NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
605105 |
2n3l   |
25650 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2n3l
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 133
_TA_constraint_stats_list.Viol_count 265
_TA_constraint_stats_list.Viol_total 34749.19
_TA_constraint_stats_list.Viol_max 22.43
_TA_constraint_stats_list.Viol_rms 2.61
_TA_constraint_stats_list.Viol_average_all_restraints 0.65
_TA_constraint_stats_list.Viol_average_violations_only 6.56
_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 10 VAL C 1 11 SER N 1 11 SER CA 1 11 SER C -91.20 -51.20 -83.70 -83.89 -84.96 . . 0 "[ . 1 . 2]"
2 PSI 1 11 SER N 1 11 SER CA 1 11 SER C 1 12 ARG N 118.90 158.90 126.56 122.28 121.20 . . 0 "[ . 1 . 2]"
3 PHI 1 11 SER C 1 12 ARG N 1 12 ARG CA 1 12 ARG C -148.70 -108.70 -135.60 -143.93 -118.83 . . 0 "[ . 1 . 2]"
4 PSI 1 12 ARG N 1 12 ARG CA 1 12 ARG C 1 13 ILE N 129.40 169.40 155.51 159.19 158.50 . . 0 "[ . 1 . 2]"
5 PHI 1 12 ARG C 1 13 ILE N 1 13 ILE CA 1 13 ILE C -150.40 -110.40 -119.10 -115.56 -116.65 . . 0 "[ . 1 . 2]"
6 PSI 1 13 ILE N 1 13 ILE CA 1 13 ILE C 1 14 TYR N 118.50 158.50 138.13 132.33 143.98 . . 0 "[ . 1 . 2]"
7 PHI 1 13 ILE C 1 14 TYR N 1 14 TYR CA 1 14 TYR C -132.30 -92.30 -105.76 -103.00 -104.95 . . 0 "[ . 1 . 2]"
8 PSI 1 14 TYR N 1 14 TYR CA 1 14 TYR C 1 15 VAL N 106.30 146.30 115.74 114.40 113.95 . . 0 "[ . 1 . 2]"
9 PHI 1 14 TYR C 1 15 VAL N 1 15 VAL CA 1 15 VAL C -134.50 -94.50 -123.40 -125.87 -127.24 . . 0 "[ . 1 . 2]"
10 PSI 1 15 VAL N 1 15 VAL CA 1 15 VAL C 1 16 GLY N 102.70 142.70 110.52 103.89 133.05 . . 0 "[ . 1 . 2]"
11 PHI 1 16 GLY C 1 17 ASN N 1 17 ASN CA 1 17 ASN C 40.60 80.60 54.72 50.45 50.13 . . 0 "[ . 1 . 2]"
12 PSI 1 17 ASN N 1 17 ASN CA 1 17 ASN C 1 18 LEU N 18.10 58.10 26.09 24.20 23.22 . . 0 "[ . 1 . 2]"
13 PHI 1 17 ASN C 1 18 LEU N 1 18 LEU CA 1 18 LEU C -97.10 -57.10 -83.69 -79.71 -82.57 . . 0 "[ . 1 . 2]"
14 PSI 1 18 LEU N 1 18 LEU CA 1 18 LEU C 1 19 PRO N 117.20 157.20 140.55 123.54 151.20 . . 0 "[ . 1 . 2]"
15 PSI 1 19 PRO N 1 19 PRO CA 1 19 PRO C 1 20 SER N 122.40 162.40 135.20 120.11 151.70 2.29 5 0 "[ . 1 . 2]"
