NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
443829 |
2kfp   |
16186 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2kfp
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 172
_TA_constraint_stats_list.Viol_count 251
_TA_constraint_stats_list.Viol_total 7805.80
_TA_constraint_stats_list.Viol_max 7.62
_TA_constraint_stats_list.Viol_rms 0.59
_TA_constraint_stats_list.Viol_average_all_restraints 0.11
_TA_constraint_stats_list.Viol_average_violations_only 1.55
_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 2 ASN C 1 3 ARG N 1 3 ARG CA 1 3 ARG C -81.05 -41.05 -61.95 -64.27 -59.91 . . 0 "[ . 1 . 2]"
2 . 1 3 ARG N 1 3 ARG CA 1 3 ARG C 1 4 GLN N -54.92 -14.92 -42.64 -44.72 -46.58 . . 0 "[ . 1 . 2]"
3 . 1 3 ARG C 1 4 GLN N 1 4 GLN CA 1 4 GLN C -81.99 -41.99 -59.51 -65.90 -43.42 . . 0 "[ . 1 . 2]"
4 . 1 4 GLN N 1 4 GLN CA 1 4 GLN C 1 5 GLN N -63.75 -23.75 -40.77 -39.47 -39.72 . . 0 "[ . 1 . 2]"
5 . 1 4 GLN C 1 5 GLN N 1 5 GLN CA 1 5 GLN C -84.91 -44.91 -64.63 -64.89 -66.03 . . 0 "[ . 1 . 2]"
6 . 1 5 GLN N 1 5 GLN CA 1 5 GLN C 1 6 PHE N -57.44 -17.44 -39.13 -40.44 -41.60 . . 0 "[ . 1 . 2]"
7 . 1 5 GLN C 1 6 PHE N 1 6 PHE CA 1 6 PHE C -84.20 -44.20 -61.39 -62.89 -63.72 . . 0 "[ . 1 . 2]"
8 . 1 6 PHE N 1 6 PHE CA 1 6 PHE C 1 7 ILE N -65.67 -25.67 -45.17 -47.66 -41.63 . . 0 "[ . 1 . 2]"
9 . 1 6 PHE C 1 7 ILE N 1 7 ILE CA 1 7 ILE C -79.68 -39.68 -63.33 -64.98 -59.24 . . 0 "[ . 1 . 2]"
10 . 1 7 ILE N 1 7 ILE CA 1 7 ILE C 1 8 ASP N -65.84 -25.84 -45.23 -45.46 -46.02 . . 0 "[ . 1 . 2]"
11 . 1 7 ILE C 1 8 ASP N 1 8 ASP CA 1 8 ASP C -82.71 -42.71 -63.61 -65.87 -67.38 . . 0 "[ . 1 . 2]"
12 . 1 8 ASP N 1 8 ASP CA 1 8 ASP C 1 9 TYR N -61.42 -21.42 -42.02 -38.27 -39.04 . . 0 "[ . 1 . 2]"
13 . 1 8 ASP C 1 9 TYR N 1 9 TYR CA 1 9 TYR C -83.05 -43.05 -62.81 -61.66 -61.78 . . 0 "[ . 1 . 2]"
14 . 1 9 TYR N 1 9 TYR CA 1 9 TYR C 1 10 ALA N -64.19 -24.19 -45.20 -44.56 -46.14 . . 0 "[ . 1 . 2]"
15 . 1 9 TYR C 1 10 ALA N 1 10 ALA CA 1 10 ALA C -80.46 -40.46 -62.80 -69.30 -54.09 . . 0 "[ . 1 . 2]"
16 . 1 10 ALA N 1 10 ALA CA 1 10 ALA C 1 11 GLN N -62.82 -22.82 -41.85 -43.56 -46.18 . . 0 "[ . 1 . 2]"
17 . 1 10 ALA C 1 11 GLN N 1 11 GLN CA 1 11 GLN C -81.21 -41.21 -64.92 -62.83 -63.45 . . 0 "[ . 1 . 2]"
18 . 1 11 GLN N 1 11 GLN CA 1 11 GLN C 1 12 LYS N -61.71 -21.71 -41.40 -50.39 -21.71 0.00 1 0 "[ . 1 . 2]"
19 . 1 11 GLN C 1 12 LYS N 1 12 LYS CA 1 12 LYS C -84.31 -44.31 -66.06 -69.11 -83.98 0.11 1 0 "[ . 1 . 2]"
20 . 1 12 LYS N 1 12 LYS CA 1 12 LYS C 1 13 LYS N -59.37 -19.37 -39.11 -43.45 -46.59 . . 0 "[ . 1 . 2]"
