NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
613015 |
2nbo   |
25986 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2nbo
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 184
_TA_constraint_stats_list.Viol_count 728
_TA_constraint_stats_list.Viol_total 7579.68
_TA_constraint_stats_list.Viol_max 4.05
_TA_constraint_stats_list.Viol_rms 0.29
_TA_constraint_stats_list.Viol_average_all_restraints 0.10
_TA_constraint_stats_list.Viol_average_violations_only 0.52
_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 9 LYS C 1 10 CYS N 1 10 CYS CA 1 10 CYS C -98.90 -49.20 -62.27 -52.37 -53.54 0.87 8 0 "[ . 1 . 2]"
2 PSI 1 10 CYS N 1 10 CYS CA 1 10 CYS C 1 11 PRO N 103.80 174.20 156.27 160.67 160.57 . . 0 "[ . 1 . 2]"
3 PSI 1 11 PRO N 1 11 PRO CA 1 11 PRO C 1 12 LEU N -42.90 -2.20 -29.81 -28.51 -32.97 . . 0 "[ . 1 . 2]"
4 PHI 1 11 PRO C 1 12 LEU N 1 12 LEU CA 1 12 LEU C -145.80 -104.50 -133.29 -142.91 -145.40 0.21 16 0 "[ . 1 . 2]"
5 PSI 1 12 LEU N 1 12 LEU CA 1 12 LEU C 1 13 MET N 108.90 148.90 123.30 112.25 138.19 . . 0 "[ . 1 . 2]"
6 PHI 1 12 LEU C 1 13 MET N 1 13 MET CA 1 13 MET C -139.20 -78.60 -138.28 -141.08 -133.05 1.88 5 0 "[ . 1 . 2]"
7 PSI 1 13 MET N 1 13 MET CA 1 13 MET C 1 14 VAL N 108.70 148.70 148.64 148.78 148.75 0.78 15 0 "[ . 1 . 2]"
8 PHI 1 13 MET C 1 14 VAL N 1 14 VAL CA 1 14 VAL C -141.30 -101.30 -102.25 -100.94 -101.06 0.80 15 0 "[ . 1 . 2]"
9 PSI 1 14 VAL N 1 14 VAL CA 1 14 VAL C 1 15 LYS N 111.20 151.20 131.48 120.06 142.76 . . 0 "[ . 1 . 2]"
10 PHI 1 14 VAL C 1 15 LYS N 1 15 LYS CA 1 15 LYS C -140.80 -100.40 -123.09 -118.75 -121.70 . . 0 "[ . 1 . 2]"
11 PSI 1 15 LYS N 1 15 LYS CA 1 15 LYS C 1 16 VAL N 109.60 149.60 109.67 109.16 111.43 0.44 16 0 "[ . 1 . 2]"
12 PHI 1 15 LYS C 1 16 VAL N 1 16 VAL CA 1 16 VAL C -126.80 -86.80 -124.36 -124.26 -124.46 0.28 5 0 "[ . 1 . 2]"
13 PSI 1 16 VAL N 1 16 VAL CA 1 16 VAL C 1 17 LEU N 104.90 144.90 120.52 118.78 124.03 . . 0 "[ . 1 . 2]"
14 PHI 1 16 VAL C 1 17 LEU N 1 17 LEU CA 1 17 LEU C -138.70 -98.70 -138.57 -138.06 -138.65 0.77 14 0 "[ . 1 . 2]"
15 PSI 1 17 LEU N 1 17 LEU CA 1 17 LEU C 1 18 ASP N 116.50 156.50 150.33 150.06 149.63 . . 0 "[ . 1 . 2]"
16 PHI 1 17 LEU C 1 18 ASP N 1 18 ASP CA 1 18 ASP C -106.50 -66.50 -80.49 -81.82 -83.44 . . 0 "[ . 1 . 2]"
17 PSI 1 18 ASP N 1 18 ASP CA 1 18 ASP C 1 19 ALA N 93.40 142.60 121.92 120.88 112.91 . . 0 "[ . 1 . 2]"
18 PHI 1 19 ALA C 1 20 VAL N 1 20 VAL CA 1 20 VAL C -91.10 -51.10 -74.69 -87.83 -51.63 . . 0 "[ . 1 . 2]"
19 PSI 1 20 VAL N 1 20 VAL CA 1 20 VAL C 1 21 ARG N -56.60 -16.10 -42.73 -45.00 -47.79 . . 0 "[ . 1 . 2]"
