"
54 PSI 1 53 VAL N 1 53 VAL CA 1 53 VAL C 1 54 ASN N -62.00 -2.00 -43.38 -43.13 -43.15 . . 0 "[ . 1 . 2]"
55 PHI 1 53 VAL C 1 54 ASN N 1 54 ASN CA 1 54 ASN C -101.60 -41.60 -67.94 -68.38 -67.63 . . 0 "[ . 1 . 2]"
56 PSI 1 54 ASN N 1 54 ASN CA 1 54 ASN C 1 55 GLU N -69.10 -9.10 -33.57 -33.66 -33.78 . . 0 "[ . 1 . 2]"
57 PHI 1 54 ASN C 1 55 GLU N 1 55 GLU CA 1 55 GLU C -89.00 -29.00 -65.20 -64.94 -64.97 . . 0 "[ . 1 . 2]"
58 PSI 1 55 GLU N 1 55 GLU CA 1 55 GLU C 1 56 LYS N -72.00 -12.00 -57.60 -57.24 -57.36 . . 0 "[ . 1 . 2]"
59 PHI 1 55 GLU C 1 56 LYS N 1 56 LYS CA 1 56 LYS C -90.80 -30.80 -60.40 -61.48 -59.62 . . 0 "[ . 1 . 2]"
60 PSI 1 56 LYS N 1 56 LYS CA 1 56 LYS C 1 57 LYS N -68.70 -8.60 -36.27 -36.14 -36.14 . . 0 "[ . 1 . 2]"
61 PHI 1 56 LYS C 1 57 LYS N 1 57 LYS CA 1 57 LYS C -94.40 -34.40 -63.14 -63.14 -63.15 . . 0 "[ . 1 . 2]"
62 PSI 1 57 LYS N 1 57 LYS CA 1 57 LYS C 1 58 LEU N -72.30 -12.30 -49.41 -48.86 -49.06 . . 0 "[ . 1 . 2]"
63 PHI 1 57 LYS C 1 58 LEU N 1 58 LEU CA 1 58 LEU C -90.90 -30.90 -65.08 -66.10 -64.33 . . 0 "[ . 1 . 2]"
64 PSI 1 58 LEU N 1 58 LEU CA 1 58 LEU C 1 59 ASN N -71.50 -11.50 -35.65 -37.10 -34.80 . . 0 "[ . 1 . 2]"
65 PHI 1 58 LEU C 1 59 ASN N 1 59 ASN CA 1 59 ASN C -93.80 -33.80 -62.67 -62.05 -62.33 . . 0 "[ . 1 . 2]"
66 PSI 1 59 ASN N 1 59 ASN CA 1 59 ASN C 1 60 LEU N -69.80 -9.80 -50.72 -50.46 -50.52 . . 0 "[ . 1 . 2]"
67 PHI 1 59 ASN C 1 60 LEU N 1 60 LEU CA 1 60 LEU C -96.40 -36.40 -62.78 -64.07 -61.50 . . 0 "[ . 1 . 2]"
68 PSI 1 60 LEU N 1 60 LEU CA 1 60 LEU C 1 61 ALA N -66.60 -6.60 -46.56 -46.95 -46.97 . . 0 "[ . 1 . 2]"
69 PHI 1 60 LEU C 1 61 ALA N 1 61 ALA CA 1 61 ALA C -100.00 -40.00 -66.73 -65.94 -66.16 . . 0 "[ . 1 . 2]"
70 PSI 1 61 ALA N 1 61 ALA CA 1 61 ALA C 1 62 PHE N -71.10 -11.10 -26.33 -27.52 -24.32 . . 0 "[ . 1 . 2]"
71 PHI 1 61 ALA C 1 62 PHE N 1 62 PHE CA 1 62 PHE C -96.40 -36.40 -73.56 -79.16 -71.69 . . 0 "[ . 1 . 2]"
72 PSI 1 62 PHE N 1 62 PHE CA 1 62 PHE C 1 63 ARG N -70.10 -10.10 -50.94 -53.06 -48.97 . . 0 "[ . 1 . 2]"
73 PHI 1 62 PHE C 1 63 ARG N 1 63 ARG CA 1 63 ARG C -98.70 -38.70 -72.81 -71.19 -71.70 . . 0 "[ . 1 . 2]"
74 PSI 1 63 ARG N 1 63 ARG CA 1 63 ARG C 1 64 SER N -51.60 8.40 -25.62 -28.97 -23.78 . . 0 "[ . 1 . 2]"
75 PHI 1 66 ARG C 1 67 SER N 1 67 SER CA 1 67 SER C -175.80 -115.80 -127.62 -126.07 -126.49 . . 0 "[ . 1 . 2]"
