NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
582643 |
2mpl   |
19988 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2mpl
save_dihedral_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 209
_TA_constraint_stats_list.Viol_total 2478.72
_TA_constraint_stats_list.Viol_max 3.05
_TA_constraint_stats_list.Viol_rms 0.19
_TA_constraint_stats_list.Viol_average_all_restraints 0.03
_TA_constraint_stats_list.Viol_average_violations_only 0.59
_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 . 1 4 GLY C 1 5 PRO N 1 5 PRO CA 1 5 PRO C -89.70 -29.70 -76.70 -55.41 -70.65 . . 0 "[ . 1 . 2]"
2 . 1 5 PRO N 1 5 PRO CA 1 5 PRO C 1 6 GLU N 115.50 175.50 157.96 115.47 175.65 0.15 19 0 "[ . 1 . 2]"
3 . 1 5 PRO C 1 6 GLU N 1 6 GLU CA 1 6 GLU C -80.90 -20.90 -77.57 -72.32 -74.68 1.09 6 0 "[ . 1 . 2]"
4 . 1 6 GLU N 1 6 GLU CA 1 6 GLU C 1 7 GLU N -70.40 -1.00 -11.86 -3.97 -7.95 0.96 18 0 "[ . 1 . 2]"
5 . 1 6 GLU C 1 7 GLU N 1 7 GLU CA 1 7 GLU C -124.00 -47.40 -78.75 -81.04 -82.44 . . 0 "[ . 1 . 2]"
6 . 1 7 GLU N 1 7 GLU CA 1 7 GLU C 1 8 LEU N -51.50 17.90 -18.04 -18.70 -19.98 . . 0 "[ . 1 . 2]"
7 . 1 7 GLU C 1 8 LEU N 1 8 LEU CA 1 8 LEU C -160.80 -91.00 -111.21 -121.80 -94.37 . . 0 "[ . 1 . 2]"
8 . 1 8 LEU N 1 8 LEU CA 1 8 LEU C 1 9 GLU N 117.30 -164.10 157.79 164.50 162.69 . . 0 "[ . 1 . 2]"
9 . 1 8 LEU C 1 9 GLU N 1 9 GLU CA 1 9 GLU C -168.40 -108.40 -140.88 -156.83 -113.57 . . 0 "[ . 1 . 2]"
10 . 1 9 GLU N 1 9 GLU CA 1 9 GLU C 1 10 LEU N 116.50 176.50 134.98 139.48 136.87 . . 0 "[ . 1 . 2]"
11 . 1 9 GLU C 1 10 LEU N 1 10 LEU CA 1 10 LEU C -149.90 -78.30 -94.11 -90.32 -93.02 . . 0 "[ . 1 . 2]"
12 . 1 10 LEU N 1 10 LEU CA 1 10 LEU C 1 11 ALA N 95.70 155.70 111.76 116.77 114.99 0.84 10 0 "[ . 1 . 2]"
13 . 1 10 LEU C 1 11 ALA N 1 11 ALA CA 1 11 ALA C -147.90 -69.10 -113.70 -105.70 -108.11 . . 0 "[ . 1 . 2]"
14 . 1 11 ALA N 1 11 ALA CA 1 11 ALA C 1 12 LEU N 98.80 158.80 138.88 137.37 135.75 . . 0 "[ . 1 . 2]"
15 . 1 11 ALA C 1 12 LEU N 1 12 LEU CA 1 12 LEU C -139.20 -79.20 -100.67 -99.77 -100.78 . . 0 "[ . 1 . 2]"
16 . 1 12 LEU N 1 12 LEU CA 1 12 LEU C 1 13 GLN N 98.70 158.70 108.83 103.55 101.94 1.00 14 0 "[ . 1 . 2]"
17 . 1 12 LEU C 1 13 GLN N 1 13 GLN CA 1 13 GLN C -166.60 -106.60 -111.22 -106.43 -109.44 1.60 11 0 "[ . 1 . 2]"
18 . 1 13 GLN N 1 13 GLN CA 1 13 GLN C 1 14 ASP N 94.30 154.30 107.53 92.23 132.88 2.07 16 0 "[ . 1 . 2]"
19 . 1 13 GLN C 1 14 ASP N 1 14 ASP CA 1 14 ASP C 22.00 82.00 63.22 36.16 73.60 . . 0 "[ . 1 . 2]"