21 . 1 12 LYS C 1 13 LYS N 1 13 LYS CA 1 13 LYS C -87.26 -47.26 -83.41 -88.25 -88.87 3.08 11 0 "[ . 1 . 2]"
22 . 1 13 LYS N 1 13 LYS CA 1 13 LYS C 1 14 TYR N -52.79 -12.79 -32.65 -12.40 -32.06 1.06 2 0 "[ . 1 . 2]"
23 . 1 13 LYS C 1 14 TYR N 1 14 TYR CA 1 14 TYR C -144.70 -84.70 -123.86 -147.02 -93.45 2.32 4 0 "[ . 1 . 2]"
24 . 1 14 TYR N 1 14 TYR CA 1 14 TYR C 1 15 ASP N -20.72 39.28 -11.88 -22.11 17.53 1.39 3 0 "[ . 1 . 2]"
25 . 1 15 ASP C 1 16 THR N 1 16 THR CA 1 16 THR C -139.92 -79.92 -107.03 -103.20 -104.19 0.23 9 0 "[ . 1 . 2]"
26 . 1 16 THR N 1 16 THR CA 1 16 THR C 1 17 LYS N 109.72 169.72 136.92 123.74 162.20 . . 0 "[ . 1 . 2]"
27 . 1 16 THR C 1 17 LYS N 1 17 LYS CA 1 17 LYS C -142.74 -82.74 -89.90 -89.34 -91.10 0.59 6 0 "[ . 1 . 2]"
28 . 1 17 LYS N 1 17 LYS CA 1 17 LYS C 1 18 PRO N 95.39 155.39 147.70 93.12 157.68 2.29 15 0 "[ . 1 . 2]"
29 . 1 17 LYS C 1 18 PRO N 1 18 PRO CA 1 18 PRO C -105.74 -45.74 -60.06 -71.86 -48.61 . . 0 "[ . 1 . 2]"
30 . 1 18 PRO N 1 18 PRO CA 1 18 PRO C 1 19 ASP N 114.09 174.09 145.49 151.07 149.55 . . 0 "[ . 1 . 2]"
31 . 1 18 PRO C 1 19 ASP N 1 19 ASP CA 1 19 ASP C -161.91 -101.91 -125.46 -132.94 -136.33 . . 0 "[ . 1 . 2]"
32 . 1 19 ASP N 1 19 ASP CA 1 19 ASP C 1 20 HIS N 122.24 -177.76 137.90 121.31 155.17 0.93 17 0 "[ . 1 . 2]"
33 . 1 19 ASP C 1 20 HIS N 1 20 HIS CA 1 20 HIS C -146.47 -86.47 -126.30 -133.72 -136.85 1.10 20 0 "[ . 1 . 2]"
34 . 1 20 HIS N 1 20 HIS CA 1 20 HIS C 1 21 PRO N 87.73 147.73 90.18 86.26 86.17 2.63 8 0 "[ . 1 . 2]"
35 . 1 21 PRO C 1 22 TRP N 1 22 TRP CA 1 22 TRP C -125.92 -65.92 -89.34 -83.45 -85.87 . . 0 "[ . 1 . 2]"
36 . 1 22 TRP N 1 22 TRP CA 1 22 TRP C 1 23 GLU N 76.50 136.50 112.31 82.06 137.50 1.00 20 0 "[ . 1 . 2]"
37 . 1 22 TRP C 1 23 GLU N 1 23 GLU CA 1 23 GLU C -94.68 -34.68 -70.31 -68.86 -69.49 . . 0 "[ . 1 . 2]"
38 . 1 23 GLU N 1 23 GLU CA 1 23 GLU C 1 24 LYS N -67.53 -7.53 -26.26 -37.35 -14.43 . . 0 "[ . 1 . 2]"
39 . 1 23 GLU C 1 24 LYS N 1 24 LYS CA 1 24 LYS C -106.29 -46.29 -73.30 -83.87 -64.78 . . 0 "[ . 1 . 2]"
40 . 1 24 LYS N 1 24 LYS CA 1 24 LYS C 1 25 PHE N -42.51 17.49 -3.14 -7.56 10.45 . . 0 "[ . 1 . 2]"
41 . 1 25 PHE C 1 26 PRO N 1 26 PRO CA 1 26 PRO C -89.99 -29.99 -67.48 -69.47 -70.22 . . 0 "[ . 1 . 2]"
42 . 1 26 PRO N 1 26 PRO CA 1 26 PRO C 1 27 ASP N -50.30 9.70 -19.19 -18.14 -19.00 . . 0 "[ . 1 . 2]"
43 . 1 26 PRO C 1 27 ASP N 1 27 ASP CA 1 27 ASP C -117.28 -57.28 -80.32 -80.64 -81.18 . . 0 "[ . 1 . 2]"
44 . 1 27 ASP N 1 27 ASP CA 1 27 ASP C 1 28 TYR N -34.47 25.53 -5.12 -5.96 -6.00 . . 0 "[ . 1 . 2]"
45 . 1 27 ASP C 1 28 TYR N 1 28 TYR CA 1 28 TYR C -132.10 -72.10 -93.08 -104.68 -84.57 . . 0 "[ . 1 . 2]"
