NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
486301 |
2rnn   |
11029 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2rnn
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 168
_TA_constraint_stats_list.Viol_count 790
_TA_constraint_stats_list.Viol_total 743149.00
_TA_constraint_stats_list.Viol_max 169.97
_TA_constraint_stats_list.Viol_rms 30.18
_TA_constraint_stats_list.Viol_average_all_restraints 11.06
_TA_constraint_stats_list.Viol_average_violations_only 47.03
_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 14 GLU C 1 15 THR N 1 15 THR CA 1 15 THR C -152.40 -48.20 -140.40 -169.98 51.17 99.37 1 5 "[+ . *1 *-* 2]"
2 PSI 1 15 THR N 1 15 THR CA 1 15 THR C 1 16 PRO N 94.80 175.20 36.67 33.53 29.26 65.81 1 20 [+*****************-*]
3 PHI 1 20 ARG C 1 21 GLU N 1 21 GLU CA 1 21 GLU C -91.70 -58.40 -143.25 -178.67 63.73 122.13 15 19 "[*******- *****+*****]"
4 PSI 1 21 GLU N 1 21 GLU CA 1 21 GLU C 1 22 PRO N 123.60 170.70 -44.64 -75.07 44.26 154.16 11 20 [**********+-********]
5 PHI 1 22 PRO C 1 23 THR N 1 23 THR CA 1 23 THR C -160.70 -51.50 -69.77 -69.81 -69.70 . . 0 "[ . 1 . 2]"
6 PSI 1 23 THR N 1 23 THR CA 1 23 THR C 1 24 ASN N 138.70 178.40 162.22 126.94 -170.71 11.76 15 12 "[ **.* -**** *+ ** 2]"
7 PHI 1 23 THR C 1 24 ASN N 1 24 ASN CA 1 24 ASN C -90.80 -37.00 -131.44 -160.72 -108.82 69.92 11 20 [**********+*******-*]
8 PSI 1 24 ASN N 1 24 ASN CA 1 24 ASN C 1 25 GLU N -77.80 20.30 139.05 138.07 150.31 130.01 15 20 [**************+*-***]
9 PHI 1 24 ASN C 1 25 GLU N 1 25 GLU CA 1 25 GLU C -77.70 -50.40 -50.81 -52.23 -49.71 0.69 8 0 "[ . 1 . 2]"
10 PSI 1 25 GLU N 1 25 GLU CA 1 25 GLU C 1 26 LEU N -49.20 -27.80 -43.74 -44.58 -39.46 . . 0 "[ . 1 . 2]"
11 PHI 1 25 GLU C 1 26 LEU N 1 26 LEU CA 1 26 LEU C -81.90 -51.80 -67.51 -69.72 -50.11 1.69 10 0 "[ . 1 . 2]"
12 PSI 1 26 LEU N 1 26 LEU CA 1 26 LEU C 1 27 ARG N -52.50 -28.40 -33.61 -32.45 -33.21 . . 0 "[ . 1 . 2]"
13 PHI 1 26 LEU C 1 27 ARG N 1 27 ARG CA 1 27 ARG C -74.00 -48.60 -63.48 -63.89 -64.05 . . 0 "[ . 1 . 2]"
14 PSI 1 27 ARG N 1 27 ARG CA 1 27 ARG C 1 28 ASN N -50.70 -24.70 -53.40 -55.96 -32.98 5.26 4 1 "[ +. 1 . 2]"
15 PHI 1 27 ARG C 1 28 ASN N 1 28 ASN CA 1 28 ASN C -75.40 -51.00 -69.53 -71.78 -63.97 . . 0 "[ . 1 . 2]"
16 PSI 1 28 ASN N 1 28 ASN CA 1 28 ASN C 1 29 GLU N -56.50 -27.80 -33.05 -51.95 -29.96 . . 0 "[ . 1 . 2]"
17 PHI 1 28 ASN C 1 29 GLU N 1 29 GLU CA 1 29 GLU C -80.00 -52.70 -69.42 -70.57 -70.93 . . 0 "[ . 1 . 2]"