20 . 1 14 ASP N 1 14 ASP CA 1 14 ASP C 1 15 GLY N 13.00 73.00 25.25 18.40 13.78 0.65 15 0 "[ . 1 . 2]"
21 . 1 14 ASP C 1 15 GLY N 1 15 GLY CA 1 15 GLY C 49.30 109.30 95.81 80.39 109.78 0.48 8 0 "[ . 1 . 2]"
22 . 1 15 GLY N 1 15 GLY CA 1 15 GLY C 1 16 GLN N -27.90 32.10 -3.84 -4.35 -6.82 . . 0 "[ . 1 . 2]"
23 . 1 15 GLY C 1 16 GLN N 1 16 GLN CA 1 16 GLN C -142.50 -82.50 -96.15 -82.35 -85.21 1.11 12 0 "[ . 1 . 2]"
24 . 1 16 GLN N 1 16 GLN CA 1 16 GLN C 1 17 ARG N 109.90 -177.50 138.10 118.89 174.90 . . 0 "[ . 1 . 2]"
25 . 1 16 GLN C 1 17 ARG N 1 17 ARG CA 1 17 ARG C -119.00 -59.00 -82.04 -84.68 -86.59 . . 0 "[ . 1 . 2]"
26 . 1 17 ARG N 1 17 ARG CA 1 17 ARG C 1 18 CYS N 96.70 156.70 112.52 95.92 136.55 0.78 12 0 "[ . 1 . 2]"
27 . 1 17 ARG C 1 18 CYS N 1 18 CYS CA 1 18 CYS C -172.00 -111.20 -123.54 -147.18 -110.14 1.06 19 0 "[ . 1 . 2]"
28 . 1 18 CYS N 1 18 CYS CA 1 18 CYS C 1 19 VAL N 121.70 -162.90 140.40 127.84 122.93 0.33 11 0 "[ . 1 . 2]"
29 . 1 18 CYS C 1 19 VAL N 1 19 VAL CA 1 19 VAL C -144.30 -74.70 -102.02 -123.95 -84.68 . . 0 "[ . 1 . 2]"
30 . 1 19 VAL N 1 19 VAL CA 1 19 VAL C 1 20 ARG N 95.30 155.30 115.15 105.90 100.69 . . 0 "[ . 1 . 2]"
31 . 1 19 VAL C 1 20 ARG N 1 20 ARG CA 1 20 ARG C -156.30 -90.70 -121.84 -142.40 -103.50 . . 0 "[ . 1 . 2]"
32 . 1 20 ARG N 1 20 ARG CA 1 20 ARG C 1 21 ALA N 115.30 175.30 153.26 140.82 168.98 . . 0 "[ . 1 . 2]"
33 . 1 20 ARG C 1 21 ALA N 1 21 ALA CA 1 21 ALA C -114.80 -54.80 -80.90 -97.77 -69.84 . . 0 "[ . 1 . 2]"
34 . 1 21 ALA N 1 21 ALA CA 1 21 ALA C 1 22 ARG N 94.10 157.10 121.74 109.10 140.35 . . 0 "[ . 1 . 2]"
35 . 1 21 ALA C 1 22 ARG N 1 22 ARG CA 1 22 ARG C -126.00 -51.00 -79.52 -81.71 -83.04 . . 0 "[ . 1 . 2]"
36 . 1 22 ARG N 1 22 ARG CA 1 22 ARG C 1 23 LEU N -79.30 28.70 -41.17 -26.57 -32.35 . . 0 "[ . 1 . 2]"
37 . 1 22 ARG C 1 23 LEU N 1 23 LEU CA 1 23 LEU C 161.90 -77.10 -110.85 -135.95 -89.13 . . 0 "[ . 1 . 2]"
38 . 1 23 LEU N 1 23 LEU CA 1 23 LEU C 1 24 SER N 114.60 -153.60 158.82 129.19 -179.52 . . 0 "[ . 1 . 2]"
39 . 1 23 LEU C 1 24 SER N 1 24 SER CA 1 24 SER C -158.20 -24.40 -75.90 -83.22 -88.71 . . 0 "[ . 1 . 2]"
40 . 1 24 SER N 1 24 SER CA 1 24 SER C 1 25 LEU N 93.90 153.90 114.70 122.19 118.17 . . 0 "[ . 1 . 2]"
41 . 1 24 SER C 1 25 LEU N 1 25 LEU CA 1 25 LEU C -148.40 -70.40 -80.37 -97.99 -69.93 0.47 13 0 "[ . 1 . 2]"
42 . 1 25 LEU N 1 25 LEU CA 1 25 LEU C 1 26 THR N 81.90 -167.30 121.38 121.99 117.85 . . 0 "[ . 1 . 2]"