16 PHI 1 21 HIS C 1 22 VAL N 1 22 VAL CA 1 22 VAL C -101.00 -61.00 -79.00 -66.02 -69.18 2.23 5 0 "[ . 1 . 2]"
17 PSI 1 22 VAL N 1 22 VAL CA 1 22 VAL C 1 23 SER N 116.10 156.10 123.38 120.49 119.78 . . 0 "[ . 1 . 2]"
18 PHI 1 22 VAL C 1 23 SER N 1 23 SER CA 1 23 SER C -116.90 -76.90 -83.01 -91.10 -78.80 . . 0 "[ . 1 . 2]"
19 PSI 1 23 SER N 1 23 SER CA 1 23 SER C 1 24 SER N 147.10 -172.90 162.34 154.06 177.53 . . 0 "[ . 1 . 2]"
20 PHI 1 23 SER C 1 24 SER N 1 24 SER CA 1 24 SER C -79.90 -39.90 -53.39 -47.18 -47.79 . . 0 "[ . 1 . 2]"
21 PSI 1 24 SER N 1 24 SER CA 1 24 SER C 1 25 ARG N -58.20 -18.20 -40.12 -49.97 -28.20 . . 0 "[ . 1 . 2]"
22 PHI 1 24 SER C 1 25 ARG N 1 25 ARG CA 1 25 ARG C -85.40 -45.40 -63.55 -77.19 -53.99 . . 0 "[ . 1 . 2]"
23 PSI 1 25 ARG N 1 25 ARG CA 1 25 ARG C 1 26 ASP N -56.70 -16.70 -42.23 -46.46 -47.11 . . 0 "[ . 1 . 2]"
24 PHI 1 25 ARG C 1 26 ASP N 1 26 ASP CA 1 26 ASP C -86.50 -46.50 -69.33 -68.40 -70.70 . . 0 "[ . 1 . 2]"
25 PSI 1 26 ASP N 1 26 ASP CA 1 26 ASP C 1 27 VAL N -62.50 -22.50 -39.91 -35.45 -35.97 3.56 4 0 "[ . 1 . 2]"
26 PHI 1 26 ASP C 1 27 VAL N 1 27 VAL CA 1 27 VAL C -84.40 -44.40 -65.38 -67.62 -68.62 . . 0 "[ . 1 . 2]"
27 PSI 1 27 VAL N 1 27 VAL CA 1 27 VAL C 1 28 GLU N -64.50 -24.50 -41.64 -54.04 -29.91 . . 0 "[ . 1 . 2]"
28 PHI 1 27 VAL C 1 28 GLU N 1 28 GLU CA 1 28 GLU C -80.40 -40.40 -56.66 -65.79 -49.12 . . 0 "[ . 1 . 2]"
29 PSI 1 28 GLU N 1 28 GLU CA 1 28 GLU C 1 29 ASN N -61.50 -21.50 -53.16 -56.82 -60.44 . . 0 "[ . 1 . 2]"
30 PHI 1 28 GLU C 1 29 ASN N 1 29 ASN CA 1 29 ASN C -85.90 -45.90 -72.79 -81.33 -65.40 . . 0 "[ . 1 . 2]"
31 PSI 1 29 ASN N 1 29 ASN CA 1 29 ASN C 1 30 GLU N -57.10 -17.10 -54.46 -59.26 -61.82 5.97 9 2 "[ . -+1 . 2]"
32 PHI 1 29 ASN C 1 30 GLU N 1 30 GLU CA 1 30 GLU C -88.80 -48.80 -65.22 -69.48 -70.42 . . 0 "[ . 1 . 2]"
33 PSI 1 30 GLU N 1 30 GLU CA 1 30 GLU C 1 31 PHE N -55.80 -15.80 -38.88 -26.99 -29.85 . . 0 "[ . 1 . 2]"
34 PHI 1 30 GLU C 1 31 PHE N 1 31 PHE CA 1 31 PHE C -89.90 -49.90 -81.76 -90.98 -74.59 1.08 2 0 "[ . 1 . 2]"
35 PSI 1 31 PHE N 1 31 PHE CA 1 31 PHE C 1 32 ARG N -56.40 -16.40 -24.57 -31.93 -35.61 0.64 17 0 "[ . 1 . 2]"