76 PSI 1 67 SER N 1 67 SER CA 1 67 SER C 1 68 VAL N 117.90 177.90 171.86 166.30 177.35 . . 0 "[ . 1 . 2]"
77 PHI 1 67 SER C 1 68 VAL N 1 68 VAL CA 1 68 VAL C -136.20 -76.20 -136.22 -136.23 -136.25 0.14 12 0 "[ . 1 . 2]"
78 PSI 1 68 VAL N 1 68 VAL CA 1 68 VAL C 1 69 ILE N 92.50 152.50 107.62 103.00 102.07 . . 0 "[ . 1 . 2]"
79 PHI 1 68 VAL C 1 69 ILE N 1 69 ILE CA 1 69 ILE C -136.50 -76.50 -89.14 -129.00 -77.63 . . 0 "[ . 1 . 2]"
80 PSI 1 69 ILE N 1 69 ILE CA 1 69 ILE C 1 70 LEU N 87.30 147.30 144.26 111.11 147.37 0.07 20 0 "[ . 1 . 2]"
81 PHI 1 69 ILE C 1 70 LEU N 1 70 LEU CA 1 70 LEU C -135.70 -75.70 -125.37 -129.42 -131.50 . . 0 "[ . 1 . 2]"
82 PSI 1 70 LEU N 1 70 LEU CA 1 70 LEU C 1 71 ILE N 97.00 157.00 106.76 101.71 98.52 . . 0 "[ . 1 . 2]"
83 PHI 1 70 LEU C 1 71 ILE N 1 71 ILE CA 1 71 ILE C -138.10 -78.10 -89.43 -108.52 -80.35 . . 0 "[ . 1 . 2]"
84 PSI 1 71 ILE N 1 71 ILE CA 1 71 ILE C 1 72 PHE N 95.80 155.80 118.68 115.37 123.46 . . 0 "[ . 1 . 2]"
85 PHI 1 71 ILE C 1 72 PHE N 1 72 PHE CA 1 72 PHE C -147.00 -87.00 -87.22 -86.94 -86.95 0.11 16 0 "[ . 1 . 2]"
86 PSI 1 72 PHE N 1 72 PHE CA 1 72 PHE C 1 73 SER N 117.30 177.30 125.28 122.13 121.57 . . 0 "[ . 1 . 2]"
87 PHI 1 72 PHE C 1 73 SER N 1 73 SER CA 1 73 SER C -138.30 -78.30 -137.68 -138.40 -130.20 0.10 12 0 "[ . 1 . 2]"
88 PSI 1 73 SER N 1 73 SER CA 1 73 SER C 1 74 VAL N 95.70 155.70 114.91 102.41 123.57 . . 0 "[ . 1 . 2]"
89 PHI 1 73 SER C 1 74 VAL N 1 74 VAL CA 1 74 VAL C -136.10 -76.10 -77.67 -80.32 -89.51 0.09 2 0 "[ . 1 . 2]"
90 PSI 1 74 VAL N 1 74 VAL CA 1 74 VAL C 1 75 ARG N 96.30 156.30 142.06 138.80 136.18 . . 0 "[ . 1 . 2]"
91 PHI 1 76 GLU C 1 77 SER N 1 77 SER CA 1 77 SER C -121.50 -61.50 -114.27 -121.63 -96.87 0.13 11 0 "[ . 1 . 2]"
92 PSI 1 77 SER N 1 77 SER CA 1 77 SER C 1 78 GLY N -38.10 21.90 -33.75 -36.36 -37.58 0.00 3 0 "[ . 1 . 2]"
93 PHI 1 79 LYS C 1 80 PHE N 1 80 PHE CA 1 80 PHE C -140.70 -80.70 -81.01 -85.45 -80.62 0.08 16 0 "[ . 1 . 2]"
94 PSI 1 80 PHE N 1 80 PHE CA 1 80 PHE C 1 81 GLN N 106.90 166.90 152.09 138.19 166.89 . . 0 "[ . 1 . 2]"
95 PHI 1 82 GLY C 1 83 PHE N 1 83 PHE CA 1 83 PHE C -156.00 -96.00 -150.28 -156.12 -117.82 0.12 9 0 "[ . 1 . 2]"
96 PSI 1 83 PHE N 1 83 PHE CA 1 83 PHE C 1 84 ALA N 122.10 -177.90 171.00 -177.86 -177.87 0.08 6 0 "[ . 1 . 2]"
