NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
591950 |
2msl   |
25125 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2msl
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 173
_TA_constraint_stats_list.Viol_count 1199
_TA_constraint_stats_list.Viol_total 55187.36
_TA_constraint_stats_list.Viol_max 13.99
_TA_constraint_stats_list.Viol_rms 1.56
_TA_constraint_stats_list.Viol_average_all_restraints 0.51
_TA_constraint_stats_list.Viol_average_violations_only 1.84
_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 CHI1 1 5 ILE N 1 5 ILE CA 1 5 ILE CB 1 5 ILE CG1 -75.00 -45.00 -66.28 -65.45 -66.59 . . 0 "[ . 1 . 2 .]"
2 CHI21 1 5 ILE CA 1 5 ILE CB 1 5 ILE CG1 1 5 ILE CD1 155.00 -175.00 162.18 163.76 162.45 . . 0 "[ . 1 . 2 .]"
3 CHI1 1 6 VAL N 1 6 VAL CA 1 6 VAL CB 1 6 VAL CG1 165.00 -165.00 -167.11 175.24 -164.06 0.94 25 0 "[ . 1 . 2 .]"
4 CHI1 1 7 TRP N 1 7 TRP CA 1 7 TRP CB 1 7 TRP CG -75.00 -45.00 -69.54 -76.28 -63.76 1.28 20 0 "[ . 1 . 2 .]"
5 CHI1 1 8 VAL N 1 8 VAL CA 1 8 VAL CB 1 8 VAL CG1 165.00 -165.00 -178.81 170.77 -164.58 0.42 4 0 "[ . 1 . 2 .]"
6 CHI1 1 9 VAL N 1 9 VAL CA 1 9 VAL CB 1 9 VAL CG1 45.00 75.00 62.58 65.77 62.76 0.08 5 0 "[ . 1 . 2 .]"
7 CHI1 1 15 ILE N 1 15 ILE CA 1 15 ILE CB 1 15 ILE CG1 -75.00 -45.00 -65.37 -71.70 -59.75 . . 0 "[ . 1 . 2 .]"
8 CHI21 1 15 ILE CA 1 15 ILE CB 1 15 ILE CG1 1 15 ILE CD1 -75.00 -45.00 -59.49 -60.12 -60.51 . . 0 "[ . 1 . 2 .]"
9 CHI1 1 17 TRP N 1 17 TRP CA 1 17 TRP CB 1 17 TRP CG 165.00 -165.00 163.36 159.72 172.24 5.28 16 1 "[ . 1 .+ 2 .]"
10 CHI2 1 19 LEU CA 1 19 LEU CB 1 19 LEU CG 1 19 LEU CD1 165.00 -165.00 166.26 161.43 -172.20 3.57 11 0 "[ . 1 . 2 .]"
11 CHI2 1 23 LEU CA 1 23 LEU CB 1 23 LEU CG 1 23 LEU CD1 165.00 -165.00 173.24 164.57 164.49 1.79 18 0 "[ . 1 . 2 .]"
12 CHI2 1 28 LEU CA 1 28 LEU CB 1 28 LEU CG 1 28 LEU CD1 165.00 -165.00 167.39 169.86 169.03 1.76 15 0 "[ . 1 . 2 .]"
13 CHI1 1 29 THR N 1 29 THR CA 1 29 THR CB 1 29 THR OG1 -75.00 -45.00 -45.59 -45.10 -45.51 0.44 4 0 "[ . 1 . 2 .]"
14 CHI1 1 31 THR N 1 31 THR CA 1 31 THR CB 1 31 THR OG1 -75.00 -45.00 -48.88 -43.78 -43.96 2.09 10 0 "[ . 1 . 2 .]"
15 CHI1 1 32 THR N 1 32 THR CA 1 32 THR CB 1 32 THR OG1 45.00 75.00 71.71 54.95 75.66 0.66 20 0 "[ . 1 . 2 .]"
16 CHI1 1 33 PHE N 1 33 PHE CA 1 33 PHE CB 1 33 PHE CG -75.00 -45.00 -63.37 -66.83 -61.00 . . 0 "[ . 1 . 2 .]"
17 CHI1 1 39 VAL N 1 39 VAL CA 1 39 VAL CB 1 39 VAL CG1 165.00 -165.00 -166.97 -163.94 -164.22 1.58 2 0 "[ . 1 . 2 .]"
18 CHI2 1 40 LEU CA 1 40 LEU CB 1 40 LEU CG 1 40 LEU CD1 45.00 75.00 57.55 55.71 55.69 3.41 19 0 "[ . 1 . 2 .]"
19 CHI2 1 43 LEU CA 1 43 LEU CB 1 43 LEU CG 1 43 LEU CD1 165.00 -165.00 -174.35 -172.70 -175.01 . . 0 "[ . 1 . 2 .]"
20 CHI1 1 47 THR N 1 47 THR CA 1 47 THR CB 1 47 THR OG1 -75.00 75.00 -12.09 -8.44 -8.87 . . 0 "[ . 1 . 2 .]"
21 CHI21 1 55 ILE CA 1 55 ILE CB 1 55 ILE CG1 1 55 ILE CD1 155.00 -175.00 171.63 153.60 -178.91 1.40 15 0 "[ . 1 . 2 .]"
22 CHI2 1 65 LEU CA 1 65 LEU CB 1 65 LEU CG 1 65 LEU CD1 165.00 -165.00 167.76 171.57 171.36 13.92 11 3 "[ . *1+ . 2 -.]"