36 PHI 1 31 PHE C 1 32 ARG N 1 32 ARG CA 1 32 ARG C -85.20 -45.20 -62.48 -72.44 -51.46 . . 0 "[ . 1 . 2]"
37 PSI 1 32 ARG N 1 32 ARG CA 1 32 ARG C 1 33 LYS N -54.50 -14.50 -29.79 -28.34 -28.45 . . 0 "[ . 1 . 2]"
38 PHI 1 32 ARG C 1 33 LYS N 1 33 LYS CA 1 33 LYS C -86.10 -46.10 -61.83 -52.03 -53.55 . . 0 "[ . 1 . 2]"
39 PSI 1 33 LYS N 1 33 LYS CA 1 33 LYS C 1 34 TYR N -51.40 -11.40 -33.95 -36.21 -45.86 . . 0 "[ . 1 . 2]"
40 PHI 1 33 LYS C 1 34 TYR N 1 34 TYR CA 1 34 TYR C -98.40 -58.40 -81.12 -92.89 -71.83 . . 0 "[ . 1 . 2]"
41 PSI 1 34 TYR N 1 34 TYR CA 1 34 TYR C 1 35 GLY N -42.50 -2.50 -37.03 -49.47 -11.27 6.97 9 1 "[ . +1 . 2]"
42 PHI 1 36 ASN C 1 37 ILE N 1 37 ILE CA 1 37 ILE C -106.20 -66.20 -76.40 -71.74 -73.61 . . 0 "[ . 1 . 2]"
43 PSI 1 37 ILE N 1 37 ILE CA 1 37 ILE C 1 38 LEU N 106.50 146.50 132.78 136.73 134.60 . . 0 "[ . 1 . 2]"
44 PHI 1 37 ILE C 1 38 LEU N 1 38 LEU CA 1 38 LEU C -109.40 -69.40 -101.02 -103.81 -106.46 . . 0 "[ . 1 . 2]"
45 PSI 1 38 LEU N 1 38 LEU CA 1 38 LEU C 1 39 LYS N -57.10 -17.10 -32.92 -49.02 -17.83 . . 0 "[ . 1 . 2]"
46 PHI 1 38 LEU C 1 39 LYS N 1 39 LYS CA 1 39 LYS C -175.00 -135.00 -149.17 -150.01 -152.05 . . 0 "[ . 1 . 2]"
47 PSI 1 39 LYS N 1 39 LYS CA 1 39 LYS C 1 40 CYS N 122.90 162.90 137.05 128.20 153.82 . . 0 "[ . 1 . 2]"
48 PHI 1 39 LYS C 1 40 CYS N 1 40 CYS CA 1 40 CYS C -138.60 -98.60 -133.58 -145.96 -105.65 7.36 3 1 "[ + . 1 . 2]"
49 PSI 1 40 CYS N 1 40 CYS CA 1 40 CYS C 1 41 ASP N 107.30 147.30 115.06 107.40 105.47 1.83 1 0 "[ . 1 . 2]"
50 PHI 1 40 CYS C 1 41 ASP N 1 41 ASP CA 1 41 ASP C -138.50 -98.50 -123.62 -109.13 -112.45 . . 0 "[ . 1 . 2]"
51 PSI 1 41 ASP N 1 41 ASP CA 1 41 ASP C 1 42 VAL N 113.50 153.50 137.76 145.98 144.83 . . 0 "[ . 1 . 2]"
52 PHI 1 41 ASP C 1 42 VAL N 1 42 VAL CA 1 42 VAL C -126.20 -86.20 -114.32 -127.15 -97.09 0.95 10 0 "[ . 1 . 2]"
53 PSI 1 42 VAL N 1 42 VAL CA 1 42 VAL C 1 43 LYS N 105.10 145.10 117.42 110.09 129.06 . . 0 "[ . 1 . 2]"
54 PHI 1 42 VAL C 1 43 LYS N 1 43 LYS CA 1 43 LYS C -141.90 -102.00 -112.64 -121.45 -106.08 . . 0 "[ . 1 . 2]"
55 PSI 1 43 LYS N 1 43 LYS CA 1 43 LYS C 1 44 LYS N 127.80 167.80 145.50 135.32 131.37 . . 0 "[ . 1 . 2]"