97 PHI 1 83 PHE C 1 84 ALA N 1 84 ALA CA 1 84 ALA C -175.80 -115.80 -162.31 -172.18 -172.60 . . 0 "[ . 1 . 2]"
98 PSI 1 84 ALA N 1 84 ALA CA 1 84 ALA C 1 85 ARG N 116.00 176.00 137.65 134.17 133.34 . . 0 "[ . 1 . 2]"
99 PHI 1 84 ALA C 1 85 ARG N 1 85 ARG CA 1 85 ARG C -147.20 -87.20 -91.04 -98.62 -87.14 0.06 1 0 "[ . 1 . 2]"
100 PSI 1 85 ARG N 1 85 ARG CA 1 85 ARG C 1 86 LEU N 110.60 170.60 138.30 127.75 159.20 . . 0 "[ . 1 . 2]"
101 PHI 1 85 ARG C 1 86 LEU N 1 86 LEU CA 1 86 LEU C -112.80 -52.80 -62.00 -53.07 -53.62 0.05 7 0 "[ . 1 . 2]"
102 PSI 1 86 LEU N 1 86 LEU CA 1 86 LEU C 1 87 SER N 106.30 166.30 107.56 106.17 111.18 0.13 8 0 "[ . 1 . 2]"
103 PHI 1 96 PRO C 1 97 ILE N 1 97 ILE CA 1 97 ILE C -119.80 -59.80 -75.01 -96.71 -64.70 . . 0 "[ . 1 . 2]"
104 PSI 1 97 ILE N 1 97 ILE CA 1 97 ILE C 1 98 HIS N 104.00 164.00 164.45 164.32 164.62 0.62 19 0 "[ . 1 . 2]"
105 PHI 1 99 TRP C 1 100 VAL N 1 100 VAL CA 1 100 VAL C -123.70 -63.70 -108.67 -123.18 -104.20 . . 0 "[ . 1 . 2]"
106 PSI 1 100 VAL N 1 100 VAL CA 1 100 VAL C 1 101 LEU N 90.40 150.40 96.44 91.99 91.11 0.04 19 0 "[ . 1 . 2]"
107 PHI 1 100 VAL C 1 101 LEU N 1 101 LEU CA 1 101 LEU C -124.00 -64.00 -107.08 -120.35 -100.07 . . 0 "[ . 1 . 2]"
108 PSI 1 101 LEU N 1 101 LEU CA 1 101 LEU C 1 102 PRO N 102.00 162.00 154.45 153.94 156.80 . . 0 "[ . 1 . 2]"
109 PHI 1 104 GLY C 1 105 MET N 1 105 MET CA 1 105 MET C -111.30 -51.30 -68.43 -89.33 -52.06 . . 0 "[ . 1 . 2]"
110 PSI 1 105 MET N 1 105 MET CA 1 105 MET C 1 106 SER N 118.80 178.80 142.56 134.81 157.27 . . 0 "[ . 1 . 2]"
111 PHI 1 105 MET C 1 106 SER N 1 106 SER CA 1 106 SER C -125.70 -65.70 -106.23 -103.22 -104.91 . . 0 "[ . 1 . 2]"
112 PSI 1 106 SER N 1 106 SER CA 1 106 SER C 1 107 ALA N 125.50 -174.50 143.90 130.87 159.17 . . 0 "[ . 1 . 2]"
113 PHI 1 106 SER C 1 107 ALA N 1 107 ALA CA 1 107 ALA C -88.50 -28.50 -69.07 -64.19 -65.30 . . 0 "[ . 1 . 2]"
114 PSI 1 107 ALA N 1 107 ALA CA 1 107 ALA C 1 108 LYS N -59.30 0.70 -24.11 -24.78 -22.81 . . 0 "[ . 1 . 2]"
115 PHI 1 107 ALA C 1 108 LYS N 1 108 LYS CA 1 108 LYS C -97.80 -37.80 -64.12 -62.66 -62.90 . . 0 "[ . 1 . 2]"
116 PSI 1 108 LYS N 1 108 LYS CA 1 108 LYS C 1 109 MET N -64.60 -4.60 -25.76 -25.60 -25.69 . . 0 "[ . 1 . 2]"
117 PHI 1 108 LYS C 1 109 MET N 1 109 MET CA 1 109 MET C -103.40 -43.40 -71.50 -73.39 -65.52 . . 0 "[ . 1 . 2]"