43 . 1 25 LEU C 1 26 THR N 1 26 THR CA 1 26 THR C -172.00 -62.00 -94.69 -127.19 -72.24 . . 0 "[ . 1 . 2]"
44 . 1 26 THR N 1 26 THR CA 1 26 THR C 1 27 GLU N 134.10 -165.90 152.78 154.05 151.39 . . 0 "[ . 1 . 2]"
45 . 1 26 THR C 1 27 GLU N 1 27 GLU CA 1 27 GLU C -84.30 -24.30 -64.18 -72.38 -55.05 . . 0 "[ . 1 . 2]"
46 . 1 27 GLU N 1 27 GLU CA 1 27 GLU C 1 28 GLY N 104.10 164.10 130.17 117.03 149.39 . . 0 "[ . 1 . 2]"
47 . 1 27 GLU C 1 28 GLY N 1 28 GLY CA 1 28 GLY C 63.00 123.00 105.33 113.21 112.77 0.12 20 0 "[ . 1 . 2]"
48 . 1 28 GLY N 1 28 GLY CA 1 28 GLY C 1 29 LEU N -45.00 15.00 -16.32 -20.24 -21.82 . . 0 "[ . 1 . 2]"
49 . 1 28 GLY C 1 29 LEU N 1 29 LEU CA 1 29 LEU C -109.80 -41.40 -73.71 -68.26 -69.87 . . 0 "[ . 1 . 2]"
50 . 1 29 LEU N 1 29 LEU CA 1 29 LEU C 1 30 SER N 108.80 168.80 130.76 117.02 146.33 . . 0 "[ . 1 . 2]"
51 . 1 29 LEU C 1 30 SER N 1 30 SER CA 1 30 SER C -167.40 -103.80 -137.05 -139.78 -142.55 . . 0 "[ . 1 . 2]"
52 . 1 30 SER N 1 30 SER CA 1 30 SER C 1 31 TRP N 129.50 -170.50 153.55 138.54 171.53 . . 0 "[ . 1 . 2]"
53 . 1 30 SER C 1 31 TRP N 1 31 TRP CA 1 31 TRP C -174.40 -92.20 -98.90 -105.40 -107.71 0.71 10 0 "[ . 1 . 2]"
54 . 1 31 TRP N 1 31 TRP CA 1 31 TRP C 1 32 GLY N 110.20 174.60 172.35 170.95 169.92 1.63 16 0 "[ . 1 . 2]"
55 . 1 31 TRP C 1 32 GLY N 1 32 GLY CA 1 32 GLY C 110.80 -23.80 -75.03 -74.90 -75.97 . . 0 "[ . 1 . 2]"
56 . 1 32 GLY N 1 32 GLY CA 1 32 GLY C 1 33 PRO N 45.10 -156.30 175.89 150.67 -165.66 . . 0 "[ . 1 . 2]"
57 . 1 32 GLY C 1 33 PRO N 1 33 PRO CA 1 33 PRO C -103.00 -43.00 -69.24 -59.33 -63.65 . . 0 "[ . 1 . 2]"
58 . 1 33 PRO N 1 33 PRO CA 1 33 PRO C 1 34 PHE N 123.80 -176.20 128.41 123.19 144.56 0.61 13 0 "[ . 1 . 2]"
59 . 1 33 PRO C 1 34 PHE N 1 34 PHE CA 1 34 PHE C -144.10 -75.50 -103.14 -110.39 -114.00 . . 0 "[ . 1 . 2]"
60 . 1 34 PHE N 1 34 PHE CA 1 34 PHE C 1 35 TYR N 108.70 173.70 154.91 168.55 162.52 0.04 9 0 "[ . 1 . 2]"
61 . 1 34 PHE C 1 35 TYR N 1 35 TYR CA 1 35 TYR C -131.70 -31.50 -100.37 -122.06 -83.86 . . 0 "[ . 1 . 2]"
62 . 1 35 TYR N 1 35 TYR CA 1 35 TYR C 1 36 GLY N 96.50 -175.90 118.20 139.05 135.58 0.55 10 0 "[ . 1 . 2]"
63 . 1 36 GLY C 1 37 SER N 1 37 SER CA 1 37 SER C -174.00 -66.00 -142.42 -161.25 -121.38 . . 0 "[ . 1 . 2]"
64 . 1 37 SER N 1 37 SER CA 1 37 SER C 1 38 ILE N 117.80 -165.20 145.25 126.12 167.84 . . 0 "[ . 1 . 2]"
65 . 1 37 SER C 1 38 ILE N 1 38 ILE CA 1 38 ILE C -148.00 -85.00 -111.31 -144.39 -84.60 0.40 19 0 "[ . 1 . 2]"