20 PHI 1 20 VAL C 1 21 ARG N 1 21 ARG CA 1 21 ARG C -124.00 -71.20 -115.44 -116.34 -116.59 . . 0 "[ . 1 . 2]"
21 PSI 1 21 ARG N 1 21 ARG CA 1 21 ARG C 1 22 GLY N -31.80 12.70 -23.05 -31.14 -16.48 . . 0 "[ . 1 . 2]"
22 PHI 1 21 ARG C 1 22 GLY N 1 22 GLY CA 1 22 GLY C 53.30 93.30 93.72 93.30 94.47 1.17 19 0 "[ . 1 . 2]"
23 PSI 1 22 GLY N 1 22 GLY CA 1 22 GLY C 1 23 SER N 2.30 42.30 6.17 5.06 4.49 . . 0 "[ . 1 . 2]"
24 PHI 1 22 GLY C 1 23 SER N 1 23 SER CA 1 23 SER C -136.00 -63.70 -97.23 -108.03 -90.57 . . 0 "[ . 1 . 2]"
25 PSI 1 23 SER N 1 23 SER CA 1 23 SER C 1 24 PRO N 122.70 169.00 162.38 162.11 162.05 . . 0 "[ . 1 . 2]"
26 PSI 1 24 PRO N 1 24 PRO CA 1 24 PRO C 1 25 ALA N 124.80 164.80 150.86 152.15 151.62 . . 0 "[ . 1 . 2]"
27 PHI 1 24 PRO C 1 25 ALA N 1 25 ALA CA 1 25 ALA C -123.40 -62.40 -95.76 -99.35 -92.11 . . 0 "[ . 1 . 2]"
28 PSI 1 25 ALA N 1 25 ALA CA 1 25 ALA C 1 26 ILE N 88.20 151.70 135.74 132.98 137.18 . . 0 "[ . 1 . 2]"
29 PHI 1 25 ALA C 1 26 ILE N 1 26 ILE CA 1 26 ILE C -104.90 -48.90 -105.67 -106.37 -105.22 1.47 14 0 "[ . 1 . 2]"
30 PSI 1 26 ILE N 1 26 ILE CA 1 26 ILE C 1 27 ASN N 118.10 163.40 139.17 138.87 138.82 . . 0 "[ . 1 . 2]"
31 PHI 1 27 ASN C 1 28 VAL N 1 28 VAL CA 1 28 VAL C -116.20 -53.30 -114.18 -117.02 -111.30 0.82 15 0 "[ . 1 . 2]"
32 PSI 1 28 VAL N 1 28 VAL CA 1 28 VAL C 1 29 ALA N 111.10 154.70 110.59 110.85 110.68 1.15 7 0 "[ . 1 . 2]"
33 PHI 1 28 VAL C 1 29 ALA N 1 29 ALA CA 1 29 ALA C -96.80 -56.80 -56.51 -60.20 -55.01 1.79 18 0 "[ . 1 . 2]"
34 PSI 1 29 ALA N 1 29 ALA CA 1 29 ALA C 1 30 VAL N 113.30 153.30 127.65 125.98 123.89 . . 0 "[ . 1 . 2]"
35 PHI 1 29 ALA C 1 30 VAL N 1 30 VAL CA 1 30 VAL C -138.10 -98.10 -138.12 -138.90 -133.60 0.80 19 0 "[ . 1 . 2]"
36 PSI 1 30 VAL N 1 30 VAL CA 1 30 VAL C 1 31 HIS N 108.40 148.40 131.76 128.57 134.29 . . 0 "[ . 1 . 2]"
37 PHI 1 30 VAL C 1 31 HIS N 1 31 HIS CA 1 31 HIS C -126.40 -79.00 -125.60 -123.26 -124.15 0.35 12 0 "[ . 1 . 2]"
38 PSI 1 31 HIS N 1 31 HIS CA 1 31 HIS C 1 32 VAL N 105.80 145.90 120.98 116.87 124.43 . . 0 "[ . 1 . 2]"
39 PHI 1 31 HIS C 1 32 VAL N 1 32 VAL CA 1 32 VAL C -130.90 -90.90 -101.46 -102.99 -103.55 . . 0 "[ . 1 . 2]"
40 PSI 1 32 VAL N 1 32 VAL CA 1 32 VAL C 1 33 PHE N 108.40 148.40 137.16 128.93 141.76 . . 0 "[ . 1 . 2]"
41 PHI 1 32 VAL C 1 33 PHE N 1 33 PHE CA 1 33 PHE C -142.30 -102.30 -131.98 -136.37 -137.14 . . 0 "[ . 1 . 2]"
42 PSI 1 33 PHE N 1 33 PHE CA 1 33 PHE C 1 34 ARG N 125.20 165.20 165.47 162.93 166.26 1.06 19 0 "[ . 1 . 2]"
43 PHI 1 33 PHE C 1 34 ARG N 1 34 ARG CA 1 34 ARG C -144.30 -102.20 -130.18 -132.59 -127.64 . . 0 "[ . 1 . 2]"