118 PSI 1 109 MET N 1 109 MET CA 1 109 MET C 1 110 LEU N -56.10 3.90 -25.48 -30.62 -18.40 . . 0 "[ . 1 . 2]"
119 PHI 1 109 MET C 1 110 LEU N 1 110 LEU CA 1 110 LEU C -128.80 -68.80 -68.80 -68.71 -68.71 0.25 10 0 "[ . 1 . 2]"
120 PSI 1 110 LEU N 1 110 LEU CA 1 110 LEU C 1 111 GLY N -34.90 25.10 -12.56 -13.44 -11.46 . . 0 "[ . 1 . 2]"
121 PHI 1 115 LYS C 1 116 ILE N 1 116 ILE CA 1 116 ILE C -164.20 -104.20 -104.41 -106.32 -104.06 0.14 1 0 "[ . 1 . 2]"
122 PSI 1 116 ILE N 1 116 ILE CA 1 116 ILE C 1 117 ASP N 129.40 -170.60 138.72 142.82 140.15 . . 0 "[ . 1 . 2]"
123 PHI 1 121 ARG C 1 122 ARG N 1 122 ARG CA 1 122 ARG C -150.70 -90.70 -136.65 -132.01 -133.52 . . 0 "[ . 1 . 2]"
124 PSI 1 122 ARG N 1 122 ARG CA 1 122 ARG C 1 123 GLU N 134.10 -165.90 -175.60 -169.97 -170.48 . . 0 "[ . 1 . 2]"
125 PHI 1 123 GLU C 1 124 LEU N 1 124 LEU CA 1 124 LEU C -168.30 -108.30 -160.23 -165.20 -150.77 . . 0 "[ . 1 . 2]"
126 PSI 1 124 LEU N 1 124 LEU CA 1 124 LEU C 1 125 PRO N 120.60 -179.40 119.08 119.08 119.05 2.42 5 0 "[ . 1 . 2]"
127 PHI 1 126 PHE C 1 127 THR N 1 127 THR CA 1 127 THR C -100.30 -40.30 -56.09 -58.81 -63.20 . . 0 "[ . 1 . 2]"
128 PSI 1 127 THR N 1 127 THR CA 1 127 THR C 1 128 LYS N -60.10 -0.10 -30.75 -35.33 -35.90 . . 0 "[ . 1 . 2]"
129 PHI 1 127 THR C 1 128 LYS N 1 128 LYS CA 1 128 LYS C -107.10 -47.10 -84.43 -92.30 -76.66 . . 0 "[ . 1 . 2]"
130 PSI 1 128 LYS N 1 128 LYS CA 1 128 LYS C 1 129 SER N -58.50 1.40 -26.90 -26.37 -26.69 . . 0 "[ . 1 . 2]"
131 PHI 1 132 LEU C 1 133 THR N 1 133 THR CA 1 133 THR C -144.00 -84.00 -144.04 -144.11 -143.95 0.11 3 0 "[ . 1 . 2]"
132 PSI 1 133 THR N 1 133 THR CA 1 133 THR C 1 134 ASN N 108.10 168.10 119.43 113.61 126.46 . . 0 "[ . 1 . 2]"
133 PHI 1 133 THR C 1 134 ASN N 1 134 ASN CA 1 134 ASN C -109.60 -49.60 -91.89 -90.23 -91.66 . . 0 "[ . 1 . 2]"
134 PSI 1 134 ASN N 1 134 ASN CA 1 134 ASN C 1 135 PRO N 107.70 167.70 106.91 106.74 107.10 0.96 20 0 "[ . 1 . 2]"
135 PHI 1 143 LYS C 1 144 ILE N 1 144 ILE CA 1 144 ILE C -137.90 -78.00 -103.33 -103.65 -103.73 . . 0 "[ . 1 . 2]"
136 PSI 1 144 ILE N 1 144 ILE CA 1 144 ILE C 1 145 GLY N 108.20 168.20 140.11 142.85 139.75 . . 0 "[ . 1 . 2]"
137 PHI 1 148 GLY C 1 149 GLN N 1 149 GLN CA 1 149 GLN C -106.20 -46.20 -105.92 -106.19 -106.20 0.08 9 0 "[ . 1 . 2]"