18 PSI 1 29 GLU N 1 29 GLU CA 1 29 GLU C 1 30 VAL N -50.20 -29.90 -46.89 -46.60 -47.75 2.32 10 0 "[ . 1 . 2]"
19 PHI 1 29 GLU C 1 30 VAL N 1 30 VAL CA 1 30 VAL C -75.10 -55.10 -66.70 -72.45 -63.37 . . 0 "[ . 1 . 2]"
20 PSI 1 30 VAL N 1 30 VAL CA 1 30 VAL C 1 31 GLU N -55.30 -35.30 -41.01 -44.87 -33.55 1.75 4 0 "[ . 1 . 2]"
21 PHI 1 30 VAL C 1 31 GLU N 1 31 GLU CA 1 31 GLU C -74.90 -50.00 -66.54 -65.89 -66.91 . . 0 "[ . 1 . 2]"
22 PSI 1 31 GLU N 1 31 GLU CA 1 31 GLU C 1 32 GLU N -49.40 -26.20 -43.11 -55.75 -34.97 6.35 4 1 "[ +. 1 . 2]"
23 PHI 1 31 GLU C 1 32 GLU N 1 32 GLU CA 1 32 GLU C -79.60 -56.70 -62.66 -62.20 -62.22 2.03 7 0 "[ . 1 . 2]"
24 PSI 1 32 GLU N 1 32 GLU CA 1 32 GLU C 1 33 THR N -48.50 -28.50 -49.08 -50.16 -41.79 1.66 15 0 "[ . 1 . 2]"
25 PHI 1 32 GLU C 1 33 THR N 1 33 THR CA 1 33 THR C -84.30 -49.20 -63.67 -60.81 -61.67 . . 0 "[ . 1 . 2]"
26 PSI 1 33 THR N 1 33 THR CA 1 33 THR C 1 34 ILE N -53.60 -25.30 -45.52 -49.28 -37.14 . . 0 "[ . 1 . 2]"
27 PHI 1 33 THR C 1 34 ILE N 1 34 ILE CA 1 34 ILE C -73.30 -53.30 -60.68 -68.11 -54.39 . . 0 "[ . 1 . 2]"
28 PSI 1 34 ILE N 1 34 ILE CA 1 34 ILE C 1 35 THR N -58.80 -28.60 -43.42 -43.59 -43.89 . . 0 "[ . 1 . 2]"
29 PHI 1 34 ILE C 1 35 THR N 1 35 THR CA 1 35 THR C -74.70 -50.50 -66.76 -73.41 -61.99 . . 0 "[ . 1 . 2]"
30 PSI 1 35 THR N 1 35 THR CA 1 35 THR C 1 36 LEU N -56.00 -31.40 -37.72 -33.66 -35.39 . . 0 "[ . 1 . 2]"
31 PHI 1 35 THR C 1 36 LEU N 1 36 LEU CA 1 36 LEU C -80.10 -49.40 -66.68 -71.01 -60.36 . . 0 "[ . 1 . 2]"
32 PSI 1 36 LEU N 1 36 LEU CA 1 36 LEU C 1 37 MET N -48.80 -26.90 -42.06 -40.70 -42.70 . . 0 "[ . 1 . 2]"
33 PHI 1 36 LEU C 1 37 MET N 1 37 MET CA 1 37 MET C -82.10 -56.50 -76.11 -81.52 -71.58 . . 0 "[ . 1 . 2]"
34 PSI 1 37 MET N 1 37 MET CA 1 37 MET C 1 38 GLU N -49.60 -19.50 -38.56 -38.00 -39.05 . . 0 "[ . 1 . 2]"
35 PHI 1 37 MET C 1 38 GLU N 1 38 GLU CA 1 38 GLU C -77.00 -48.50 -72.99 -78.88 -67.64 1.88 3 0 "[ . 1 . 2]"
36 PSI 1 38 GLU N 1 38 GLU CA 1 38 GLU C 1 39 LEU N -64.50 -15.30 -24.69 -39.90 -21.16 . . 0 "[ . 1 . 2]"
37 PHI 1 38 GLU C 1 39 LEU N 1 39 LEU CA 1 39 LEU C -116.50 -47.70 -54.94 -57.33 -50.40 . . 0 "[ . 1 . 2]"
38 PSI 1 39 LEU N 1 39 LEU CA 1 39 LEU C 1 40 LEU N -58.90 35.50 -24.41 -29.14 -21.02 . . 0 "[ . 1 . 2]"
39 PHI 1 41 LYS C 1 42 VAL N 1 42 VAL CA 1 42 VAL C -68.50 -45.90 -112.93 -133.74 -73.79 65.24 7 20 [******+-************]