44 PSI 1 34 ARG N 1 34 ARG CA 1 34 ARG C 1 35 LYS N 114.90 154.90 146.01 139.64 152.38 . . 0 "[ . 1 . 2]"
45 PHI 1 34 ARG C 1 35 LYS N 1 35 LYS CA 1 35 LYS C -92.90 -52.90 -66.06 -67.78 -68.84 . . 0 "[ . 1 . 2]"
46 PSI 1 35 LYS N 1 35 LYS CA 1 35 LYS C 1 36 ALA N 102.10 150.50 109.13 108.02 111.72 . . 0 "[ . 1 . 2]"
47 PHI 1 35 LYS C 1 36 ALA N 1 36 ALA CA 1 36 ALA C -102.40 -50.10 -71.69 -74.01 -69.73 . . 0 "[ . 1 . 2]"
48 PSI 1 36 ALA N 1 36 ALA CA 1 36 ALA C 1 37 ALA N 143.30 -176.40 156.70 154.60 159.57 . . 0 "[ . 1 . 2]"
49 PHI 1 36 ALA C 1 37 ALA N 1 37 ALA CA 1 37 ALA C -84.00 -44.00 -60.04 -59.73 -59.85 . . 0 "[ . 1 . 2]"
50 PSI 1 37 ALA N 1 37 ALA CA 1 37 ALA C 1 38 ASP N -41.30 -1.30 -20.23 -21.28 -19.34 . . 0 "[ . 1 . 2]"
51 PHI 1 37 ALA C 1 38 ASP N 1 38 ASP CA 1 38 ASP C -107.60 -67.60 -94.23 -93.74 -93.93 . . 0 "[ . 1 . 2]"
52 PSI 1 38 ASP N 1 38 ASP CA 1 38 ASP C 1 39 ASP N -9.10 30.90 16.89 16.17 18.78 . . 0 "[ . 1 . 2]"
53 PHI 1 38 ASP C 1 39 ASP N 1 39 ASP CA 1 39 ASP C 45.90 85.90 64.37 64.95 64.93 . . 0 "[ . 1 . 2]"
54 PSI 1 39 ASP N 1 39 ASP CA 1 39 ASP C 1 40 THR N 1.10 51.30 39.40 36.21 36.19 . . 0 "[ . 1 . 2]"
55 PHI 1 40 THR C 1 41 TRP N 1 41 TRP CA 1 41 TRP C -136.50 -61.80 -105.97 -111.67 -103.70 . . 0 "[ . 1 . 2]"
56 PSI 1 41 TRP N 1 41 TRP CA 1 41 TRP C 1 42 GLU N 107.50 164.20 106.83 106.19 107.15 1.31 11 0 "[ . 1 . 2]"
57 PHI 1 41 TRP C 1 42 GLU N 1 42 GLU CA 1 42 GLU C -159.70 -53.80 -95.91 -94.60 -94.78 . . 0 "[ . 1 . 2]"
58 PSI 1 42 GLU N 1 42 GLU CA 1 42 GLU C 1 43 PRO N 89.50 171.60 150.63 149.06 152.40 . . 0 "[ . 1 . 2]"
59 PSI 1 43 PRO N 1 43 PRO CA 1 43 PRO C 1 44 PHE N 114.70 154.70 116.20 114.74 118.31 . . 0 "[ . 1 . 2]"
60 PHI 1 43 PRO C 1 44 PHE N 1 44 PHE CA 1 44 PHE C -131.80 -84.90 -102.36 -106.80 -100.04 . . 0 "[ . 1 . 2]"
61 PSI 1 44 PHE N 1 44 PHE CA 1 44 PHE C 1 45 ALA N -65.30 -10.60 -41.92 -42.13 -42.44 . . 0 "[ . 1 . 2]"
62 PHI 1 44 PHE C 1 45 ALA N 1 45 ALA CA 1 45 ALA C -180.00 -140.00 -172.59 -178.12 -161.52 . . 0 "[ . 1 . 2]"
63 PSI 1 45 ALA N 1 45 ALA CA 1 45 ALA C 1 46 SER N 135.10 175.10 175.83 175.93 175.81 1.29 4 0 "[ . 1 . 2]"
64 PHI 1 45 ALA C 1 46 SER N 1 46 SER CA 1 46 SER C -172.00 -96.70 -171.14 -171.98 -172.11 0.22 6 0 "[ . 1 . 2]"
65 PSI 1 46 SER N 1 46 SER CA 1 46 SER C 1 47 GLY N 132.30 172.60 150.30 155.84 152.43 . . 0 "[ . 1 . 2]"
66 PHI 1 47 GLY C 1 48 LYS N 1 48 LYS CA 1 48 LYS C -157.20 -99.80 -131.13 -142.66 -111.50 . . 0 "[ . 1 . 2]"
67 PSI 1 48 LYS N 1 48 LYS CA 1 48 LYS C 1 49 THR N 126.30 167.50 132.98 133.82 133.59 . . 0 "[ . 1 . 2]"