66 . 1 38 ILE N 1 38 ILE CA 1 38 ILE C 1 39 GLN N 96.10 156.10 115.98 95.52 147.51 0.58 13 0 "[ . 1 . 2]"
67 . 1 38 ILE C 1 39 GLN N 1 39 GLN CA 1 39 GLN C -147.70 -72.90 -94.36 -149.47 -72.07 1.77 2 0 "[ . 1 . 2]"
68 . 1 39 GLN N 1 39 GLN CA 1 39 GLN C 1 40 THR N 98.80 165.00 106.40 97.37 142.62 1.43 2 0 "[ . 1 . 2]"
69 . 1 39 GLN C 1 40 THR N 1 40 THR CA 1 40 THR C -148.90 -62.90 -83.95 -135.36 -61.20 1.70 3 0 "[ . 1 . 2]"
70 . 1 40 THR N 1 40 THR CA 1 40 THR C 1 41 ARG N 85.60 162.00 130.82 162.41 155.77 1.23 2 0 "[ . 1 . 2]"
71 . 1 43 LEU C 1 44 SER N 1 44 SER CA 1 44 SER C -128.00 -44.00 -93.13 -100.81 -100.96 . . 0 "[ . 1 . 2]"
72 . 1 44 SER N 1 44 SER CA 1 44 SER C 1 45 PRO N 108.00 176.00 118.34 105.38 162.86 2.62 12 0 "[ . 1 . 2]"
73 . 1 45 PRO C 1 46 GLU N 1 46 GLU CA 1 46 GLU C -111.10 -43.50 -91.25 -60.99 -69.39 1.53 4 0 "[ . 1 . 2]"
74 . 1 46 GLU N 1 46 GLU CA 1 46 GLU C 1 47 ARG N -44.90 19.90 -18.71 -46.73 20.38 1.83 8 0 "[ . 1 . 2]"
75 . 1 50 PRO C 1 51 GLY N 1 51 GLY CA 1 51 GLY C 80.70 -3.90 178.76 79.32 -64.58 1.38 9 0 "[ . 1 . 2]"
76 . 1 51 GLY N 1 51 GLY CA 1 51 GLY C 1 52 PRO N 47.90 -113.50 -161.17 83.59 -111.39 2.11 12 0 "[ . 1 . 2]"
77 . 1 52 PRO C 1 53 ALA N 1 53 ALA CA 1 53 ALA C -120.20 -60.20 -80.49 -104.11 -60.02 0.18 11 0 "[ . 1 . 2]"
78 . 1 53 ALA N 1 53 ALA CA 1 53 ALA C 1 54 VAL N -49.80 10.20 -29.40 -30.39 -32.37 0.14 6 0 "[ . 1 . 2]"
79 . 1 53 ALA C 1 54 VAL N 1 54 VAL CA 1 54 VAL C 177.80 -76.20 -98.13 -91.22 -101.71 1.28 15 0 "[ . 1 . 2]"
80 . 1 54 VAL N 1 54 VAL CA 1 54 VAL C 1 55 THR N 118.30 178.30 124.28 116.91 116.61 1.69 1 0 "[ . 1 . 2]"
81 . 1 54 VAL C 1 55 THR N 1 55 THR CA 1 55 THR C -165.50 -82.30 -132.47 -134.32 -140.66 . . 0 "[ . 1 . 2]"
82 . 1 55 THR N 1 55 THR CA 1 55 THR C 1 56 LEU N 103.10 179.10 154.22 179.62 172.92 3.05 2 0 "[ . 1 . 2]"
83 . 1 55 THR C 1 56 LEU N 1 56 LEU CA 1 56 LEU C -165.00 -63.20 -87.05 -90.05 -97.48 0.13 14 0 "[ . 1 . 2]"
84 . 1 56 LEU N 1 56 LEU CA 1 56 LEU C 1 57 MET N 91.90 151.90 125.02 134.14 131.92 0.42 15 0 "[ . 1 . 2]"
85 . 1 56 LEU C 1 57 MET N 1 57 MET CA 1 57 MET C -123.20 -63.20 -100.44 -97.17 -101.56 0.40 7 0 "[ . 1 . 2]"
86 . 1 57 MET N 1 57 MET CA 1 57 MET C 1 58 VAL N 69.60 176.80 89.36 92.94 90.91 . . 0 "[ . 1 . 2]"
87 . 1 57 MET C 1 58 VAL N 1 58 VAL CA 1 58 VAL C -176.20 -77.60 -127.27 -139.25 -105.04 . . 0 "[ . 1 . 2]"