40 PSI 1 42 VAL N 1 42 VAL CA 1 42 VAL C 1 43 SER N -56.40 -24.70 171.54 161.55 179.10 142.05 13 20 [****-*******+*******]
41 PHI 1 42 VAL C 1 43 SER N 1 43 SER CA 1 43 SER C -75.40 -55.40 -52.90 -61.08 -49.82 5.58 4 3 "[ +. * 1 - . 2]"
42 PSI 1 43 SER N 1 43 SER CA 1 43 SER C 1 44 GLU N -50.20 -25.00 -37.92 -42.11 -32.85 . . 0 "[ . 1 . 2]"
43 PHI 1 43 SER C 1 44 GLU N 1 44 GLU CA 1 44 GLU C -101.80 -45.60 -64.64 -69.23 -61.65 . . 0 "[ . 1 . 2]"
44 PSI 1 44 GLU N 1 44 GLU CA 1 44 GLU C 1 45 LEU N -64.30 -18.40 -48.18 -50.39 -50.49 . . 0 "[ . 1 . 2]"
45 PHI 1 44 GLU C 1 45 LEU N 1 45 LEU CA 1 45 LEU C -81.00 -47.50 -64.70 -62.09 -63.22 . . 0 "[ . 1 . 2]"
46 PSI 1 45 LEU N 1 45 LEU CA 1 45 LEU C 1 46 LYS N -53.50 -27.00 -49.22 -52.16 -54.15 2.76 13 0 "[ . 1 . 2]"
47 PHI 1 45 LEU C 1 46 LYS N 1 46 LYS CA 1 46 LYS C -72.90 -52.90 -55.09 -61.69 -50.57 2.33 1 0 "[ . 1 . 2]"
48 PSI 1 46 LYS N 1 46 LYS CA 1 46 LYS C 1 47 ASP N -52.50 -32.50 -49.48 -53.60 -40.56 1.10 4 0 "[ . 1 . 2]"
49 PHI 1 46 LYS C 1 47 ASP N 1 47 ASP CA 1 47 ASP C -74.30 -54.30 -61.28 -58.44 -60.35 . . 0 "[ . 1 . 2]"
50 PSI 1 47 ASP N 1 47 ASP CA 1 47 ASP C 1 48 ILE N -50.10 -30.10 -45.85 -50.58 -41.39 0.48 8 0 "[ . 1 . 2]"
51 PHI 1 47 ASP C 1 48 ILE N 1 48 ILE CA 1 48 ILE C -79.40 -58.40 -54.89 -54.14 -54.19 4.47 20 0 "[ . 1 . 2]"
52 PSI 1 48 ILE N 1 48 ILE CA 1 48 ILE C 1 49 CYS N -52.50 -32.50 -49.89 -48.40 -50.08 . . 0 "[ . 1 . 2]"
53 PHI 1 48 ILE C 1 49 CYS N 1 49 CYS CA 1 49 CYS C -71.50 -51.50 -63.16 -61.66 -62.17 2.35 8 0 "[ . 1 . 2]"
54 PSI 1 49 CYS N 1 49 CYS CA 1 49 CYS C 1 50 ARG N -54.80 -26.00 -52.01 -52.79 -52.90 . . 0 "[ . 1 . 2]"
55 PHI 1 49 CYS C 1 50 ARG N 1 50 ARG CA 1 50 ARG C -74.40 -50.20 -53.34 -56.33 -51.13 . . 0 "[ . 1 . 2]"
56 PSI 1 50 ARG N 1 50 ARG CA 1 50 ARG C 1 51 SER N -53.10 -33.10 -34.65 -30.89 -32.34 3.81 12 0 "[ . 1 . 2]"
57 PHI 1 50 ARG C 1 51 SER N 1 51 SER CA 1 51 SER C -84.30 -51.20 -74.06 -74.51 -74.62 . . 0 "[ . 1 . 2]"
58 PSI 1 51 SER N 1 51 SER CA 1 51 SER C 1 52 VAL N -50.40 -8.10 -49.44 -53.48 -32.92 3.08 4 0 "[ . 1 . 2]"
59 PHI 1 51 SER C 1 52 VAL N 1 52 VAL CA 1 52 VAL C -122.70 -68.10 -57.93 -69.24 -52.93 15.17 10 19 "[*******-*+******** *]"
60 PSI 1 52 VAL N 1 52 VAL CA 1 52 VAL C 1 53 SER N -9.10 24.40 -47.07 -50.70 -50.76 41.98 8 20 [***-***+************]
61 PHI 1 59 ARG C 1 60 LYS N 1 60 LYS CA 1 60 LYS C -72.80 -40.00 -149.42 -179.65 -137.98 106.85 5 20 [***-+***************]