23 CHI21 1 69 ILE CA 1 69 ILE CB 1 69 ILE CG1 1 69 ILE CD1 155.00 -175.00 173.71 155.92 -178.52 . . 0 "[ . 1 . 2 .]"
24 CHI2 1 76 LEU CA 1 76 LEU CB 1 76 LEU CG 1 76 LEU CD1 45.00 75.00 69.44 70.96 67.62 1.26 25 0 "[ . 1 . 2 .]"
25 CHI1 1 78 VAL N 1 78 VAL CA 1 78 VAL CB 1 78 VAL CG1 165.00 -165.00 -171.40 175.11 -164.46 0.54 20 0 "[ . 1 . 2 .]"
26 CHI1 1 79 ILE N 1 79 ILE CA 1 79 ILE CB 1 79 ILE CG1 -75.00 -45.00 -48.09 -46.13 -47.63 0.98 11 0 "[ . 1 . 2 .]"
27 CHI21 1 79 ILE CA 1 79 ILE CB 1 79 ILE CG1 1 79 ILE CD1 155.00 -175.00 168.88 173.37 172.07 0.66 5 0 "[ . 1 . 2 .]"
28 CHI1 1 80 ILE N 1 80 ILE CA 1 80 ILE CB 1 80 ILE CG1 -75.00 -45.00 -65.43 -76.35 -49.09 1.35 17 0 "[ . 1 . 2 .]"
29 CHI21 1 80 ILE CA 1 80 ILE CB 1 80 ILE CG1 1 80 ILE CD1 -75.00 -45.00 -78.93 -79.44 -79.57 7.52 12 5 "[ . **+ - 2 *]"
30 CHI1 1 82 THR N 1 82 THR CA 1 82 THR CB 1 82 THR OG1 165.00 -165.00 165.87 156.09 -170.84 8.91 13 11 "[ * -* * 1 +*. **2* **.]"
31 CHI1 1 91 VAL N 1 91 VAL CA 1 91 VAL CB 1 91 VAL CG1 165.00 -165.00 166.45 163.31 173.86 1.69 7 0 "[ . 1 . 2 .]"
32 CHI1 1 94 TYR N 1 94 TYR CA 1 94 TYR CB 1 94 TYR CG 165.00 -165.00 -153.33 -156.96 -151.01 13.99 6 25 [*****+******************-]
33 CHI1 1 101 TYR N 1 101 TYR CA 1 101 TYR CB 1 101 TYR CG 45.00 75.00 45.26 47.05 46.74 2.04 17 0 "[ . 1 . 2 .]"
34 CHI2 1 102 LEU CA 1 102 LEU CB 1 102 LEU CG 1 102 LEU CD1 45.00 75.00 75.00 70.05 78.16 3.16 4 0 "[ . 1 . 2 .]"
35 CHI21 1 108 ILE CA 1 108 ILE CB 1 108 ILE CG1 1 108 ILE CD1 155.00 -175.00 152.04 152.31 152.25 3.49 5 0 "[ . 1 . 2 .]"
36 CHI1 1 112 VAL N 1 112 VAL CA 1 112 VAL CB 1 112 VAL CG1 165.00 -165.00 164.88 163.90 168.32 1.10 25 0 "[ . 1 . 2 .]"
37 CHI2 1 114 LEU CA 1 114 LEU CB 1 114 LEU CG 1 114 LEU CD1 45.00 75.00 76.48 76.15 76.07 3.22 17 0 "[ . 1 . 2 .]"
38 CHI21 1 119 ILE CA 1 119 ILE CB 1 119 ILE CG1 1 119 ILE CD1 155.00 -175.00 164.49 159.24 157.59 0.27 25 0 "[ . 1 . 2 .]"
39 CHI1 1 121 HIS N 1 121 HIS CA 1 121 HIS CB 1 121 HIS CG 165.00 -165.00 -166.58 -169.52 -164.87 0.13 1 0 "[ . 1 . 2 .]"