68 PHI 1 48 LYS C 1 49 THR N 1 49 THR CA 1 49 THR C -109.90 -43.40 -57.79 -61.95 -54.62 . . 0 "[ . 1 . 2]"
69 PSI 1 49 THR N 1 49 THR CA 1 49 THR C 1 50 SER N 115.70 174.00 171.04 148.31 173.35 . . 0 "[ . 1 . 2]"
70 PHI 1 49 THR C 1 50 SER N 1 50 SER CA 1 50 SER C -126.70 -49.00 -126.22 -127.24 -127.31 0.82 6 0 "[ . 1 . 2]"
71 PSI 1 50 SER N 1 50 SER CA 1 50 SER C 1 51 GLU N 155.70 -164.30 174.43 174.49 174.36 . . 0 "[ . 1 . 2]"
72 PHI 1 50 SER C 1 51 GLU N 1 51 GLU CA 1 51 GLU C -83.30 -43.30 -68.85 -69.25 -68.30 . . 0 "[ . 1 . 2]"
73 PSI 1 51 GLU N 1 51 GLU CA 1 51 GLU C 1 52 SER N -40.40 -0.40 -8.60 -8.14 -8.49 . . 0 "[ . 1 . 2]"
74 PHI 1 51 GLU C 1 52 SER N 1 52 SER CA 1 52 SER C -111.30 -71.30 -101.37 -102.78 -99.66 . . 0 "[ . 1 . 2]"
75 PSI 1 52 SER N 1 52 SER CA 1 52 SER C 1 53 GLY N -19.80 20.20 3.55 2.19 1.53 . . 0 "[ . 1 . 2]"
76 PHI 1 52 SER C 1 53 GLY N 1 53 GLY CA 1 53 GLY C 62.80 102.80 70.42 66.12 73.89 . . 0 "[ . 1 . 2]"
77 PSI 1 53 GLY N 1 53 GLY CA 1 53 GLY C 1 54 GLU N -6.80 33.20 21.82 23.10 22.25 . . 0 "[ . 1 . 2]"
78 PHI 1 53 GLY C 1 54 GLU N 1 54 GLU CA 1 54 GLU C -130.50 -64.30 -130.76 -130.53 -130.62 1.10 14 0 "[ . 1 . 2]"
79 PSI 1 54 GLU N 1 54 GLU CA 1 54 GLU C 1 55 LEU N 128.80 173.90 141.93 128.71 153.59 0.09 10 0 "[ . 1 . 2]"
80 PHI 1 54 GLU C 1 55 LEU N 1 55 LEU CA 1 55 LEU C -136.20 -41.90 -110.15 -134.37 -75.78 . . 0 "[ . 1 . 2]"
81 PSI 1 55 LEU N 1 55 LEU CA 1 55 LEU C 1 56 HIS N 110.70 162.50 135.46 110.75 110.72 2.04 4 0 "[ . 1 . 2]"
82 PHI 1 57 GLY C 1 58 LEU N 1 58 LEU CA 1 58 LEU C -100.30 -57.20 -79.06 -100.29 -57.06 0.14 4 0 "[ . 1 . 2]"
83 PSI 1 58 LEU N 1 58 LEU CA 1 58 LEU C 1 59 THR N -60.70 10.80 -21.93 -25.25 -25.46 0.59 9 0 "[ . 1 . 2]"
84 PHI 1 58 LEU C 1 59 THR N 1 59 THR CA 1 59 THR C -163.20 -45.00 -60.26 -104.40 -50.93 . . 0 "[ . 1 . 2]"
85 PSI 1 59 THR N 1 59 THR CA 1 59 THR C 1 60 THR N 117.30 179.70 139.23 123.87 156.75 . . 0 "[ . 1 . 2]"
86 PHI 1 59 THR C 1 60 THR N 1 60 THR CA 1 60 THR C -162.30 -71.80 -151.52 -152.44 -147.18 . . 0 "[ . 1 . 2]"
87 PSI 1 60 THR N 1 60 THR CA 1 60 THR C 1 61 GLU N 147.80 -172.20 173.71 174.75 173.89 . . 0 "[ . 1 . 2]"
88 PHI 1 60 THR C 1 61 GLU N 1 61 GLU CA 1 61 GLU C -79.90 -39.90 -65.15 -78.92 -58.79 . . 0 "[ . 1 . 2]"
89 PSI 1 61 GLU N 1 61 GLU CA 1 61 GLU C 1 62 GLU N -54.50 -14.50 -15.91 -14.75 -15.15 1.35 15 0 "[ . 1 . 2]"
90 PHI 1 61 GLU C 1 62 GLU N 1 62 GLU CA 1 62 GLU C -88.40 -48.40 -73.04 -82.39 -60.06 . . 0 "[ . 1 . 2]"
91 PSI 1 62 GLU N 1 62 GLU CA 1 62 GLU C 1 63 GLU N -41.40 -1.40 -7.51 -15.80 -16.29 1.81 15 0 "[ . 1 . 2]"