62 PSI 1 60 LYS N 1 60 LYS CA 1 60 LYS C 1 61 ALA N -66.90 -19.20 167.23 146.72 -176.36 146.38 14 20 [************-+******]
63 PHI 1 60 LYS C 1 61 ALA N 1 61 ALA CA 1 61 ALA C -72.50 -52.50 -53.73 -52.52 -53.59 4.61 14 0 "[ . 1 . 2]"
64 PSI 1 61 ALA N 1 61 ALA CA 1 61 ALA C 1 62 VAL N -56.30 -17.20 -40.93 -55.63 -34.28 . . 0 "[ . 1 . 2]"
65 PHI 1 61 ALA C 1 62 VAL N 1 62 VAL CA 1 62 VAL C -76.80 -55.20 -63.81 -68.35 -54.41 0.79 5 0 "[ . 1 . 2]"
66 PSI 1 62 VAL N 1 62 VAL CA 1 62 VAL C 1 63 LEU N -57.80 -27.30 -40.63 -42.14 -42.22 . . 0 "[ . 1 . 2]"
67 PHI 1 62 VAL C 1 63 LEU N 1 63 LEU CA 1 63 LEU C -77.10 -48.00 -65.18 -64.42 -64.54 . . 0 "[ . 1 . 2]"
68 PSI 1 63 LEU N 1 63 LEU CA 1 63 LEU C 1 64 GLN N -53.20 -33.20 -47.19 -45.36 -46.03 . . 0 "[ . 1 . 2]"
69 PHI 1 63 LEU C 1 64 GLN N 1 64 GLN CA 1 64 GLN C -75.00 -52.60 -62.66 -68.29 -57.98 . . 0 "[ . 1 . 2]"
70 PSI 1 64 GLN N 1 64 GLN CA 1 64 GLN C 1 65 ASP N -57.30 -29.60 -54.73 -55.03 -55.08 . . 0 "[ . 1 . 2]"
71 PHI 1 64 GLN C 1 65 ASP N 1 65 ASP CA 1 65 ASP C -72.60 -52.60 -58.70 -58.77 -58.93 . . 0 "[ . 1 . 2]"
72 PSI 1 65 ASP N 1 65 ASP CA 1 65 ASP C 1 66 LEU N -56.10 -35.80 -32.79 -33.81 -30.26 5.54 16 1 "[ . 1 .+ 2]"
73 PHI 1 65 ASP C 1 66 LEU N 1 66 LEU CA 1 66 LEU C -76.20 -51.60 -69.58 -69.35 -69.37 . . 0 "[ . 1 . 2]"
74 PSI 1 66 LEU N 1 66 LEU CA 1 66 LEU C 1 67 ILE N -51.50 -25.50 -41.81 -45.84 -39.14 . . 0 "[ . 1 . 2]"
75 PHI 1 66 LEU C 1 67 ILE N 1 67 ILE CA 1 67 ILE C -71.80 -51.80 -64.70 -62.39 -63.31 . . 0 "[ . 1 . 2]"
76 PSI 1 67 ILE N 1 67 ILE CA 1 67 ILE C 1 68 ARG N -51.60 -31.20 -48.53 -47.83 -48.65 0.40 20 0 "[ . 1 . 2]"
77 PHI 1 67 ILE C 1 68 ARG N 1 68 ARG CA 1 68 ARG C -69.50 -49.50 -64.50 -70.25 -61.17 0.75 11 0 "[ . 1 . 2]"
78 PSI 1 68 ARG N 1 68 ARG CA 1 68 ARG C 1 69 ASN N -52.80 -28.50 -49.50 -52.49 -41.21 . . 0 "[ . 1 . 2]"
79 PHI 1 68 ARG C 1 69 ASN N 1 69 ASN CA 1 69 ASN C -82.50 -49.90 -55.59 -52.12 -53.28 . . 0 "[ . 1 . 2]"
80 PSI 1 69 ASN N 1 69 ASN CA 1 69 ASN C 1 70 PHE N -51.80 -24.30 -49.17 -52.18 -39.68 0.38 20 0 "[ . 1 . 2]"
81 PHI 1 69 ASN C 1 70 PHE N 1 70 PHE CA 1 70 PHE C -75.10 -53.00 -63.01 -63.35 -64.18 . . 0 "[ . 1 . 2]"
82 PSI 1 70 PHE N 1 70 PHE CA 1 70 PHE C 1 71 LEU N -56.00 -34.60 -38.76 -45.11 -32.93 1.67 14 0 "[ . 1 . 2]"
83 PHI 1 70 PHE C 1 71 LEU N 1 71 LEU CA 1 71 LEU C -80.40 -46.30 -58.71 -54.84 -56.52 . . 0 "[ . 1 . 2]"