56 PHI 1 43 LYS C 1 44 LYS N 1 44 LYS CA 1 44 LYS C -131.50 -91.50 -128.15 -126.42 -127.37 2.00 16 0 "[ . 1 . 2]"
57 PSI 1 44 LYS N 1 44 LYS CA 1 44 LYS C 1 45 THR N 118.10 158.10 142.87 143.92 142.78 . . 0 "[ . 1 . 2]"
58 PHI 1 44 LYS C 1 45 THR N 1 45 THR CA 1 45 THR C -105.30 -65.30 -100.01 -100.32 -100.59 . . 0 "[ . 1 . 2]"
59 PSI 1 45 THR N 1 45 THR CA 1 45 THR C 1 46 VAL N 151.70 -168.30 168.17 159.36 176.88 . . 0 "[ . 1 . 2]"
60 PHI 1 45 THR C 1 46 VAL N 1 46 VAL CA 1 46 VAL C -84.70 -44.70 -74.04 -75.57 -75.63 . . 0 "[ . 1 . 2]"
61 PSI 1 46 VAL N 1 46 VAL CA 1 46 VAL C 1 47 SER N -40.90 -0.90 -10.53 -18.13 -3.70 . . 0 "[ . 1 . 2]"
62 PHI 1 46 VAL C 1 47 SER N 1 47 SER CA 1 47 SER C -106.90 -66.90 -84.16 -98.83 -75.52 . . 0 "[ . 1 . 2]"
63 PSI 1 47 SER N 1 47 SER CA 1 47 SER C 1 48 GLY N -23.40 16.60 -1.44 -12.87 8.36 . . 0 "[ . 1 . 2]"
64 PHI 1 47 SER C 1 48 GLY N 1 48 GLY CA 1 48 GLY C 72.30 112.30 91.67 82.73 82.54 . . 0 "[ . 1 . 2]"
65 PSI 1 48 GLY N 1 48 GLY CA 1 48 GLY C 1 49 ALA N -13.50 26.50 -4.94 -4.74 -4.89 . . 0 "[ . 1 . 2]"
66 PHI 1 48 GLY C 1 49 ALA N 1 49 ALA CA 1 49 ALA C -96.80 -56.80 -85.84 -89.53 -78.31 . . 0 "[ . 1 . 2]"
67 PSI 1 49 ALA N 1 49 ALA CA 1 49 ALA C 1 50 ALA N 121.80 161.80 136.80 130.85 152.74 . . 0 "[ . 1 . 2]"
68 PHI 1 49 ALA C 1 50 ALA N 1 50 ALA CA 1 50 ALA C -143.80 -103.80 -110.15 -104.96 -105.34 . . 0 "[ . 1 . 2]"
69 PSI 1 50 ALA N 1 50 ALA CA 1 50 ALA C 1 51 PHE N 117.00 157.00 146.86 146.89 146.26 . . 0 "[ . 1 . 2]"
70 PHI 1 50 ALA C 1 51 PHE N 1 51 PHE CA 1 51 PHE C -171.30 -131.30 -132.04 -127.49 -128.29 6.18 4 1 "[ +. 1 . 2]"
71 PSI 1 51 PHE N 1 51 PHE CA 1 51 PHE C 1 52 ALA N 142.60 -177.40 150.30 145.02 165.91 . . 0 "[ . 1 . 2]"
72 PHI 1 51 PHE C 1 52 ALA N 1 52 ALA CA 1 52 ALA C -148.00 -108.00 -126.61 -141.35 -115.47 . . 0 "[ . 1 . 2]"
73 PSI 1 52 ALA N 1 52 ALA CA 1 52 ALA C 1 53 PHE N 130.90 170.90 140.37 137.00 135.57 . . 0 "[ . 1 . 2]"
74 PHI 1 52 ALA C 1 53 PHE N 1 53 PHE CA 1 53 PHE C -139.20 -99.20 -121.15 -132.97 -106.12 . . 0 "[ . 1 . 2]"
75 PSI 1 53 PHE N 1 53 PHE CA 1 53 PHE C 1 54 ILE N 112.40 152.40 117.57 113.31 122.15 . . 0 "[ . 1 . 2]"