92 PHI 1 62 GLU C 1 63 GLU N 1 63 GLU CA 1 63 GLU C -106.70 -66.70 -66.59 -65.98 -66.07 0.90 7 0 "[ . 1 . 2]"
93 PSI 1 63 GLU N 1 63 GLU CA 1 63 GLU C 1 64 PHE N -30.20 11.40 -16.30 -14.21 -14.25 . . 0 "[ . 1 . 2]"
94 PHI 1 63 GLU C 1 64 PHE N 1 64 PHE CA 1 64 PHE C -113.60 -67.60 -84.67 -82.18 -83.54 . . 0 "[ . 1 . 2]"
95 PSI 1 64 PHE N 1 64 PHE CA 1 64 PHE C 1 65 VAL N 1.30 129.90 53.43 56.15 55.13 . . 0 "[ . 1 . 2]"
96 PHI 1 64 PHE C 1 65 VAL N 1 65 VAL CA 1 65 VAL C -135.80 -72.50 -118.08 -119.31 -121.34 0.22 13 0 "[ . 1 . 2]"
97 PSI 1 65 VAL N 1 65 VAL CA 1 65 VAL C 1 66 GLU N 121.90 -177.50 -176.91 -177.18 -176.17 1.33 14 0 "[ . 1 . 2]"
98 PHI 1 67 GLY C 1 68 ILE N 1 68 ILE CA 1 68 ILE C -123.90 -60.40 -69.78 -68.83 -69.46 . . 0 "[ . 1 . 2]"
99 PSI 1 68 ILE N 1 68 ILE CA 1 68 ILE C 1 69 TYR N 108.10 148.10 118.23 123.37 121.93 0.07 18 0 "[ . 1 . 2]"
100 PHI 1 68 ILE C 1 69 TYR N 1 69 TYR CA 1 69 TYR C -143.10 -103.10 -140.70 -143.33 -137.05 0.23 4 0 "[ . 1 . 2]"
101 PSI 1 69 TYR N 1 69 TYR CA 1 69 TYR C 1 70 LYS N 125.00 165.80 129.58 124.20 142.38 0.80 3 0 "[ . 1 . 2]"
102 PHI 1 69 TYR C 1 70 LYS N 1 70 LYS CA 1 70 LYS C -135.00 -78.20 -116.78 -115.94 -121.09 . . 0 "[ . 1 . 2]"
103 PSI 1 70 LYS N 1 70 LYS CA 1 70 LYS C 1 71 VAL N 104.80 144.80 104.17 104.01 103.96 1.13 6 0 "[ . 1 . 2]"
104 PHI 1 70 LYS C 1 71 VAL N 1 71 VAL CA 1 71 VAL C -128.80 -88.80 -99.93 -103.58 -93.17 . . 0 "[ . 1 . 2]"
105 PSI 1 71 VAL N 1 71 VAL CA 1 71 VAL C 1 72 GLU N 105.10 145.10 134.95 133.27 130.02 . . 0 "[ . 1 . 2]"
106 PHI 1 71 VAL C 1 72 GLU N 1 72 GLU CA 1 72 GLU C -129.60 -89.60 -121.21 -129.58 -110.72 . . 0 "[ . 1 . 2]"
107 PSI 1 72 GLU N 1 72 GLU CA 1 72 GLU C 1 73 ILE N 108.20 148.20 138.29 137.66 137.14 . . 0 "[ . 1 . 2]"
108 PHI 1 72 GLU C 1 73 ILE N 1 73 ILE CA 1 73 ILE C -131.80 -91.80 -116.50 -125.23 -112.63 . . 0 "[ . 1 . 2]"
109 PSI 1 73 ILE N 1 73 ILE CA 1 73 ILE C 1 74 ASP N 109.20 149.20 134.23 138.16 136.67 . . 0 "[ . 1 . 2]"
110 PHI 1 73 ILE C 1 74 ASP N 1 74 ASP CA 1 74 ASP C -104.30 -64.30 -101.75 -105.28 -88.34 0.98 9 0 "[ . 1 . 2]"
111 PSI 1 74 ASP N 1 74 ASP CA 1 74 ASP C 1 75 THR N 71.80 136.80 93.55 71.69 106.11 0.11 17 0 "[ . 1 . 2]"
112 PHI 1 75 THR C 1 76 LYS N 1 76 LYS CA 1 76 LYS C -84.30 -44.30 -67.58 -86.10 -50.35 1.80 15 0 "[ . 1 . 2]"
113 PSI 1 76 LYS N 1 76 LYS CA 1 76 LYS C 1 77 SER N -65.70 -25.70 -39.81 -46.81 -29.69 . . 0 "[ . 1 . 2]"
114 PHI 1 76 LYS C 1 77 SER N 1 77 SER CA 1 77 SER C -88.60 -48.60 -90.03 -90.26 -90.39 4.05 15 0 "[ . 1 . 2]"
115 PSI 1 77 SER N 1 77 SER CA 1 77 SER C 1 78 TYR N -55.10 -15.10 -23.91 -51.12 -12.76 2.34 18 0 "[ . 1 . 2]"