84 PSI 1 71 LEU N 1 71 LEU CA 1 71 LEU C 1 72 GLN N -51.30 -31.30 -50.37 -50.96 -51.51 5.17 18 1 "[ . 1 . + 2]"
85 PHI 1 71 LEU C 1 72 GLN N 1 72 GLN CA 1 72 GLN C -79.50 -51.30 -66.68 -67.54 -67.91 . . 0 "[ . 1 . 2]"
86 PSI 1 72 GLN N 1 72 GLN CA 1 72 GLN C 1 73 ASN N -54.10 -18.20 -40.17 -51.28 -31.16 . . 0 "[ . 1 . 2]"
87 PHI 1 72 GLN C 1 73 ASN N 1 73 ASN CA 1 73 ASN C -86.20 -53.80 -66.02 -60.03 -62.54 . . 0 "[ . 1 . 2]"
88 PSI 1 73 ASN N 1 73 ASN CA 1 73 ASN C 1 74 ALA N -45.70 -0.30 -36.15 -43.55 -25.99 . . 0 "[ . 1 . 2]"
89 PHI 1 73 ASN C 1 74 ALA N 1 74 ALA CA 1 74 ALA C -106.90 -54.30 -84.26 -86.46 -72.42 . . 0 "[ . 1 . 2]"
90 PSI 1 74 ALA N 1 74 ALA CA 1 74 ALA C 1 75 LEU N -55.00 25.00 -18.88 -28.38 -13.24 . . 0 "[ . 1 . 2]"
91 PHI 1 75 LEU C 1 76 VAL N 1 76 VAL CA 1 76 VAL C -128.00 -53.30 -115.90 -125.65 -97.65 . . 0 "[ . 1 . 2]"
92 PSI 1 76 VAL N 1 76 VAL CA 1 76 VAL C 1 77 VAL N 85.20 178.50 57.89 66.36 65.36 44.13 19 20 [******************+-]
93 PHI 1 76 VAL C 1 77 VAL N 1 77 VAL CA 1 77 VAL C -105.70 -32.90 -101.06 -112.49 -79.11 6.79 15 2 "[ . 1 - + 2]"
94 PSI 1 77 VAL N 1 77 VAL CA 1 77 VAL C 1 78 GLY N 112.10 151.90 137.14 141.14 139.07 . . 0 "[ . 1 . 2]"
95 PHI 1 82 PRO C 1 83 TYR N 1 83 TYR CA 1 83 TYR C -103.80 -33.10 -69.76 -69.79 -69.81 . . 0 "[ . 1 . 2]"
96 PSI 1 83 TYR N 1 83 TYR CA 1 83 TYR C 1 84 ARG N -83.70 38.40 -20.19 -27.08 -8.87 . . 0 "[ . 1 . 2]"
97 PHI 1 83 TYR C 1 84 ARG N 1 84 ARG CA 1 84 ARG C -71.40 -51.40 -52.43 -59.66 -51.24 0.16 12 0 "[ . 1 . 2]"
98 PSI 1 84 ARG N 1 84 ARG CA 1 84 ARG C 1 85 VAL N -52.50 -32.50 -51.53 -57.97 -44.53 5.47 7 1 "[ . + 1 . 2]"
99 PHI 1 84 ARG C 1 85 VAL N 1 85 VAL CA 1 85 VAL C -79.10 -51.90 -62.85 -59.52 -61.23 0.34 7 0 "[ . 1 . 2]"
100 PSI 1 85 VAL N 1 85 VAL CA 1 85 VAL C 1 86 GLN N -60.80 -30.90 -33.54 -39.54 -32.02 . . 0 "[ . 1 . 2]"
101 PHI 1 85 VAL C 1 86 GLN N 1 86 GLN CA 1 86 GLN C -75.90 -46.90 -62.47 -66.87 -57.73 . . 0 "[ . 1 . 2]"
102 PSI 1 86 GLN N 1 86 GLN CA 1 86 GLN C 1 87 ALA N -60.50 -17.40 -57.03 -60.98 -50.02 0.48 18 0 "[ . 1 . 2]"
103 PHI 1 86 GLN C 1 87 ALA N 1 87 ALA CA 1 87 ALA C -79.00 -59.00 -62.29 -65.06 -65.80 3.84 10 0 "[ . 1 . 2]"
104 PSI 1 87 ALA N 1 87 ALA CA 1 87 ALA C 1 88 VAL N -50.00 -30.00 -39.35 -44.00 -34.20 . . 0 "[ . 1 . 2]"
105 PHI 1 87 ALA C 1 88 VAL N 1 88 VAL CA 1 88 VAL C -74.70 -53.70 -61.97 -60.86 -61.31 . . 0 "[ . 1 . 2]"