88 . 1 58 VAL N 1 58 VAL CA 1 58 VAL C 1 59 ASP N 132.60 -167.40 170.58 150.36 -174.40 . . 0 "[ . 1 . 2]"
89 . 1 58 VAL C 1 59 ASP N 1 59 ASP CA 1 59 ASP C -102.30 -42.30 -66.33 -85.78 -49.37 . . 0 "[ . 1 . 2]"
90 . 1 59 ASP N 1 59 ASP CA 1 59 ASP C 1 60 GLU N 122.30 -177.70 151.78 168.74 160.38 . . 0 "[ . 1 . 2]"
91 . 1 59 ASP C 1 60 GLU N 1 60 GLU CA 1 60 GLU C -85.80 -25.80 -59.68 -78.90 -50.43 . . 0 "[ . 1 . 2]"
92 . 1 60 GLU N 1 60 GLU CA 1 60 GLU C 1 61 SER N -63.10 -3.10 -27.49 -10.07 -14.40 . . 0 "[ . 1 . 2]"
93 . 1 60 GLU C 1 61 SER N 1 61 SER CA 1 61 SER C -121.20 -61.20 -92.86 -90.04 -91.98 . . 0 "[ . 1 . 2]"
94 . 1 61 SER N 1 61 SER CA 1 61 SER C 1 62 CYS N -33.10 26.90 -0.85 -9.37 -11.96 . . 0 "[ . 1 . 2]"
95 . 1 61 SER C 1 62 CYS N 1 62 CYS CA 1 62 CYS C -108.80 -48.80 -78.75 -109.09 -64.66 0.29 2 0 "[ . 1 . 2]"
96 . 1 62 CYS N 1 62 CYS CA 1 62 CYS C 1 63 TRP N 87.50 155.10 121.00 96.71 137.31 . . 0 "[ . 1 . 2]"
97 . 1 62 CYS C 1 63 TRP N 1 63 TRP CA 1 63 TRP C -91.00 -31.00 -57.97 -70.04 -44.83 . . 0 "[ . 1 . 2]"
98 . 1 63 TRP N 1 63 TRP CA 1 63 TRP C 1 64 LEU N -52.00 8.00 -24.09 -14.44 -17.79 . . 0 "[ . 1 . 2]"
99 . 1 63 TRP C 1 64 LEU N 1 64 LEU CA 1 64 LEU C -97.40 -37.40 -59.51 -63.45 -52.80 . . 0 "[ . 1 . 2]"
100 . 1 64 LEU N 1 64 LEU CA 1 64 LEU C 1 65 ARG N -64.30 -4.30 -31.20 -25.70 -28.16 . . 0 "[ . 1 . 2]"
101 . 1 64 LEU C 1 65 ARG N 1 65 ARG CA 1 65 ARG C -96.10 -36.10 -91.81 -87.95 -93.05 1.21 6 0 "[ . 1 . 2]"
102 . 1 65 ARG N 1 65 ARG CA 1 65 ARG C 1 66 MET N -57.70 2.30 -1.50 -10.33 3.17 0.87 13 0 "[ . 1 . 2]"
103 . 1 65 ARG C 1 66 MET N 1 66 MET CA 1 66 MET C -125.70 -59.50 -94.98 -89.86 -91.55 . . 0 "[ . 1 . 2]"
104 . 1 66 MET N 1 66 MET CA 1 66 MET C 1 67 LEU N -52.20 38.60 -9.17 -16.27 -20.09 . . 0 "[ . 1 . 2]"
105 . 1 66 MET C 1 67 LEU N 1 67 LEU CA 1 67 LEU C -155.40 -64.60 -87.23 -83.99 -85.43 . . 0 "[ . 1 . 2]"
106 . 1 67 LEU N 1 67 LEU CA 1 67 LEU C 1 68 PRO N 58.30 -175.90 146.59 133.68 155.18 . . 0 "[ . 1 . 2]"
107 . 1 67 LEU C 1 68 PRO N 1 68 PRO CA 1 68 PRO C -101.50 -41.50 -67.97 -74.44 -60.05 . . 0 "[ . 1 . 2]"
108 . 1 68 PRO N 1 68 PRO CA 1 68 PRO C 1 69 GLN N 118.60 178.60 127.23 142.53 134.61 0.52 18 0 "[ . 1 . 2]"
109 . 1 69 GLN C 1 70 VAL N 1 70 VAL CA 1 70 VAL C -165.80 -83.40 -127.68 -115.69 -120.21 . . 0 "[ . 1 . 2]"
110 . 1 70 VAL N 1 70 VAL CA 1 70 VAL C 1 71 LEU N 123.40 -169.60 152.75 160.68 158.24 . . 0 "[ . 1 . 2]"
111 . 1 70 VAL C 1 71 LEU N 1 71 LEU CA 1 71 LEU C -156.60 -49.40 -98.06 -77.54 -83.68 . . 0 "[ . 1 . 2]"