40 PHI 1 4 GLY C 1 5 ILE N 1 5 ILE CA 1 5 ILE C -130.00 -82.00 -81.22 -81.05 -81.19 2.45 5 0 "[ . 1 . 2 .]"
41 PSI 1 5 ILE N 1 5 ILE CA 1 5 ILE C 1 6 VAL N 106.00 146.00 136.78 104.86 142.38 1.14 11 0 "[ . 1 . 2 .]"
42 PHI 1 5 ILE C 1 6 VAL N 1 6 VAL CA 1 6 VAL C -135.00 -95.00 -121.49 -120.73 -121.56 . . 0 "[ . 1 . 2 .]"
43 PSI 1 6 VAL N 1 6 VAL CA 1 6 VAL C 1 7 TRP N 106.00 162.00 125.19 115.27 135.44 . . 0 "[ . 1 . 2 .]"
44 PHI 1 6 VAL C 1 7 TRP N 1 7 TRP CA 1 7 TRP C -140.00 -100.00 -106.23 -105.13 -107.68 0.36 24 0 "[ . 1 . 2 .]"
45 PSI 1 7 TRP N 1 7 TRP CA 1 7 TRP C 1 8 VAL N 108.00 164.00 149.52 120.87 164.93 0.93 14 0 "[ . 1 . 2 .]"
46 PHI 1 7 TRP C 1 8 VAL N 1 8 VAL CA 1 8 VAL C -147.00 -107.00 -127.21 -145.04 -105.26 1.74 11 0 "[ . 1 . 2 .]"
47 PSI 1 8 VAL N 1 8 VAL CA 1 8 VAL C 1 9 VAL N 107.00 147.00 145.33 136.57 148.64 1.64 16 0 "[ . 1 . 2 .]"
48 PHI 1 12 ASP C 1 13 SER N 1 13 SER CA 1 13 SER C -75.00 -35.00 -76.06 -78.02 -74.97 3.02 22 0 "[ . 1 . 2 .]"
49 PSI 1 13 SER N 1 13 SER CA 1 13 SER C 1 14 SER N -56.00 -16.00 -51.85 -53.42 -54.50 0.67 22 0 "[ . 1 . 2 .]"
50 PHI 1 13 SER C 1 14 SER N 1 14 SER CA 1 14 SER C -85.00 -45.00 -64.32 -73.48 -57.01 . . 0 "[ . 1 . 2 .]"
51 PSI 1 14 SER N 1 14 SER CA 1 14 SER C 1 15 ILE N -61.00 -21.00 -31.18 -47.28 -19.07 1.93 16 0 "[ . 1 . 2 .]"
52 PHI 1 14 SER C 1 15 ILE N 1 15 ILE CA 1 15 ILE C -87.00 -47.00 -66.45 -51.28 -73.27 0.17 8 0 "[ . 1 . 2 .]"
53 PSI 1 15 ILE N 1 15 ILE CA 1 15 ILE C 1 16 ARG N -59.00 -19.00 -42.55 -57.39 -36.17 . . 0 "[ . 1 . 2 .]"
54 PHI 1 15 ILE C 1 16 ARG N 1 16 ARG CA 1 16 ARG C -79.00 -39.00 -79.75 -82.09 -82.30 3.70 1 0 "[ . 1 . 2 .]"
55 PSI 1 16 ARG N 1 16 ARG CA 1 16 ARG C 1 17 TRP N -65.00 -25.00 -29.02 -25.94 -30.27 1.83 13 0 "[ . 1 . 2 .]"
56 PHI 1 16 ARG C 1 17 TRP N 1 17 TRP CA 1 17 TRP C -81.00 -41.00 -63.24 -74.94 -50.16 . . 0 "[ . 1 . 2 .]"
57 PSI 1 17 TRP N 1 17 TRP CA 1 17 TRP C 1 18 VAL N -64.00 -24.00 -58.45 -50.94 -52.67 4.41 8 0 "[ . 1 . 2 .]"
58 PHI 1 17 TRP C 1 18 VAL N 1 18 VAL CA 1 18 VAL C -87.00 -47.00 -48.94 -48.15 -48.42 1.31 20 0 "[ . 1 . 2 .]"
59 PSI 1 18 VAL N 1 18 VAL CA 1 18 VAL C 1 19 LEU N -57.00 -17.00 -41.78 -43.88 -46.07 . . 0 "[ . 1 . 2 .]"
60 PHI 1 18 VAL C 1 19 LEU N 1 19 LEU CA 1 19 LEU C -84.00 -44.00 -72.57 -85.70 -56.88 1.70 5 0 "[ . 1 . 2 .]"