106 PSI 1 88 VAL N 1 88 VAL CA 1 88 VAL C 1 89 LYS N -52.60 -32.60 -50.74 -51.82 -50.22 . . 0 "[ . 1 . 2]"
107 PHI 1 88 VAL C 1 89 LYS N 1 89 LYS CA 1 89 LYS C -69.20 -49.20 -63.23 -66.20 -58.15 . . 0 "[ . 1 . 2]"
108 PSI 1 89 LYS N 1 89 LYS CA 1 89 LYS C 1 90 PHE N -50.20 -30.20 -49.52 -52.87 -43.74 2.67 2 0 "[ . 1 . 2]"
109 PHI 1 89 LYS C 1 90 PHE N 1 90 PHE CA 1 90 PHE C -76.10 -52.00 -54.10 -52.73 -54.18 1.15 9 0 "[ . 1 . 2]"
110 PSI 1 90 PHE N 1 90 PHE CA 1 90 PHE C 1 91 LEU N -59.40 -27.00 -45.41 -42.66 -44.82 . . 0 "[ . 1 . 2]"
111 PHI 1 90 PHE C 1 91 LEU N 1 91 LEU CA 1 91 LEU C -77.90 -55.00 -62.92 -68.26 -54.95 0.05 20 0 "[ . 1 . 2]"
112 PSI 1 91 LEU N 1 91 LEU CA 1 91 LEU C 1 92 ILE N -49.80 -29.80 -47.03 -45.23 -45.94 2.36 4 0 "[ . 1 . 2]"
113 PHI 1 91 LEU C 1 92 ILE N 1 92 ILE CA 1 92 ILE C -74.40 -54.40 -58.19 -57.83 -58.10 0.54 4 0 "[ . 1 . 2]"
114 PSI 1 92 ILE N 1 92 ILE CA 1 92 ILE C 1 93 GLU N -52.60 -31.70 -51.08 -53.55 -50.33 0.95 20 0 "[ . 1 . 2]"
115 PHI 1 92 ILE C 1 93 GLU N 1 93 GLU CA 1 93 GLU C -75.20 -49.00 -57.63 -62.17 -54.00 . . 0 "[ . 1 . 2]"
116 PSI 1 93 GLU N 1 93 GLU CA 1 93 GLU C 1 94 ARG N -54.00 -26.50 -48.46 -50.04 -51.39 . . 0 "[ . 1 . 2]"
117 PHI 1 93 GLU C 1 94 ARG N 1 94 ARG CA 1 94 ARG C -73.50 -50.60 -59.09 -68.86 -54.89 . . 0 "[ . 1 . 2]"
118 PSI 1 94 ARG N 1 94 ARG CA 1 94 ARG C 1 95 ILE N -65.10 -18.60 -49.40 -46.17 -46.74 . . 0 "[ . 1 . 2]"
119 PHI 1 94 ARG C 1 95 ILE N 1 95 ILE CA 1 95 ILE C -91.50 -35.80 -55.27 -60.80 -50.63 . . 0 "[ . 1 . 2]"
120 PSI 1 95 ILE N 1 95 ILE CA 1 95 ILE C 1 96 ARG N -53.10 -24.30 -42.74 -47.14 -48.43 . . 0 "[ . 1 . 2]"
121 PHI 1 95 ILE C 1 96 ARG N 1 96 ARG CA 1 96 ARG C -75.20 -55.20 -69.25 -78.26 -56.94 3.06 20 0 "[ . 1 . 2]"
122 PSI 1 96 ARG N 1 96 ARG CA 1 96 ARG C 1 97 LYS N -42.20 -13.00 -39.54 -53.02 -27.91 10.82 19 5 "[ *. * 1 * . -+2]"
123 PHI 1 96 ARG C 1 97 LYS N 1 97 LYS CA 1 97 LYS C -125.40 -58.40 -74.96 -75.67 -75.82 . . 0 "[ . 1 . 2]"
124 PSI 1 97 LYS N 1 97 LYS CA 1 97 LYS C 1 98 ASN N -30.10 28.60 -15.19 -12.60 -15.13 . . 0 "[ . 1 . 2]"
125 PHI 1 98 ASN C 1 99 GLU N 1 99 GLU CA 1 99 GLU C -148.20 -46.10 65.26 63.78 67.38 113.48 20 20 [***-***************+]
126 PSI 1 99 GLU N 1 99 GLU CA 1 99 GLU C 1 100 PRO N 82.60 -176.50 63.74 37.70 37.14 45.46 1 12 "[+* *. * * ***. ***-]"
127 PHI 1 100 PRO C 1 101 LEU N 1 101 LEU CA 1 101 LEU C -135.60 -35.20 -69.76 -69.84 -69.66 . . 0 "[ . 1 . 2]"