112 . 1 71 LEU N 1 71 LEU CA 1 71 LEU C 1 72 THR N -53.50 37.90 -17.66 -46.14 1.07 . . 0 "[ . 1 . 2]"
113 . 1 71 LEU C 1 72 THR N 1 72 THR CA 1 72 THR C 172.80 -86.60 -95.47 -115.03 -85.80 0.80 12 0 "[ . 1 . 2]"
114 . 1 72 THR N 1 72 THR CA 1 72 THR C 1 73 GLU N 135.20 -164.80 144.73 173.01 169.03 1.34 12 0 "[ . 1 . 2]"
115 . 1 72 THR C 1 73 GLU N 1 73 GLU CA 1 73 GLU C -95.30 -35.30 -82.14 -89.09 -94.27 0.42 10 0 "[ . 1 . 2]"
116 . 1 73 GLU N 1 73 GLU CA 1 73 GLU C 1 74 GLU N -66.00 -6.00 -21.42 -23.68 -27.09 0.70 17 0 "[ . 1 . 2]"
117 . 1 73 GLU C 1 74 GLU N 1 74 GLU CA 1 74 GLU C -98.70 -38.70 -70.12 -80.90 -51.80 . . 0 "[ . 1 . 2]"
118 . 1 74 GLU N 1 74 GLU CA 1 74 GLU C 1 75 ALA N -53.50 6.50 -31.46 -36.19 -38.83 . . 0 "[ . 1 . 2]"
119 . 1 74 GLU C 1 75 ALA N 1 75 ALA CA 1 75 ALA C -124.70 -64.70 -87.71 -100.04 -65.64 . . 0 "[ . 1 . 2]"
120 . 1 75 ALA N 1 75 ALA CA 1 75 ALA C 1 76 ALA N -38.40 24.60 -24.68 -0.74 -10.98 0.24 9 0 "[ . 1 . 2]"
121 . 1 77 ASN C 1 78 SER N 1 78 SER CA 1 78 SER C 177.30 -78.30 -141.83 -149.36 -150.42 . . 0 "[ . 1 . 2]"
122 . 1 78 SER N 1 78 SER CA 1 78 SER C 1 79 GLU N 119.30 -174.70 136.36 124.36 146.58 . . 0 "[ . 1 . 2]"
123 . 1 78 SER C 1 79 GLU N 1 79 GLU CA 1 79 GLU C -171.30 -87.30 -120.85 -116.72 -118.92 . . 0 "[ . 1 . 2]"
124 . 1 79 GLU N 1 79 GLU CA 1 79 GLU C 1 80 ILE N 115.50 -171.70 144.54 123.29 155.50 . . 0 "[ . 1 . 2]"
125 . 1 79 GLU C 1 80 ILE N 1 80 ILE CA 1 80 ILE C -157.60 -97.60 -109.84 -118.28 -102.03 . . 0 "[ . 1 . 2]"
126 . 1 80 ILE N 1 80 ILE CA 1 80 ILE C 1 81 TYR N 115.20 175.20 122.50 114.35 137.13 0.85 8 0 "[ . 1 . 2]"
127 . 1 80 ILE C 1 81 TYR N 1 81 TYR CA 1 81 TYR C -179.10 -104.50 -129.43 -132.10 -133.72 . . 0 "[ . 1 . 2]"
128 . 1 81 TYR N 1 81 TYR CA 1 81 TYR C 1 82 ARG N 130.10 -169.90 160.59 175.60 169.52 . . 0 "[ . 1 . 2]"
129 . 1 81 TYR C 1 82 ARG N 1 82 ARG CA 1 82 ARG C -149.50 -83.10 -102.63 -127.12 -88.11 . . 0 "[ . 1 . 2]"
130 . 1 82 ARG N 1 82 ARG CA 1 82 ARG C 1 83 LYS N 91.70 151.70 137.02 123.71 146.13 . . 0 "[ . 1 . 2]"
131 . 1 82 ARG C 1 83 LYS N 1 83 LYS CA 1 83 LYS C 172.80 -71.40 -145.80 -138.22 -140.15 . . 0 "[ . 1 . 2]"
132 . 1 83 LYS N 1 83 LYS CA 1 83 LYS C 1 84 ASP N 96.50 156.50 120.54 125.55 122.66 0.77 17 0 "[ . 1 . 2]"
133 . 1 83 LYS C 1 84 ASP N 1 84 ASP CA 1 84 ASP C 23.00 83.00 62.49 58.72 57.38 . . 0 "[ . 1 . 2]"