116 PHI 1 77 SER C 1 78 TYR N 1 78 TYR CA 1 78 TYR C -85.00 -45.00 -71.53 -52.72 -73.15 . . 0 "[ . 1 . 2]"
117 PSI 1 78 TYR N 1 78 TYR CA 1 78 TYR C 1 79 TRP N -66.90 -26.90 -33.53 -29.49 -31.06 0.57 20 0 "[ . 1 . 2]"
118 PHI 1 78 TYR C 1 79 TRP N 1 79 TRP CA 1 79 TRP C -85.80 -45.80 -76.27 -71.00 -73.01 0.27 10 0 "[ . 1 . 2]"
119 PSI 1 79 TRP N 1 79 TRP CA 1 79 TRP C 1 80 LYS N -56.70 -16.70 -27.92 -40.74 -16.23 0.47 6 0 "[ . 1 . 2]"
120 PHI 1 79 TRP C 1 80 LYS N 1 80 LYS CA 1 80 LYS C -85.40 -45.40 -77.96 -70.72 -72.19 0.67 14 0 "[ . 1 . 2]"
121 PSI 1 80 LYS N 1 80 LYS CA 1 80 LYS C 1 81 ALA N -58.30 -18.30 -17.69 -18.17 -18.55 2.61 12 0 "[ . 1 . 2]"
122 PHI 1 80 LYS C 1 81 ALA N 1 81 ALA CA 1 81 ALA C -87.60 -47.60 -81.76 -76.88 -79.79 1.39 5 0 "[ . 1 . 2]"
123 PSI 1 81 ALA N 1 81 ALA CA 1 81 ALA C 1 82 LEU N -44.90 -4.90 -44.33 -43.64 -44.42 0.53 12 0 "[ . 1 . 2]"
124 PHI 1 82 LEU C 1 83 GLY N 1 83 GLY CA 1 83 GLY C 56.60 96.60 59.27 58.09 56.96 1.15 12 0 "[ . 1 . 2]"
125 PSI 1 83 GLY N 1 83 GLY CA 1 83 GLY C 1 84 ILE N 5.50 45.50 45.79 38.60 47.32 1.82 13 0 "[ . 1 . 2]"
126 PHI 1 83 GLY C 1 84 ILE N 1 84 ILE CA 1 84 ILE C -131.20 -91.20 -91.42 -100.93 -89.23 1.97 7 0 "[ . 1 . 2]"
127 PSI 1 84 ILE N 1 84 ILE CA 1 84 ILE C 1 85 SER N 116.40 161.70 156.27 151.18 159.80 . . 0 "[ . 1 . 2]"
128 PHI 1 84 ILE C 1 85 SER N 1 85 SER CA 1 85 SER C -104.40 -49.10 -49.39 -51.36 -47.56 1.54 12 0 "[ . 1 . 2]"
129 PSI 1 85 SER N 1 85 SER CA 1 85 SER C 1 86 PRO N 109.30 159.20 149.13 108.48 160.04 0.84 12 0 "[ . 1 . 2]"
130 PHI 1 91 ALA C 1 92 GLU N 1 92 GLU CA 1 92 GLU C -143.90 -103.90 -127.58 -127.24 -128.27 0.29 3 0 "[ . 1 . 2]"
131 PSI 1 92 GLU N 1 92 GLU CA 1 92 GLU C 1 93 VAL N 122.30 170.90 160.89 149.61 171.06 0.16 3 0 "[ . 1 . 2]"
132 PHI 1 92 GLU C 1 93 VAL N 1 93 VAL CA 1 93 VAL C -140.80 -86.40 -121.04 -124.75 -126.70 0.25 11 0 "[ . 1 . 2]"
133 PSI 1 93 VAL N 1 93 VAL CA 1 93 VAL C 1 94 VAL N 109.90 149.90 111.19 109.27 116.90 0.63 9 0 "[ . 1 . 2]"
134 PHI 1 93 VAL C 1 94 VAL N 1 94 VAL CA 1 94 VAL C -129.20 -89.20 -126.21 -129.53 -116.01 0.33 2 0 "[ . 1 . 2]"
135 PSI 1 94 VAL N 1 94 VAL CA 1 94 VAL C 1 95 PHE N 109.00 149.00 110.59 108.70 127.22 0.30 15 0 "[ . 1 . 2]"
136 PHI 1 94 VAL C 1 95 PHE N 1 95 PHE CA 1 95 PHE C -139.80 -99.80 -130.70 -139.75 -118.59 . . 0 "[ . 1 . 2]"
137 PSI 1 95 PHE N 1 95 PHE CA 1 95 PHE C 1 96 THR N 110.10 154.50 144.22 119.59 154.83 0.33 9 0 "[ . 1 . 2]"
138 PHI 1 95 PHE C 1 96 THR N 1 96 THR CA 1 96 THR C -121.00 -72.20 -110.84 -109.88 -113.45 0.24 4 0 "[ . 1 . 2]"