76 PHI 1 53 PHE C 1 54 ILE N 1 54 ILE CA 1 54 ILE C -140.50 -100.50 -125.40 -135.33 -115.10 . . 0 "[ . 1 . 2]"
77 PSI 1 54 ILE N 1 54 ILE CA 1 54 ILE C 1 55 GLU N 103.20 143.20 112.08 112.26 111.56 . . 0 "[ . 1 . 2]"
78 PHI 1 54 ILE C 1 55 GLU N 1 55 GLU CA 1 55 GLU C -121.60 -81.60 -102.66 -115.52 -88.58 . . 0 "[ . 1 . 2]"
79 PSI 1 55 GLU N 1 55 GLU CA 1 55 GLU C 1 56 PHE N 99.90 139.90 108.75 107.53 106.98 . . 0 "[ . 1 . 2]"
80 PHI 1 55 GLU C 1 56 PHE N 1 56 PHE CA 1 56 PHE C -112.50 -72.50 -112.17 -110.24 -111.43 5.08 18 2 "[ . - 1 . + 2]"
81 PSI 1 56 PHE N 1 56 PHE CA 1 56 PHE C 1 57 GLU N 135.60 175.60 160.94 152.94 146.60 . . 0 "[ . 1 . 2]"
82 PHI 1 56 PHE C 1 57 GLU N 1 57 GLU CA 1 57 GLU C -88.40 -48.40 -77.86 -82.30 -82.81 . . 0 "[ . 1 . 2]"
83 PSI 1 57 GLU N 1 57 GLU CA 1 57 GLU C 1 58 ASP N -55.40 -15.40 -32.75 -30.12 -31.18 . . 0 "[ . 1 . 2]"
84 PHI 1 57 GLU C 1 58 ASP N 1 58 ASP CA 1 58 ASP C -152.80 -112.80 -117.08 -117.48 -117.75 1.39 7 0 "[ . 1 . 2]"
85 PSI 1 58 ASP N 1 58 ASP CA 1 58 ASP C 1 59 ALA N 124.40 164.40 120.57 120.89 120.25 11.98 11 8 "[ **.-** *+ . * 2]"
86 PHI 1 58 ASP C 1 59 ALA N 1 59 ALA CA 1 59 ALA C -82.70 -42.70 -78.27 -76.60 -76.90 1.61 18 0 "[ . 1 . 2]"
87 PSI 1 59 ALA N 1 59 ALA CA 1 59 ALA C 1 60 ARG N -54.30 -14.30 -39.03 -35.87 -38.37 . . 0 "[ . 1 . 2]"
88 PHI 1 59 ALA C 1 60 ARG N 1 60 ARG CA 1 60 ARG C -84.00 -44.00 -75.74 -80.71 -60.21 . . 0 "[ . 1 . 2]"
89 PSI 1 60 ARG N 1 60 ARG CA 1 60 ARG C 1 61 ASP N -56.50 -16.50 -30.07 -34.90 -40.11 . . 0 "[ . 1 . 2]"
90 PHI 1 60 ARG C 1 61 ASP N 1 61 ASP CA 1 61 ASP C -87.60 -47.60 -74.03 -63.22 -68.43 . . 0 "[ . 1 . 2]"
91 PSI 1 61 ASP N 1 61 ASP CA 1 61 ASP C 1 62 ALA N -58.20 -18.20 -36.13 -50.57 -25.86 . . 0 "[ . 1 . 2]"
92 PHI 1 61 ASP C 1 62 ALA N 1 62 ALA CA 1 62 ALA C -85.20 -45.20 -64.27 -75.33 -50.02 . . 0 "[ . 1 . 2]"
93 PSI 1 62 ALA N 1 62 ALA CA 1 62 ALA C 1 63 ALA N -62.60 -22.60 -23.15 -27.93 -14.60 8.00 3 1 "[ + . 1 . 2]"
94 PHI 1 62 ALA C 1 63 ALA N 1 63 ALA CA 1 63 ALA C -83.70 -43.70 -52.08 -59.37 -44.88 . . 0 "[ . 1 . 2]"
95 PSI 1 63 ALA N 1 63 ALA CA 1 63 ALA C 1 64 ASP N -58.40 -18.40 -32.80 -45.89 -22.25 . . 0 "[ . 1 . 2]"