128 PSI 1 101 LEU N 1 101 LEU CA 1 101 LEU C 1 102 PRO N 99.30 176.40 124.27 105.33 150.39 . . 0 "[ . 1 . 2]"
129 PHI 1 102 PRO C 1 103 VAL N 1 103 VAL CA 1 103 VAL C -119.20 -39.20 -69.76 -69.86 -69.69 . . 0 "[ . 1 . 2]"
130 PSI 1 103 VAL N 1 103 VAL CA 1 103 VAL C 1 104 TYR N 108.80 142.60 -170.34 -175.89 -167.88 49.52 16 20 [*********-*****+****]
131 PHI 1 103 VAL C 1 104 TYR N 1 104 TYR CA 1 104 TYR C -71.30 -50.00 -72.18 -83.15 -64.51 11.85 8 2 "[ . + 1 . -]"
132 PSI 1 104 TYR N 1 104 TYR CA 1 104 TYR C 1 105 LYS N -55.10 -35.10 140.19 134.87 130.55 169.97 13 20 [***-********+*******]
133 PHI 1 104 TYR C 1 105 LYS N 1 105 LYS CA 1 105 LYS C -71.80 -51.80 -62.19 -64.96 -57.86 . . 0 "[ . 1 . 2]"
134 PSI 1 105 LYS N 1 105 LYS CA 1 105 LYS C 1 106 ASP N -62.90 -13.60 -44.29 -47.81 -42.34 . . 0 "[ . 1 . 2]"
135 PHI 1 105 LYS C 1 106 ASP N 1 106 ASP CA 1 106 ASP C -80.80 -46.90 -68.20 -67.49 -67.71 . . 0 "[ . 1 . 2]"
136 PSI 1 106 ASP N 1 106 ASP CA 1 106 ASP C 1 107 LEU N -52.90 -27.90 -49.64 -51.27 -53.01 0.93 5 0 "[ . 1 . 2]"
137 PHI 1 106 ASP C 1 107 LEU N 1 107 LEU CA 1 107 LEU C -76.50 -56.50 -60.53 -63.95 -58.02 . . 0 "[ . 1 . 2]"
138 PSI 1 107 LEU N 1 107 LEU CA 1 107 LEU C 1 108 TRP N -60.70 -19.80 -52.97 -53.40 -52.33 . . 0 "[ . 1 . 2]"
139 PHI 1 107 LEU C 1 108 TRP N 1 108 TRP CA 1 108 TRP C -74.80 -48.10 -58.19 -60.35 -56.35 . . 0 "[ . 1 . 2]"
140 PSI 1 108 TRP N 1 108 TRP CA 1 108 TRP C 1 109 ASN N -55.30 -26.90 -49.95 -46.95 -48.94 0.28 5 0 "[ . 1 . 2]"
141 PHI 1 108 TRP C 1 109 ASN N 1 109 ASN CA 1 109 ASN C -68.70 -48.70 -55.00 -59.63 -51.20 . . 0 "[ . 1 . 2]"
142 PSI 1 109 ASN N 1 109 ASN CA 1 109 ASN C 1 110 ALA N -58.20 -23.10 -49.99 -49.63 -50.68 . . 0 "[ . 1 . 2]"
143 PHI 1 109 ASN C 1 110 ALA N 1 110 ALA CA 1 110 ALA C -80.70 -49.00 -61.11 -68.78 -57.31 . . 0 "[ . 1 . 2]"
144 PSI 1 110 ALA N 1 110 ALA CA 1 110 ALA C 1 111 LEU N -48.60 -28.30 -40.74 -44.59 -36.38 . . 0 "[ . 1 . 2]"
145 PHI 1 110 ALA C 1 111 LEU N 1 111 LEU CA 1 111 LEU C -76.20 -56.20 -61.62 -66.00 -58.39 . . 0 "[ . 1 . 2]"
146 PSI 1 111 LEU N 1 111 LEU CA 1 111 LEU C 1 112 ARG N -52.50 -26.60 -48.69 -48.90 -48.39 . . 0 "[ . 1 . 2]"
147 PSI 1 22 PRO N 1 22 PRO CA 1 22 PRO C 1 23 THR N 60.00 -160.00 122.89 122.75 122.58 . . 0 "[ . 1 . 2]"
148 CHI1 1 26 LEU N 1 26 LEU CA 1 26 LEU CB 1 26 LEU CG 130.00 -130.00 -176.24 171.65 73.64 59.86 1 3 "[+ . *1 . - 2]"