139 PSI 1 96 THR N 1 96 THR CA 1 96 THR C 1 97 ALA N 105.40 145.40 143.97 138.35 146.58 1.18 9 0 "[ . 1 . 2]"
140 PHI 1 96 THR C 1 97 ALA N 1 97 ALA CA 1 97 ALA C -120.80 -80.40 -80.90 -88.34 -79.42 0.98 9 0 "[ . 1 . 2]"
141 PSI 1 97 ALA N 1 97 ALA CA 1 97 ALA C 1 98 ASN N 95.80 158.70 157.52 147.99 159.09 0.39 17 0 "[ . 1 . 2]"
142 PHI 1 105 TYR C 1 106 THR N 1 106 THR CA 1 106 THR C -127.50 -87.50 -95.24 -93.09 -103.88 0.20 13 0 "[ . 1 . 2]"
143 PSI 1 106 THR N 1 106 THR CA 1 106 THR C 1 107 ILE N 106.30 146.30 137.47 130.94 143.22 . . 0 "[ . 1 . 2]"
144 PHI 1 106 THR C 1 107 ILE N 1 107 ILE CA 1 107 ILE C -127.00 -87.00 -86.82 -86.68 -86.71 0.44 13 0 "[ . 1 . 2]"
145 PSI 1 107 ILE N 1 107 ILE CA 1 107 ILE C 1 108 ALA N 105.50 145.50 109.48 108.27 107.67 0.27 11 0 "[ . 1 . 2]"
146 PHI 1 107 ILE C 1 108 ALA N 1 108 ALA CA 1 108 ALA C -134.80 -92.60 -91.99 -92.89 -91.63 0.97 9 0 "[ . 1 . 2]"
147 PSI 1 108 ALA N 1 108 ALA CA 1 108 ALA C 1 109 ALA N 111.90 151.90 111.62 111.10 111.97 0.80 20 0 "[ . 1 . 2]"
148 PHI 1 108 ALA C 1 109 ALA N 1 109 ALA CA 1 109 ALA C -144.90 -104.90 -127.35 -125.62 -126.16 . . 0 "[ . 1 . 2]"
149 PSI 1 109 ALA N 1 109 ALA CA 1 109 ALA C 1 110 MET N 109.90 149.90 115.83 119.44 118.92 . . 0 "[ . 1 . 2]"
150 PHI 1 109 ALA C 1 110 MET N 1 110 MET CA 1 110 MET C -120.00 -79.10 -108.74 -113.42 -103.02 . . 0 "[ . 1 . 2]"
151 PSI 1 110 MET N 1 110 MET CA 1 110 MET C 1 111 LEU N 99.20 139.20 125.38 126.52 126.47 . . 0 "[ . 1 . 2]"
152 PHI 1 111 LEU C 1 112 SER N 1 112 SER CA 1 112 SER C -84.60 -44.60 -63.22 -55.15 -57.66 0.12 19 0 "[ . 1 . 2]"
153 PSI 1 112 SER N 1 112 SER CA 1 112 SER C 1 113 PRO N 113.10 171.90 160.03 160.06 160.04 . . 0 "[ . 1 . 2]"
154 PHI 1 46 SER C 1 47 GLY N 1 47 GLY CA 1 47 GLY C 100.90 -71.70 171.40 160.12 -169.48 . . 0 "[ . 1 . 2]"
155 PSI 1 47 GLY N 1 47 GLY CA 1 47 GLY C 1 48 LYS N 112.80 -116.70 -158.25 -157.48 -158.14 . . 0 "[ . 1 . 2]"
156 PHI 1 74 ASP C 1 75 THR N 1 75 THR CA 1 75 THR C -104.60 -34.00 -92.75 -106.10 -81.51 1.50 19 0 "[ . 1 . 2]"
157 PSI 1 75 THR N 1 75 THR CA 1 75 THR C 1 76 LYS N -68.50 18.40 -6.14 -2.73 -14.40 0.40 20 0 "[ . 1 . 2]"
158 PHI 1 81 ALA C 1 82 LEU N 1 82 LEU CA 1 82 LEU C -122.90 -62.90 -96.88 -92.94 -93.95 . . 0 "[ . 1 . 2]"
159 PSI 1 82 LEU N 1 82 LEU CA 1 82 LEU C 1 83 GLY N -30.00 30.00 7.57 9.58 7.24 . . 0 "[ . 1 . 2]"
160 PHI 1 90 HIS C 1 91 ALA N 1 91 ALA CA 1 91 ALA C -101.00 -41.00 -87.97 -95.99 -100.93 0.55 14 0 "[ . 1 . 2]"
161 PSI 1 91 ALA N 1 91 ALA CA 1 91 ALA C 1 92 GLU N 98.50 -160.00 148.60 144.58 135.05 . . 0 "[ . 1 . 2]"