96 PHI 1 63 ALA C 1 64 ASP N 1 64 ASP CA 1 64 ASP C -85.70 -45.70 -59.43 -70.99 -50.66 . . 0 "[ . 1 . 2]"
97 PSI 1 64 ASP N 1 64 ASP CA 1 64 ASP C 1 65 ALA N -62.20 -22.20 -47.17 -48.14 -50.82 . . 0 "[ . 1 . 2]"
98 PHI 1 64 ASP C 1 65 ALA N 1 65 ALA CA 1 65 ALA C -85.00 -45.00 -66.80 -76.51 -57.09 . . 0 "[ . 1 . 2]"
99 PSI 1 65 ALA N 1 65 ALA CA 1 65 ALA C 1 66 ILE N -62.50 -22.50 -38.91 -39.92 -42.54 . . 0 "[ . 1 . 2]"
100 PHI 1 65 ALA C 1 66 ILE N 1 66 ILE CA 1 66 ILE C -82.70 -42.70 -69.70 -73.78 -62.50 . . 0 "[ . 1 . 2]"
101 PSI 1 66 ILE N 1 66 ILE CA 1 66 ILE C 1 67 LYS N -64.10 -24.10 -37.61 -50.04 -28.85 . . 0 "[ . 1 . 2]"
102 PHI 1 66 ILE C 1 67 LYS N 1 67 LYS CA 1 67 LYS C -86.90 -46.90 -67.66 -63.61 -65.92 . . 0 "[ . 1 . 2]"
103 PSI 1 67 LYS N 1 67 LYS CA 1 67 LYS C 1 68 GLU N -53.70 -13.70 -28.13 -34.85 -20.68 . . 0 "[ . 1 . 2]"
104 PHI 1 67 LYS C 1 68 GLU N 1 68 GLU CA 1 68 GLU C -96.00 -56.00 -76.05 -65.64 -69.45 . . 0 "[ . 1 . 2]"
105 PSI 1 68 GLU N 1 68 GLU CA 1 68 GLU C 1 69 LYS N -51.50 -11.50 -24.33 -37.26 -17.10 . . 0 "[ . 1 . 2]"
106 PHI 1 68 GLU C 1 69 LYS N 1 69 LYS CA 1 69 LYS C -119.90 -79.90 -103.73 -113.42 -92.36 . . 0 "[ . 1 . 2]"
107 PSI 1 69 LYS N 1 69 LYS CA 1 69 LYS C 1 70 ASP N -19.50 20.50 11.99 16.72 15.17 . . 0 "[ . 1 . 2]"
108 PHI 1 69 LYS C 1 70 ASP N 1 70 ASP CA 1 70 ASP C -78.60 -38.60 -72.80 -79.79 -51.54 1.19 3 0 "[ . 1 . 2]"
109 PSI 1 70 ASP N 1 70 ASP CA 1 70 ASP C 1 71 GLY N 107.70 147.70 158.23 160.03 159.63 17.27 11 19 [**********+**-.*****]
110 PHI 1 70 ASP C 1 71 GLY N 1 71 GLY CA 1 71 GLY C 67.40 107.40 115.91 112.03 122.76 15.36 11 19 "[**********+*****- **]"
111 PSI 1 71 GLY N 1 71 GLY CA 1 71 GLY C 1 72 CYS N -25.20 14.80 27.32 21.75 31.99 17.19 4 20 [***+**************-*]
112 PHI 1 71 GLY C 1 72 CYS N 1 72 CYS CA 1 72 CYS C -97.10 -57.10 -53.95 -59.81 -44.68 12.42 11 9 "[* ****- **+ . 2]"
113 PSI 1 72 CYS N 1 72 CYS CA 1 72 CYS C 1 73 ASP N 129.50 169.50 130.24 123.33 139.49 6.17 7 2 "[ . +- 1 . 2]"
114 PHI 1 72 CYS C 1 73 ASP N 1 73 ASP CA 1 73 ASP C -114.20 -74.20 -127.33 -131.63 -133.19 22.43 16 20 [***************+***-]