138 PSI 1 149 GLN N 1 149 GLN CA 1 149 GLN C 1 150 GLU N 101.90 161.90 123.99 123.65 122.32 0.03 16 0 "[ . 1 . 2]"
139 PHI 1 149 GLN C 1 150 GLU N 1 150 GLU CA 1 150 GLU C -105.20 -45.20 -62.20 -102.62 -52.02 . . 0 "[ . 1 . 2]"
140 PSI 1 150 GLU N 1 150 GLU CA 1 150 GLU C 1 151 ILE N 92.20 152.20 150.16 137.64 152.44 0.24 17 0 "[ . 1 . 2]"
141 PHI 1 150 GLU C 1 151 ILE N 1 151 ILE CA 1 151 ILE C -144.20 -84.20 -130.06 -140.20 -114.14 . . 0 "[ . 1 . 2]"
142 PSI 1 151 ILE N 1 151 ILE CA 1 151 ILE C 1 152 GLU N 98.80 158.80 143.70 133.48 147.88 . . 0 "[ . 1 . 2]"
143 PHI 1 152 GLU C 1 153 LEU N 1 153 LEU CA 1 153 LEU C -93.80 -33.80 -81.85 -86.27 -87.23 . . 0 "[ . 1 . 2]"
144 PSI 1 153 LEU N 1 153 LEU CA 1 153 LEU C 1 154 GLU N -68.10 -8.10 -56.89 -55.26 -55.85 . . 0 "[ . 1 . 2]"
145 PHI 1 153 LEU C 1 154 GLU N 1 154 GLU CA 1 154 GLU C -96.60 -36.60 -53.55 -53.67 -54.60 . . 0 "[ . 1 . 2]"
146 PSI 1 154 GLU N 1 154 GLU CA 1 154 GLU C 1 155 CYS N -70.70 -10.70 -47.24 -52.57 -42.96 . . 0 "[ . 1 . 2]"
147 PHI 1 154 GLU C 1 155 CYS N 1 155 CYS CA 1 155 CYS C -95.20 -35.20 -52.22 -55.42 -51.85 . . 0 "[ . 1 . 2]"
148 PSI 1 155 CYS N 1 155 CYS CA 1 155 CYS C 1 156 GLY N -73.90 -13.90 -67.56 -66.34 -66.90 . . 0 "[ . 1 . 2]"
149 PHI 1 155 CYS C 1 156 GLY N 1 156 GLY CA 1 156 GLY C -97.90 -37.90 -51.94 -51.72 -51.84 . . 0 "[ . 1 . 2]"
150 PSI 1 156 GLY N 1 156 GLY CA 1 156 GLY C 1 157 THR N -59.30 0.70 -47.05 -52.12 -45.02 . . 0 "[ . 1 . 2]"
151 PHI 1 156 GLY C 1 157 THR N 1 157 THR CA 1 157 THR C -93.20 -33.20 -50.94 -50.56 -50.80 . . 0 "[ . 1 . 2]"
152 PSI 1 157 THR N 1 157 THR CA 1 157 THR C 1 158 GLN N -71.60 -11.60 -66.32 -66.07 -66.66 . . 0 "[ . 1 . 2]"
153 PHI 1 157 THR C 1 158 GLN N 1 158 GLN CA 1 158 GLN C -90.20 -30.20 -50.07 -50.14 -50.16 . . 0 "[ . 1 . 2]"
154 PSI 1 158 GLN N 1 158 GLN CA 1 158 GLN C 1 159 LEU N -70.20 -10.20 -48.74 -50.72 -46.65 . . 0 "[ . 1 . 2]"
155 PHI 1 158 GLN C 1 159 LEU N 1 159 LEU CA 1 159 LEU C -93.00 -33.00 -52.11 -51.80 -51.82 . . 0 "[ . 1 . 2]"
156 PSI 1 159 LEU N 1 159 LEU CA 1 159 LEU C 1 160 CYS N -72.00 -12.00 -37.82 -38.78 -36.27 . . 0 "[ . 1 . 2]"
157 PHI 1 159 LEU C 1 160 CYS N 1 160 CYS CA 1 160 CYS C -92.30 -32.30 -70.38 -69.70 -69.93 . . 0 "[ . 1 . 2]"
158 PSI 1 160 CYS N 1 160 CYS CA 1 160 CYS C 1 161 LEU N -71.10 -11.10 -48.01 -49.60 -44.27 . . 0 "[ . 1 . 2]"