162 PHI 1 110 MET C 1 111 LEU N 1 111 LEU CA 1 111 LEU C -142.60 -42.60 -84.69 -83.52 -84.55 . . 0 "[ . 1 . 2]"
163 PSI 1 111 LEU N 1 111 LEU CA 1 111 LEU C 1 112 SER N 63.50 -176.20 74.83 63.94 63.54 0.36 10 0 "[ . 1 . 2]"
164 CHI1 1 3 THR N 1 3 THR CA 1 3 THR CB 1 3 THR OG1 42.80 80.40 68.18 70.46 70.02 . . 0 "[ . 1 . 2]"
165 CHI1 1 5 THR N 1 5 THR CA 1 5 THR CB 1 5 THR OG1 36.70 103.90 61.80 69.68 67.53 . . 0 "[ . 1 . 2]"
166 CHI1 1 14 VAL N 1 14 VAL CA 1 14 VAL CB 1 14 VAL CG1 168.20 -163.00 177.16 177.94 177.61 . . 0 "[ . 1 . 2]"
167 CHI1 1 16 VAL N 1 16 VAL CA 1 16 VAL CB 1 16 VAL CG1 164.00 -147.60 179.34 179.87 179.66 . . 0 "[ . 1 . 2]"
168 CHI1 1 20 VAL N 1 20 VAL CA 1 20 VAL CB 1 20 VAL CG1 163.20 -163.20 -178.42 176.83 -172.05 . . 0 "[ . 1 . 2]"
169 CHI1 1 28 VAL N 1 28 VAL CA 1 28 VAL CB 1 28 VAL CG1 170.10 -159.90 178.16 174.23 -179.06 . . 0 "[ . 1 . 2]"
170 CHI1 1 30 VAL N 1 30 VAL CA 1 30 VAL CB 1 30 VAL CG1 174.70 -160.90 -178.40 178.21 176.99 . . 0 "[ . 1 . 2]"
171 CHI1 1 32 VAL N 1 32 VAL CA 1 32 VAL CB 1 32 VAL CG1 159.40 -147.00 -169.04 -171.60 -167.18 . . 0 "[ . 1 . 2]"
172 CHI1 1 40 THR N 1 40 THR CA 1 40 THR CB 1 40 THR OG1 36.40 78.80 76.34 74.06 77.43 . . 0 "[ . 1 . 2]"
173 CHI1 1 49 THR N 1 49 THR CA 1 49 THR CB 1 49 THR OG1 43.80 71.40 68.89 68.73 68.49 1.33 17 0 "[ . 1 . 2]"
174 CHI1 1 59 THR N 1 59 THR CA 1 59 THR CB 1 59 THR OG1 45.50 80.30 63.72 61.37 59.26 . . 0 "[ . 1 . 2]"
175 CHI1 1 60 THR N 1 60 THR CA 1 60 THR CB 1 60 THR OG1 51.30 81.30 51.95 50.87 61.33 0.43 14 0 "[ . 1 . 2]"
176 CHI1 1 65 VAL N 1 65 VAL CA 1 65 VAL CB 1 65 VAL CG1 -66.80 -50.80 -67.21 -68.18 -66.84 1.38 15 0 "[ . 1 . 2]"
177 CHI1 1 68 ILE N 1 68 ILE CA 1 68 ILE CB 1 68 ILE CG1 -75.10 -41.10 -51.61 -59.03 -47.10 . . 0 "[ . 1 . 2]"
178 CHI1 1 71 VAL N 1 71 VAL CA 1 71 VAL CB 1 71 VAL CG1 171.70 -164.30 177.82 178.37 178.06 . . 0 "[ . 1 . 2]"
179 CHI1 1 73 ILE N 1 73 ILE CA 1 73 ILE CB 1 73 ILE CG1 -70.70 -50.70 -58.64 -62.55 -50.42 0.28 19 0 "[ . 1 . 2]"
180 CHI1 1 84 ILE N 1 84 ILE CA 1 84 ILE CB 1 84 ILE CG1 -74.90 -46.50 -46.00 -48.08 -44.79 1.71 19 0 "[ . 1 . 2]"
181 CHI1 1 93 VAL N 1 93 VAL CA 1 93 VAL CB 1 93 VAL CG1 166.60 -159.80 -178.24 177.30 -171.30 . . 0 "[ . 1 . 2]"
182 CHI1 1 94 VAL N 1 94 VAL CA 1 94 VAL CB 1 94 VAL CG1 173.20 -165.60 -178.63 178.97 178.57 . . 0 "[ . 1 . 2]"
183 CHI1 1 106 THR N 1 106 THR CA 1 106 THR CB 1 106 THR OG1 -72.50 -40.10 -59.49 -60.08 -60.13 . . 0 "[ . 1 . 2]"
184 CHI1 1 107 ILE N 1 107 ILE CA 1 107 ILE CB 1 107 ILE CG1 -74.90 -41.70 -63.87 -62.89 -63.27 . . 0 "[ . 1 . 2]"
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