115 PSI 1 73 ASP N 1 73 ASP CA 1 73 ASP C 1 74 PHE N 106.60 146.60 143.34 149.07 147.68 6.81 11 2 "[ . - 1+ . 2]"
116 PHI 1 73 ASP C 1 74 PHE N 1 74 PHE CA 1 74 PHE C -146.10 -106.10 -147.30 -147.59 -147.77 9.53 11 4 "[ * -*+ . 2]"
117 PSI 1 74 PHE N 1 74 PHE CA 1 74 PHE C 1 75 GLU N 97.20 137.20 145.35 139.29 149.38 12.18 18 18 "[*****-***1 ******+**]"
118 PHI 1 74 PHE C 1 75 GLU N 1 75 GLU CA 1 75 GLU C 32.10 72.10 72.43 73.02 72.35 4.20 16 0 "[ . 1 . 2]"
119 PSI 1 75 GLU N 1 75 GLU CA 1 75 GLU C 1 76 GLY N 21.30 61.30 64.24 51.39 68.61 7.31 13 6 "[ . 1 *+ .-* **]"
120 PHI 1 75 GLU C 1 76 GLY N 1 76 GLY CA 1 76 GLY C 60.70 100.70 97.25 99.02 98.74 1.18 12 0 "[ . 1 . 2]"
121 PSI 1 76 GLY N 1 76 GLY CA 1 76 GLY C 1 77 ASN N -17.80 22.20 -12.23 -13.19 -13.68 . . 0 "[ . 1 . 2]"
122 PHI 1 76 GLY C 1 77 ASN N 1 77 ASN CA 1 77 ASN C -127.50 -87.50 -118.68 -112.79 -113.23 . . 0 "[ . 1 . 2]"
123 PSI 1 77 ASN N 1 77 ASN CA 1 77 ASN C 1 78 LYS N 115.70 155.70 121.56 121.90 121.28 . . 0 "[ . 1 . 2]"
124 PHI 1 77 ASN C 1 78 LYS N 1 78 LYS CA 1 78 LYS C -98.70 -58.70 -96.16 -95.59 -95.96 5.84 9 1 "[ . +1 . 2]"
125 PSI 1 78 LYS N 1 78 LYS CA 1 78 LYS C 1 79 LEU N 99.70 139.70 105.74 103.25 102.90 . . 0 "[ . 1 . 2]"
126 PHI 1 79 LEU C 1 80 ARG N 1 80 ARG CA 1 80 ARG C -126.80 -86.80 -95.48 -96.54 -96.60 . . 0 "[ . 1 . 2]"
127 PSI 1 80 ARG N 1 80 ARG CA 1 80 ARG C 1 81 VAL N 106.50 146.50 112.91 107.58 118.09 . . 0 "[ . 1 . 2]"
128 PHI 1 80 ARG C 1 81 VAL N 1 81 VAL CA 1 81 VAL C -135.90 -95.90 -127.73 -123.48 -126.87 . . 0 "[ . 1 . 2]"
129 PSI 1 81 VAL N 1 81 VAL CA 1 81 VAL C 1 82 GLU N 111.80 151.80 118.27 111.46 125.83 0.34 11 0 "[ . 1 . 2]"
130 PHI 1 81 VAL C 1 82 GLU N 1 82 GLU CA 1 82 GLU C -157.90 -117.90 -146.89 -138.70 -142.95 . . 0 "[ . 1 . 2]"
131 PSI 1 82 GLU N 1 82 GLU CA 1 82 GLU C 1 83 VAL N 133.50 173.50 141.59 140.97 138.66 2.07 7 0 "[ . 1 . 2]"
132 PHI 1 82 GLU C 1 83 VAL N 1 83 VAL CA 1 83 VAL C -96.50 -56.50 -87.10 -91.74 -93.12 . . 0 "[ . 1 . 2]"
133 PSI 1 83 VAL N 1 83 VAL CA 1 83 VAL C 1 84 PRO N 123.00 163.00 125.61 121.95 135.86 1.05 12 0 "[ . 1 . 2]"
stop_
save_
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