149 CHI1 1 29 GLU N 1 29 GLU CA 1 29 GLU CB 1 29 GLU CG -110.00 -10.00 152.51 155.05 154.57 97.07 14 20 [*********-***+******]
150 CHI1 1 39 LEU N 1 39 LEU CA 1 39 LEU CB 1 39 LEU CG -110.00 -10.00 166.57 81.39 -110.11 92.33 13 19 [*********1**+******-]
151 CHI1 1 45 LEU N 1 45 LEU CA 1 45 LEU CB 1 45 LEU CG -110.00 -10.00 -70.34 -48.79 -52.60 55.63 16 4 "[ . -1 * .+ *]"
152 CHI1 1 47 ASP N 1 47 ASP CA 1 47 ASP CB 1 47 ASP CG -110.00 -10.00 -114.06 175.88 -75.11 74.12 5 8 "[ ** +* ** * .- 2]"
153 PSI 1 55 PRO N 1 55 PRO CA 1 55 PRO C 1 56 VAL N 60.00 -160.00 160.34 160.01 159.98 . . 0 "[ . 1 . 2]"
154 CHI1 1 65 ASP N 1 65 ASP CA 1 65 ASP CB 1 65 ASP CG -110.00 -10.00 76.33 69.79 81.63 91.63 18 20 [***************-*+**]
155 CHI1 1 66 LEU N 1 66 LEU CA 1 66 LEU CB 1 66 LEU CG -110.00 -10.00 -85.79 -84.22 -84.54 . . 0 "[ . 1 . 2]"
156 CHI1 1 72 GLN N 1 72 GLN CA 1 72 GLN CB 1 72 GLN CG -110.00 -10.00 -130.19 -119.36 -121.86 68.84 15 20 [************-*+*****]
157 CHI1 1 77 VAL N 1 77 VAL CA 1 77 VAL CB 1 77 VAL CG1 130.00 -130.00 168.32 174.05 173.72 . . 0 "[ . 1 . 2]"
158 PSI 1 82 PRO N 1 82 PRO CA 1 82 PRO C 1 83 TYR N -90.00 0.00 78.22 74.54 108.08 108.08 7 20 [******+***-*********]
159 CHI1 1 90 PHE N 1 90 PHE CA 1 90 PHE CB 1 90 PHE CG 130.00 -130.00 170.90 165.05 -167.41 . . 0 "[ . 1 . 2]"
160 CHI1 1 91 LEU N 1 91 LEU CA 1 91 LEU CB 1 91 LEU CG -110.00 -10.00 -149.58 177.94 -130.06 72.06 5 20 [****+********-******]
161 CHI2 1 91 LEU CA 1 91 LEU CB 1 91 LEU CG 1 91 LEU CD1 130.00 -130.00 -2.80 74.09 59.03 73.63 1 20 [+***************-***]
162 CHI1 1 98 ASN N 1 98 ASN CA 1 98 ASN CB 1 98 ASN CG 130.00 -130.00 -97.24 -71.05 -72.97 77.33 3 15 "[**+**-* *** *** * *]"
163 PSI 1 100 PRO N 1 100 PRO CA 1 100 PRO C 1 101 LEU N 60.00 -160.00 160.69 155.45 162.12 . . 0 "[ . 1 . 2]"
164 PSI 1 102 PRO N 1 102 PRO CA 1 102 PRO C 1 103 VAL N 60.00 -160.00 119.09 97.52 150.72 . . 0 "[ . 1 . 2]"
165 CHI1 1 105 LYS N 1 105 LYS CA 1 105 LYS CB 1 105 LYS CG 130.00 -130.00 175.74 170.58 -166.27 . . 0 "[ . 1 . 2]"
166 CHI1 1 107 LEU N 1 107 LEU CA 1 107 LEU CB 1 107 LEU CG 130.00 -130.00 -157.90 -168.02 -141.98 . . 0 "[ . 1 . 2]"
167 CHI1 1 108 TRP N 1 108 TRP CA 1 108 TRP CB 1 108 TRP CG 130.00 -130.00 -177.12 174.66 -167.71 . . 0 "[ . 1 . 2]"
168 CHI1 1 109 ASN N 1 109 ASN CA 1 109 ASN CB 1 109 ASN CG -110.00 -10.00 175.02 168.45 -167.52 81.55 20 20 [****-**************+]
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