61 PSI 1 19 LEU N 1 19 LEU CA 1 19 LEU C 1 20 GLU N -58.00 -18.00 -26.77 -39.07 -17.73 0.27 25 0 "[ . 1 . 2 .]"
62 PHI 1 19 LEU C 1 20 GLU N 1 20 GLU CA 1 20 GLU C -81.00 -41.00 -75.37 -74.93 -80.29 1.51 4 0 "[ . 1 . 2 .]"
63 PSI 1 20 GLU N 1 20 GLU CA 1 20 GLU C 1 21 ARG N -64.00 -24.00 -51.21 -60.12 -62.23 0.28 1 0 "[ . 1 . 2 .]"
64 PHI 1 20 GLU C 1 21 ARG N 1 21 ARG CA 1 21 ARG C -85.00 -45.00 -60.42 -80.97 -50.08 . . 0 "[ . 1 . 2 .]"
65 PSI 1 21 ARG N 1 21 ARG CA 1 21 ARG C 1 22 ALA N -62.00 -22.00 -28.99 -28.26 -30.06 0.50 22 0 "[ . 1 . 2 .]"
66 PHI 1 21 ARG C 1 22 ALA N 1 22 ALA CA 1 22 ALA C -89.00 -49.00 -57.28 -72.43 -48.96 0.04 7 0 "[ . 1 . 2 .]"
67 PSI 1 22 ALA N 1 22 ALA CA 1 22 ALA C 1 23 LEU N -60.00 -20.00 -50.81 -60.93 -36.30 0.93 9 0 "[ . 1 . 2 .]"
68 PHI 1 22 ALA C 1 23 LEU N 1 23 LEU CA 1 23 LEU C -84.00 -44.00 -80.78 -74.47 -79.16 0.99 4 0 "[ . 1 . 2 .]"
69 PSI 1 23 LEU N 1 23 LEU CA 1 23 LEU C 1 24 ALA N -59.00 -19.00 -33.33 -45.56 -18.55 0.45 15 0 "[ . 1 . 2 .]"
70 PHI 1 23 LEU C 1 24 ALA N 1 24 ALA CA 1 24 ALA C -84.00 -44.00 -50.76 -54.71 -48.87 . . 0 "[ . 1 . 2 .]"
71 PSI 1 24 ALA N 1 24 ALA CA 1 24 ALA C 1 25 GLY N -57.00 -17.00 -40.22 -33.05 -33.41 . . 0 "[ . 1 . 2 .]"
72 PHI 1 24 ALA C 1 25 GLY N 1 25 GLY CA 1 25 GLY C -86.00 -46.00 -86.32 -86.19 -86.22 0.89 8 0 "[ . 1 . 2 .]"
73 PSI 1 25 GLY N 1 25 GLY CA 1 25 GLY C 1 26 ALA N -45.00 -1.00 -12.99 -22.59 -23.09 0.26 10 0 "[ . 1 . 2 .]"
74 PHI 1 30 CYS C 1 31 THR N 1 31 THR CA 1 31 THR C -126.00 -86.00 -121.80 -126.25 -126.31 0.65 20 0 "[ . 1 . 2 .]"
75 PSI 1 31 THR N 1 31 THR CA 1 31 THR C 1 32 THR N 114.00 154.00 113.28 110.98 125.10 3.02 22 0 "[ . 1 . 2 .]"
76 PHI 1 31 THR C 1 32 THR N 1 32 THR CA 1 32 THR C -160.00 -104.00 -103.47 -108.39 -101.50 2.50 8 0 "[ . 1 . 2 .]"
77 PSI 1 32 THR N 1 32 THR CA 1 32 THR C 1 33 PHE N 129.00 -179.00 130.04 127.13 142.70 1.87 12 0 "[ . 1 . 2 .]"
78 PHI 1 36 GLY C 1 37 ASN N 1 37 ASN CA 1 37 ASN C -81.00 -41.00 -61.29 -59.85 -61.12 . . 0 "[ . 1 . 2 .]"
79 PSI 1 37 ASN N 1 37 ASN CA 1 37 ASN C 1 38 GLU N -60.00 -20.00 -23.42 -20.87 -21.37 0.52 19 0 "[ . 1 . 2 .]"
80 PHI 1 37 ASN C 1 38 GLU N 1 38 GLU CA 1 38 GLU C -90.00 -50.00 -84.84 -89.13 -89.34 0.90 12 0 "[ . 1 . 2 .]"