134 . 1 84 ASP N 1 84 ASP CA 1 84 ASP C 1 85 ASP N 12.00 72.00 36.34 16.60 72.51 0.51 9 0 "[ . 1 . 2]"
135 . 1 85 ASP C 1 86 ALA N 1 86 ALA CA 1 86 ALA C 174.10 -80.50 -114.58 -104.70 -109.08 . . 0 "[ . 1 . 2]"
136 . 1 86 ALA N 1 86 ALA CA 1 86 ALA C 1 87 LEU N 124.90 -175.10 157.97 147.87 172.92 . . 0 "[ . 1 . 2]"
137 . 1 86 ALA C 1 87 LEU N 1 87 LEU CA 1 87 LEU C -167.10 -93.90 -97.45 -94.42 -96.17 0.57 15 0 "[ . 1 . 2]"
138 . 1 87 LEU N 1 87 LEU CA 1 87 LEU C 1 88 TRP N 117.70 177.70 133.40 139.12 137.85 . . 0 "[ . 1 . 2]"
139 . 1 87 LEU C 1 88 TRP N 1 88 TRP CA 1 88 TRP C -168.30 -105.30 -124.27 -134.00 -116.28 . . 0 "[ . 1 . 2]"
140 . 1 88 TRP N 1 88 TRP CA 1 88 TRP C 1 89 CYS N 118.30 -168.10 138.99 149.20 145.01 . . 0 "[ . 1 . 2]"
141 . 1 88 TRP C 1 89 CYS N 1 89 CYS CA 1 89 CYS C -146.00 -86.00 -113.77 -135.46 -93.67 . . 0 "[ . 1 . 2]"
142 . 1 89 CYS N 1 89 CYS CA 1 89 CYS C 1 90 ARG N 104.10 164.10 121.68 110.96 130.92 . . 0 "[ . 1 . 2]"
143 . 1 89 CYS C 1 90 ARG N 1 90 ARG CA 1 90 ARG C -150.20 -90.20 -118.28 -120.00 -121.60 . . 0 "[ . 1 . 2]"
144 . 1 90 ARG N 1 90 ARG CA 1 90 ARG C 1 91 VAL N 103.60 163.60 143.37 131.63 150.30 . . 0 "[ . 1 . 2]"
145 . 1 90 ARG C 1 91 VAL N 1 91 VAL CA 1 91 VAL C -117.70 -52.90 -87.74 -98.06 -78.44 . . 0 "[ . 1 . 2]"
146 . 1 91 VAL N 1 91 VAL CA 1 91 VAL C 1 92 THR N 99.90 159.90 118.23 100.41 132.46 . . 0 "[ . 1 . 2]"
147 . 1 91 VAL C 1 92 THR N 1 92 THR CA 1 92 THR C -132.60 -72.60 -95.30 -94.22 -95.81 . . 0 "[ . 1 . 2]"
148 . 1 92 THR N 1 92 THR CA 1 92 THR C 1 93 LYS N -47.10 12.90 -29.41 -47.57 3.19 0.47 8 0 "[ . 1 . 2]"
149 . 1 92 THR C 1 93 LYS N 1 93 LYS CA 1 93 LYS C -167.30 -102.90 -130.08 -113.90 -119.49 . . 0 "[ . 1 . 2]"
150 . 1 93 LYS N 1 93 LYS CA 1 93 LYS C 1 94 VAL N 132.30 -167.70 151.27 169.92 161.69 . . 0 "[ . 1 . 2]"
151 . 1 93 LYS C 1 94 VAL N 1 94 VAL CA 1 94 VAL C -121.00 -54.60 -74.11 -98.55 -57.01 . . 0 "[ . 1 . 2]"
152 . 1 94 VAL N 1 94 VAL CA 1 94 VAL C 1 95 VAL N 98.70 158.70 116.96 98.23 131.46 0.47 7 0 "[ . 1 . 2]"
153 . 1 94 VAL C 1 95 VAL N 1 95 VAL CA 1 95 VAL C -147.10 -86.50 -106.25 -126.64 -85.56 0.94 11 0 "[ . 1 . 2]"
154 . 1 95 VAL N 1 95 VAL CA 1 95 VAL C 1 96 PRO N 93.40 171.00 120.30 108.80 128.14 . . 0 "[ . 1 . 2]"
155 . 1 95 VAL C 1 96 PRO N 1 96 PRO CA 1 96 PRO C -89.20 -29.20 -70.51 -82.95 -60.15 . . 0 "[ . 1 . 2]"
156 . 1 96 PRO N 1 96 PRO CA 1 96 PRO C 1 97 SER N 116.70 176.70 159.49 158.25 153.60 0.23 2 0 "[ . 1 . 2]"