159 PHI 1 160 CYS C 1 161 LEU N 1 161 LEU CA 1 161 LEU C -95.60 -35.60 -56.96 -55.26 -55.46 . . 0 "[ . 1 . 2]"
160 PSI 1 161 LEU N 1 161 LEU CA 1 161 LEU C 1 162 LEU N -57.00 3.00 -34.76 -35.87 -31.08 . . 0 "[ . 1 . 2]"
161 PHI 1 165 PRO C 1 166 ASP N 1 166 ASP CA 1 166 ASP C -142.40 -82.40 -110.83 -105.09 -107.12 . . 0 "[ . 1 . 2]"
162 PSI 1 166 ASP N 1 166 ASP CA 1 166 ASP C 1 167 GLU N 106.90 166.90 133.81 136.89 132.75 . . 0 "[ . 1 . 2]"
163 PHI 1 169 ILE C 1 170 ASP N 1 170 ASP CA 1 170 ASP C -118.20 -58.20 -78.28 -81.07 -81.85 . . 0 "[ . 1 . 2]"
164 PSI 1 170 ASP N 1 170 ASP CA 1 170 ASP C 1 171 LEU N 88.40 148.40 108.12 93.31 128.10 . . 0 "[ . 1 . 2]"
165 PHI 1 170 ASP C 1 171 LEU N 1 171 LEU CA 1 171 LEU C -91.70 -31.70 -85.19 -81.43 -83.20 0.01 18 0 "[ . 1 . 2]"
166 PSI 1 171 LEU N 1 171 LEU CA 1 171 LEU C 1 172 TYR N -57.80 2.20 -39.44 -40.10 -41.24 . . 0 "[ . 1 . 2]"
167 PHI 1 171 LEU C 1 172 TYR N 1 172 TYR CA 1 172 TYR C -91.70 -31.70 -59.55 -63.58 -52.22 . . 0 "[ . 1 . 2]"
168 PSI 1 172 TYR N 1 172 TYR CA 1 172 TYR C 1 173 GLN N -71.60 -11.60 -42.71 -45.21 -39.09 . . 0 "[ . 1 . 2]"
169 PHI 1 172 TYR C 1 173 GLN N 1 173 GLN CA 1 173 GLN C -96.00 -36.00 -54.67 -54.67 -54.89 . . 0 "[ . 1 . 2]"
170 PSI 1 173 GLN N 1 173 GLN CA 1 173 GLN C 1 174 VAL N -66.30 -6.30 -31.67 -34.69 -26.85 . . 0 "[ . 1 . 2]"
171 PHI 1 173 GLN C 1 174 VAL N 1 174 VAL CA 1 174 VAL C -97.70 -37.70 -68.45 -70.25 -71.20 . . 0 "[ . 1 . 2]"
172 PSI 1 174 VAL N 1 174 VAL CA 1 174 VAL C 1 175 ILE N -73.70 -13.70 -29.56 -41.53 -25.88 . . 0 "[ . 1 . 2]"
173 PHI 1 174 VAL C 1 175 ILE N 1 175 ILE CA 1 175 ILE C -93.30 -33.30 -89.26 -93.73 -77.10 0.43 13 0 "[ . 1 . 2]"
174 PSI 1 175 ILE N 1 175 ILE CA 1 175 ILE C 1 176 HIS N -74.10 -14.10 -28.08 -25.31 -26.65 . . 0 "[ . 1 . 2]"
175 PHI 1 175 ILE C 1 176 HIS N 1 176 HIS CA 1 176 HIS C -93.70 -33.70 -68.36 -73.98 -63.79 . . 0 "[ . 1 . 2]"
176 PSI 1 176 HIS N 1 176 HIS CA 1 176 HIS C 1 177 LYS N -66.20 -6.20 -33.09 -36.61 -37.42 . . 0 "[ . 1 . 2]"
177 PHI 1 176 HIS C 1 177 LYS N 1 177 LYS CA 1 177 LYS C -100.60 -40.60 -71.25 -86.83 -56.27 . . 0 "[ . 1 . 2]"
178 PSI 1 177 LYS N 1 177 LYS CA 1 177 LYS C 1 178 MET N -55.90 4.10 -27.72 -31.49 -32.65 . . 0 "[ . 1 . 2]"
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