81 PSI 1 38 GLU N 1 38 GLU CA 1 38 GLU C 1 39 VAL N -56.00 -16.00 -15.94 -15.62 -15.86 2.16 19 0 "[ . 1 . 2 .]"
82 PHI 1 38 GLU C 1 39 VAL N 1 39 VAL CA 1 39 VAL C -87.00 -47.00 -88.59 -88.94 -89.15 2.92 4 0 "[ . 1 . 2 .]"
83 PSI 1 39 VAL N 1 39 VAL CA 1 39 VAL C 1 40 LEU N -62.00 -22.00 -40.12 -47.99 -34.60 . . 0 "[ . 1 . 2 .]"
84 PHI 1 39 VAL C 1 40 LEU N 1 40 LEU CA 1 40 LEU C -80.00 -40.00 -50.76 -53.75 -49.59 . . 0 "[ . 1 . 2 .]"
85 PSI 1 40 LEU N 1 40 LEU CA 1 40 LEU C 1 41 ALA N -62.00 -22.00 -45.29 -43.34 -43.65 0.15 20 0 "[ . 1 . 2 .]"
86 PHI 1 40 LEU C 1 41 ALA N 1 41 ALA CA 1 41 ALA C -86.00 -46.00 -71.48 -77.08 -55.68 . . 0 "[ . 1 . 2 .]"
87 PSI 1 41 ALA N 1 41 ALA CA 1 41 ALA C 1 42 ALA N -58.00 -18.00 -28.24 -25.18 -26.02 . . 0 "[ . 1 . 2 .]"
88 PHI 1 41 ALA C 1 42 ALA N 1 42 ALA CA 1 42 ALA C -83.00 -43.00 -61.16 -67.13 -56.85 . . 0 "[ . 1 . 2 .]"
89 PSI 1 42 ALA N 1 42 ALA CA 1 42 ALA C 1 43 LEU N -60.00 -20.00 -35.91 -42.13 -31.58 . . 0 "[ . 1 . 2 .]"
90 PHI 1 42 ALA C 1 43 LEU N 1 43 LEU CA 1 43 LEU C -86.00 -46.00 -58.53 -69.17 -52.89 . . 0 "[ . 1 . 2 .]"
91 PSI 1 43 LEU N 1 43 LEU CA 1 43 LEU C 1 44 ALA N -55.00 -11.00 -36.97 -45.25 -28.69 . . 0 "[ . 1 . 2 .]"
92 PHI 1 43 LEU C 1 44 ALA N 1 44 ALA CA 1 44 ALA C -94.00 -54.00 -63.81 -80.82 -53.56 0.44 24 0 "[ . 1 . 2 .]"
93 PSI 1 44 ALA N 1 44 ALA CA 1 44 ALA C 1 45 SER N -52.00 -4.00 -13.59 -13.40 -15.01 2.22 21 0 "[ . 1 . 2 .]"
94 PHI 1 62 GLY C 1 63 LEU N 1 63 LEU CA 1 63 LEU C -81.00 -41.00 -78.36 -84.66 -43.71 3.66 14 0 "[ . 1 . 2 .]"
95 PSI 1 63 LEU N 1 63 LEU CA 1 63 LEU C 1 64 ALA N -59.00 -19.00 -16.51 -15.16 -15.37 6.02 12 2 "[ . 1 + . 2- .]"
96 PHI 1 63 LEU C 1 64 ALA N 1 64 ALA CA 1 64 ALA C -85.00 -45.00 -46.25 -53.21 -43.24 1.76 9 0 "[ . 1 . 2 .]"
97 PSI 1 64 ALA N 1 64 ALA CA 1 64 ALA C 1 65 LEU N -59.00 -19.00 -52.87 -52.83 -54.54 2.78 18 0 "[ . 1 . 2 .]"
98 PHI 1 64 ALA C 1 65 LEU N 1 65 LEU CA 1 65 LEU C -84.00 -44.00 -82.83 -89.80 -71.15 5.80 24 1 "[ . 1 . 2 +.]"
99 PSI 1 65 LEU N 1 65 LEU CA 1 65 LEU C 1 66 LEU N -65.00 -25.00 -27.23 -24.05 -24.29 1.92 15 0 "[ . 1 . 2 .]"
100 PHI 1 65 LEU C 1 66 LEU N 1 66 LEU CA 1 66 LEU C -85.00 -45.00 -63.73 -71.05 -49.27 . . 0 "[ . 1 . 2 .]"
101 PSI 1 66 LEU N 1 66 LEU CA 1 66 LEU C 1 67 LYS N -63.00 -23.00 -30.99 -52.35 -22.54 0.46 10 0 "[ . 1 . 2 .]"