157 . 1 97 SER C 1 98 GLY N 1 98 GLY CA 1 98 GLY C 62.00 122.00 103.44 103.81 101.89 0.20 5 0 "[ . 1 . 2]"
158 . 1 98 GLY N 1 98 GLY CA 1 98 GLY C 1 99 GLY N -43.40 16.60 -10.32 -8.14 -13.78 0.20 14 0 "[ . 1 . 2]"
159 . 1 98 GLY C 1 99 GLY N 1 99 GLY CA 1 99 GLY C 144.40 70.80 -84.46 -75.66 -76.84 . . 0 "[ . 1 . 2]"
160 . 1 99 GLY N 1 99 GLY CA 1 99 GLY C 1 100 LEU N 105.00 -144.40 154.87 138.58 171.84 . . 0 "[ . 1 . 2]"
161 . 1 99 GLY C 1 100 LEU N 1 100 LEU CA 1 100 LEU C 127.20 33.60 -94.71 -105.34 -88.76 . . 0 "[ . 1 . 2]"
162 . 1 100 LEU N 1 100 LEU CA 1 100 LEU C 1 101 LEU N 62.70 -173.50 147.36 120.39 168.24 . . 0 "[ . 1 . 2]"
163 . 1 100 LEU C 1 101 LEU N 1 101 LEU CA 1 101 LEU C -175.80 -43.20 -116.19 -127.81 -132.80 . . 0 "[ . 1 . 2]"
164 . 1 101 LEU N 1 101 LEU CA 1 101 LEU C 1 102 TYR N 86.60 -167.00 150.25 136.49 164.38 . . 0 "[ . 1 . 2]"
165 . 1 101 LEU C 1 102 TYR N 1 102 TYR CA 1 102 TYR C -156.10 -96.10 -120.41 -136.03 -106.46 . . 0 "[ . 1 . 2]"
166 . 1 102 TYR N 1 102 TYR CA 1 102 TYR C 1 103 VAL N 102.20 162.20 145.52 126.82 158.74 . . 0 "[ . 1 . 2]"
167 . 1 102 TYR C 1 103 VAL N 1 103 VAL CA 1 103 VAL C -157.40 -97.40 -101.19 -104.80 -106.99 0.80 9 0 "[ . 1 . 2]"
168 . 1 103 VAL N 1 103 VAL CA 1 103 VAL C 1 104 ARG N 105.20 165.20 128.52 129.07 128.54 . . 0 "[ . 1 . 2]"
169 . 1 103 VAL C 1 104 ARG N 1 104 ARG CA 1 104 ARG C -144.60 -84.60 -104.98 -119.28 -93.06 . . 0 "[ . 1 . 2]"
170 . 1 104 ARG N 1 104 ARG CA 1 104 ARG C 1 105 LEU N 98.90 158.90 131.25 108.07 147.76 . . 0 "[ . 1 . 2]"
171 . 1 104 ARG C 1 105 LEU N 1 105 LEU CA 1 105 LEU C -127.90 -67.90 -97.96 -117.09 -83.73 . . 0 "[ . 1 . 2]"
172 . 1 105 LEU N 1 105 LEU CA 1 105 LEU C 1 106 VAL N 93.50 153.50 139.56 145.97 139.83 1.28 16 0 "[ . 1 . 2]"
173 . 1 105 LEU C 1 106 VAL N 1 106 VAL CA 1 106 VAL C -118.90 -38.10 -65.51 -115.82 -39.49 . . 0 "[ . 1 . 2]"
174 . 1 106 VAL N 1 106 VAL CA 1 106 VAL C 1 107 THR N 44.80 -118.80 113.65 142.28 133.82 . . 0 "[ . 1 . 2]"
175 . 1 107 THR C 1 108 GLU N 1 108 GLU CA 1 108 GLU C -138.10 -35.50 -85.23 -63.94 -72.12 . . 0 "[ . 1 . 2]"
176 . 1 108 GLU N 1 108 GLU CA 1 108 GLU C 1 109 PRO N 104.70 -179.10 133.91 135.90 124.49 0.42 15 0 "[ . 1 . 2]"
177 . 1 119 GLU C 1 120 PRO N 1 120 PRO CA 1 120 PRO C -99.80 -39.80 -70.97 -94.99 -52.14 . . 0 "[ . 1 . 2]"
178 . 1 120 PRO N 1 120 PRO CA 1 120 PRO C 1 121 VAL N 118.80 178.80 133.49 116.24 162.45 2.56 9 0 "[ . 1 . 2]"
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