102 PHI 1 66 LEU C 1 67 LYS N 1 67 LYS CA 1 67 LYS C -82.00 -42.00 -62.29 -67.52 -68.45 . . 0 "[ . 1 . 2 .]"
103 PSI 1 67 LYS N 1 67 LYS CA 1 67 LYS C 1 68 GLN N -61.00 -21.00 -28.68 -34.99 -20.85 0.15 4 0 "[ . 1 . 2 .]"
104 PHI 1 67 LYS C 1 68 GLN N 1 68 GLN CA 1 68 GLN C -86.00 -46.00 -85.66 -87.18 -73.63 1.18 20 0 "[ . 1 . 2 .]"
105 PSI 1 68 GLN N 1 68 GLN CA 1 68 GLN C 1 69 ILE N -63.00 -23.00 -25.48 -40.63 -22.38 0.62 12 0 "[ . 1 . 2 .]"
106 PHI 1 68 GLN C 1 69 ILE N 1 69 ILE CA 1 69 ILE C -84.00 -44.00 -60.86 -71.53 -50.80 . . 0 "[ . 1 . 2 .]"
107 PSI 1 69 ILE N 1 69 ILE CA 1 69 ILE C 1 70 LYS N -63.00 -23.00 -27.60 -33.70 -22.16 0.84 11 0 "[ . 1 . 2 .]"
108 PHI 1 69 ILE C 1 70 LYS N 1 70 LYS CA 1 70 LYS C -82.00 -42.00 -78.47 -82.35 -68.90 0.35 9 0 "[ . 1 . 2 .]"
109 PSI 1 70 LYS N 1 70 LYS CA 1 70 LYS C 1 71 GLN N -59.00 -19.00 -32.16 -26.06 -26.07 . . 0 "[ . 1 . 2 .]"
110 PHI 1 70 LYS C 1 71 GLN N 1 71 GLN CA 1 71 GLN C -90.00 -46.00 -83.97 -89.57 -89.96 0.29 11 0 "[ . 1 . 2 .]"
111 PSI 1 71 GLN N 1 71 GLN CA 1 71 GLN C 1 72 ARG N -58.00 -18.00 -37.24 -28.85 -33.27 . . 0 "[ . 1 . 2 .]"
112 PSI 1 74 PRO N 1 74 PRO CA 1 74 PRO C 1 75 MET N -43.00 -3.00 -34.51 -43.30 -7.69 0.30 23 0 "[ . 1 . 2 .]"
113 PHI 1 74 PRO C 1 75 MET N 1 75 MET CA 1 75 MET C -111.00 -67.00 -82.99 -79.62 -81.96 . . 0 "[ . 1 . 2 .]"
114 PSI 1 75 MET N 1 75 MET CA 1 75 MET C 1 76 LEU N -21.00 19.00 -4.27 -16.83 2.71 . . 0 "[ . 1 . 2 .]"
115 PHI 1 75 MET C 1 76 LEU N 1 76 LEU CA 1 76 LEU C -95.00 -51.00 -92.44 -95.08 -95.13 0.59 21 0 "[ . 1 . 2 .]"
116 PSI 1 76 LEU N 1 76 LEU CA 1 76 LEU C 1 77 PRO N 111.00 151.00 113.65 114.96 113.11 2.22 12 0 "[ . 1 . 2 .]"
117 PSI 1 77 PRO N 1 77 PRO CA 1 77 PRO C 1 78 VAL N 121.00 165.00 132.13 134.85 120.92 1.49 4 0 "[ . 1 . 2 .]"
118 PHI 1 78 VAL C 1 79 ILE N 1 79 ILE CA 1 79 ILE C -138.00 -98.00 -129.92 -136.78 -120.95 . . 0 "[ . 1 . 2 .]"
119 PSI 1 79 ILE N 1 79 ILE CA 1 79 ILE C 1 80 ILE N 104.00 148.00 136.29 117.10 147.89 . . 0 "[ . 1 . 2 .]"
120 PHI 1 79 ILE C 1 80 ILE N 1 80 ILE CA 1 80 ILE C -137.00 -85.00 -100.93 -89.92 -94.29 . . 0 "[ . 1 . 2 .]"
121 PSI 1 80 ILE N 1 80 ILE CA 1 80 ILE C 1 81 MET N 100.00 140.00 135.80 98.17 141.93 1.93 13 0 "[ . 1 . 2 .]"
122 PHI 1 80 ILE C 1 81 MET N 1 81 MET CA 1 81 MET C -144.00 -84.00 -121.84 -126.74 -127.75 . . 0 "[ . 1 . 2 .]"
123 PSI 1 81 MET N 1 81 MET CA 1 81 MET C 1 82 THR N 123.00 167.00 123.70 116.44 131.05 6.56 12 1 "[ . 1 + . 2 .]"
124 PHI 1 86 ASP C 1 87 LEU N 1 87 LEU CA 1 87 LEU C -78.00 -38.00 -59.25 -51.94 -56.62 . . 0 "[ . 1 . 2 .]"
125 PSI 1 87 LEU N 1 87 LEU CA 1 87 LEU C 1 88 ASP N -68.00 -24.00 -43.12 -44.56 -45.76 . . 0 "[ . 1 . 2 .]"
126 PHI 1 87 LEU C 1 88 ASP N 1 88 ASP CA 1 88 ASP C -86.00 -46.00 -47.57 -45.39 -45.65 1.35 2 0 "[ . 1 . 2 .]"
127 PSI 1 88 ASP N 1 88 ASP CA 1 88 ASP C 1 89 ALA N -58.00 -18.00 -35.95 -46.98 -23.14 . . 0 "[ . 1 . 2 .]"
128 PHI 1 88 ASP C 1 89 ALA N 1 89 ALA CA 1 89 ALA C -86.00 -46.00 -87.07 -88.38 -81.25 2.38 22 0 "[ . 1 . 2 .]"
129 PSI 1 89 ALA N 1 89 ALA CA 1 89 ALA C 1 90 ALA N -58.00 -18.00 -43.03 -48.21 -49.08 1.22 12 0 "[ . 1 . 2 .]"
130 PHI 1 89 ALA C 1 90 ALA N 1 90 ALA CA 1 90 ALA C -85.00 -45.00 -62.45 -50.66 -54.01 0.40 16 0 "[ . 1 . 2 .]"
131 PSI 1 90 ALA N 1 90 ALA CA 1 90 ALA C 1 91 VAL N -61.00 -21.00 -25.70 -36.41 -18.04 2.96 15 0 "[ . 1 . 2 .]"
132 PHI 1 90 ALA C 1 91 VAL N 1 91 VAL CA 1 91 VAL C -83.00 -43.00 -52.17 -49.66 -49.70 0.25 25 0 "[ . 1 . 2 .]"
133 PSI 1 91 VAL N 1 91 VAL CA 1 91 VAL C 1 92 SER N -62.00 -22.00 -57.53 -57.07 -57.88 2.21 25 0 "[ . 1 . 2 .]"
134 PHI 1 91 VAL C 1 92 SER N 1 92 SER CA 1 92 SER C -84.00 -44.00 -87.29 -86.95 -87.02 6.08 15 3 "[ . 1 -+ 2 * .]"
135 PSI 1 92 SER N 1 92 SER CA 1 92 SER C 1 93 ALA N -58.00 -18.00 -38.37 -49.94 -16.66 1.34 13 0 "[ . 1 . 2 .]"
136 PHI 1 92 SER C 1 93 ALA N 1 93 ALA CA 1 93 ALA C -81.00 -41.00 -65.22 -59.99 -60.59 7.36 23 4 "[ . 1 **- 2 + .]"
137 PSI 1 93 ALA N 1 93 ALA CA 1 93 ALA C 1 94 TYR N -61.00 -21.00 -61.97 -63.26 -63.29 3.11 12 0 "[ . 1 . 2 .]"
138 PHI 1 93 ALA C 1 94 TYR N 1 94 TYR CA 1 94 TYR C -84.00 -44.00 -57.40 -55.66 -55.68 3.08 25 0 "[ . 1 . 2 .]"
139 PSI 1 94 TYR N 1 94 TYR CA 1 94 TYR C 1 95 GLN N -63.00 -23.00 -22.67 -37.34 -17.68 5.32 9 2 "[ - +1 . 2 .]"
140 PHI 1 94 TYR C 1 95 GLN N 1 95 GLN CA 1 95 GLN C -89.00 -45.00 -68.97 -71.17 -62.09 . . 0 "[ . 1 . 2 .]"
141 PSI 1 95 GLN N 1 95 GLN CA 1 95 GLN C 1 96 GLN N -57.00 -9.00 1.81 -2.35 3.25 12.25 11 25 [**********+*************-]
142 PHI 1 95 GLN C 1 96 GLN N 1 96 GLN CA 1 96 GLN C -109.00 -69.00 -73.73 -76.46 -70.44 . . 0 "[ . 1 . 2 .]"
143 PSI 1 96 GLN N 1 96 GLN CA 1 96 GLN C 1 97 GLY N -29.00 27.00 26.00 27.61 27.38 6.55 25 1 "[ . 1 . 2 +]"
144 PHI 1 96 GLN C 1 97 GLY N 1 97 GLY CA 1 97 GLY C 67.00 107.00 109.07 108.10 107.82 5.68 25 1 "[ . 1 . 2 +]"
145 PSI 1 97 GLY N 1 97 GLY CA 1 97 GLY C 1 98 ALA N -11.00 29.00 33.46 32.11 34.60 5.60 23 5 "[ . 1 *** - 2 + .]"
146 PHI 1 106 PHE C 1 107 ASP N 1 107 ASP CA 1 107 ASP C -104.00 -56.00 -91.21 -87.41 -90.23 . . 0 "[ . 1 . 2 .]"
147 PSI 1 107 ASP N 1 107 ASP CA 1 107 ASP C 1 108 ILE N 92.00 148.00 113.15 109.10 115.12 . . 0 "[ . 1 . 2 .]"
148 PHI 1 107 ASP C 1 108 ILE N 1 108 ILE CA 1 108 ILE C -78.00 -38.00 -46.59 -47.44 -47.86 . . 0 "[ . 1 . 2 .]"
149 PSI 1 108 ILE N 1 108 ILE CA 1 108 ILE C 1 109 ASP N -59.00 -3.00 -34.00 -43.55 -30.41 . . 0 "[ . 1 . 2 .]"
150 PHI 1 108 ILE C 1 109 ASP N 1 109 ASP CA 1 109 ASP C -80.00 -40.00 -58.52 -51.56 -53.75 . . 0 "[ . 1 . 2 .]"
151 PSI 1 109 ASP N 1 109 ASP CA 1 109 ASP C 1 110 GLU N -61.00 -21.00 -42.98 -40.06 -40.70 . . 0 "[ . 1 . 2 .]"
152 PHI 1 109 ASP C 1 110 GLU N 1 110 GLU CA 1 110 GLU C -87.00 -47.00 -80.42 -80.77 -81.07 . . 0 "[ . 1 . 2 .]"
153 PSI 1 110 GLU N 1 110 GLU CA 1 110 GLU C 1 111 ALA N -62.00 -22.00 -30.24 -30.24 -30.46 . . 0 "[ . 1 . 2 .]"
154 PHI 1 110 GLU C 1 111 ALA N 1 111 ALA CA 1 111 ALA C -86.00 -46.00 -67.33 -67.42 -67.47 . . 0 "[ . 1 . 2 .]"
155 PSI 1 111 ALA N 1 111 ALA CA 1 111 ALA C 1 112 VAL N -60.00 -20.00 -54.82 -57.41 -49.05 . . 0 "[ . 1 . 2 .]"
156 PHI 1 111 ALA C 1 112 VAL N 1 112 VAL CA 1 112 VAL C -84.00 -44.00 -51.24 -52.33 -53.16 . . 0 "[ . 1 . 2 .]"
157 PSI 1 112 VAL N 1 112 VAL CA 1 112 VAL C 1 113 ALA N -61.00 -21.00 -34.21 -38.28 -27.59 . . 0 "[ . 1 . 2 .]"
158 PHI 1 112 VAL C 1 113 ALA N 1 113 ALA CA 1 113 ALA C -84.00 -44.00 -84.03 -85.03 -82.19 1.03 19 0 "[ . 1 . 2 .]"
159 PSI 1 113 ALA N 1 113 ALA CA 1 113 ALA C 1 114 LEU N -59.00 -19.00 -28.81 -25.90 -27.13 . . 0 "[ . 1 . 2 .]"
160 PHI 1 113 ALA C 1 114 LEU N 1 114 LEU CA 1 114 LEU C -84.00 -44.00 -63.72 -67.11 -67.93 . . 0 "[ . 1 . 2 .]"
161 PSI 1 114 LEU N 1 114 LEU CA 1 114 LEU C 1 115 VAL N -64.00 -24.00 -40.33 -48.40 -30.16 . . 0 "[ . 1 . 2 .]"
162 PHI 1 114 LEU C 1 115 VAL N 1 115 VAL CA 1 115 VAL C -83.00 -43.00 -70.49 -65.59 -66.95 1.58 4 0 "[ . 1 . 2 .]"
163 PSI 1 115 VAL N 1 115 VAL CA 1 115 VAL C 1 116 GLU N -62.00 -22.00 -37.10 -40.09 -31.53 . . 0 "[ . 1 . 2 .]"
164 PHI 1 115 VAL C 1 116 GLU N 1 116 GLU CA 1 116 GLU C -81.00 -41.00 -59.28 -60.96 -62.47 . . 0 "[ . 1 . 2 .]"
165 PSI 1 116 GLU N 1 116 GLU CA 1 116 GLU C 1 117 ARG N -60.00 -20.00 -29.09 -48.73 -19.85 0.15 19 0 "[ . 1 . 2 .]"
166 PHI 1 116 GLU C 1 117 ARG N 1 117 ARG CA 1 117 ARG C -86.00 -46.00 -68.60 -73.30 -60.33 . . 0 "[ . 1 . 2 .]"
167 PSI 1 117 ARG N 1 117 ARG CA 1 117 ARG C 1 118 ALA N -59.00 -19.00 -33.22 -26.56 -28.32 0.43 4 0 "[ . 1 . 2 .]"
168 PHI 1 117 ARG C 1 118 ALA N 1 118 ALA CA 1 118 ALA C -84.00 -44.00 -78.02 -81.20 -83.70 0.69 8 0 "[ . 1 . 2 .]"
169 PSI 1 118 ALA N 1 118 ALA CA 1 118 ALA C 1 119 ILE N -61.00 -21.00 -36.35 -46.72 -27.79 . . 0 "[ . 1 . 2 .]"
170 PHI 1 118 ALA C 1 119 ILE N 1 119 ILE CA 1 119 ILE C -84.00 -44.00 -78.00 -83.77 -84.00 0.19 11 0 "[ . 1 . 2 .]"
171 PSI 1 119 ILE N 1 119 ILE CA 1 119 ILE C 1 120 SER N -56.00 -16.00 -46.80 -55.93 -20.63 . . 0 "[ . 1 . 2 .]"
172 PHI 1 120 SER C 1 121 HIS N 1 121 HIS CA 1 121 HIS C -87.00 -47.00 -56.80 -55.84 -56.33 0.21 11 0 "[ . 1 . 2 .]"
173 PSI 1 121 HIS N 1 121 HIS CA 1 121 HIS C 1 122 TYR N -52.00 -12.00 -27.40 -41.66 -17.46 . . 0 "[ . 1 . 2 .]"
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