46 . 1 28 TYR N 1 28 TYR CA 1 28 TYR C 1 29 ALA N 103.89 163.89 139.99 132.16 150.80 . . 0 "[ . 1 . 2]"
47 . 1 28 TYR C 1 29 ALA N 1 29 ALA CA 1 29 ALA C -159.10 -99.10 -129.56 -140.88 -121.72 . . 0 "[ . 1 . 2]"
48 . 1 29 ALA N 1 29 ALA CA 1 29 ALA C 1 30 VAL N 114.80 174.80 135.32 146.37 141.38 . . 0 "[ . 1 . 2]"
49 . 1 29 ALA C 1 30 VAL N 1 30 VAL CA 1 30 VAL C -151.81 -91.81 -121.05 -121.16 -123.73 . . 0 "[ . 1 . 2]"
50 . 1 30 VAL N 1 30 VAL CA 1 30 VAL C 1 31 PHE N 115.48 175.48 128.92 124.51 133.55 . . 0 "[ . 1 . 2]"
51 . 1 30 VAL C 1 31 PHE N 1 31 PHE CA 1 31 PHE C -134.34 -74.34 -110.24 -112.77 -113.48 . . 0 "[ . 1 . 2]"
52 . 1 31 PHE N 1 31 PHE CA 1 31 PHE C 1 32 ARG N 96.39 156.39 125.80 109.92 147.88 . . 0 "[ . 1 . 2]"
53 . 1 31 PHE C 1 32 ARG N 1 32 ARG CA 1 32 ARG C -158.98 -98.98 -144.01 -151.57 -156.12 . . 0 "[ . 1 . 2]"
54 . 1 32 ARG N 1 32 ARG CA 1 32 ARG C 1 33 HIS N 132.25 -167.75 144.09 153.17 150.67 2.57 6 0 "[ . 1 . 2]"
55 . 1 32 ARG C 1 33 HIS N 1 33 HIS CA 1 33 HIS C -99.36 -39.36 -97.48 -85.42 -96.68 3.92 6 0 "[ . 1 . 2]"
56 . 1 33 HIS N 1 33 HIS CA 1 33 HIS C 1 34 SER N 110.19 170.19 124.34 124.11 118.20 0.03 7 0 "[ . 1 . 2]"
57 . 1 33 HIS C 1 34 SER N 1 34 SER CA 1 34 SER C -101.63 -41.63 -75.47 -70.94 -75.79 1.28 8 0 "[ . 1 . 2]"
58 . 1 34 SER N 1 34 SER CA 1 34 SER C 1 35 ASP N -49.79 10.21 -25.28 -50.91 -6.89 1.12 8 0 "[ . 1 . 2]"
59 . 1 34 SER C 1 35 ASP N 1 35 ASP CA 1 35 ASP C -109.20 -49.20 -77.86 -96.86 -62.03 . . 0 "[ . 1 . 2]"
60 . 1 35 ASP N 1 35 ASP CA 1 35 ASP C 1 36 ASN N -43.41 16.59 -24.56 -45.64 -0.73 2.23 20 0 "[ . 1 . 2]"
61 . 1 35 ASP C 1 36 ASN N 1 36 ASN CA 1 36 ASN C -121.80 -61.80 -109.91 -105.07 -107.45 3.78 20 0 "[ . 1 . 2]"
62 . 1 36 ASN N 1 36 ASN CA 1 36 ASN C 1 37 ASP N -30.01 29.99 -0.31 -13.15 -24.60 1.83 8 0 "[ . 1 . 2]"
63 . 1 39 TRP C 1 40 TYR N 1 40 TYR CA 1 40 TYR C -158.26 -98.26 -125.58 -122.80 -138.58 1.92 10 0 "[ . 1 . 2]"
64 . 1 40 TYR N 1 40 TYR CA 1 40 TYR C 1 41 ALA N 126.42 -173.58 124.52 124.35 123.29 7.62 14 5 "[* .* * - +. 2]"
65 . 1 40 TYR C 1 41 ALA N 1 41 ALA CA 1 41 ALA C -150.29 -90.29 -152.61 -152.06 -153.61 7.29 14 5 "[* .* * - +. 2]"
66 . 1 41 ALA N 1 41 ALA CA 1 41 ALA C 1 42 LEU N 105.90 165.90 121.40 121.11 106.23 1.04 7 0 "[ . 1 . 2]"
67 . 1 41 ALA C 1 42 LEU N 1 42 LEU CA 1 42 LEU C -160.15 -100.15 -130.31 -124.34 -132.29 . . 0 "[ . 1 . 2]"
68 . 1 42 LEU N 1 42 LEU CA 1 42 LEU C 1 43 LEU N 94.87 154.87 134.84 146.00 144.01 . . 0 "[ . 1 . 2]"
69 . 1 42 LEU C 1 43 LEU N 1 43 LEU CA 1 43 LEU C -144.25 -84.25 -121.19 -115.27 -116.40 . . 0 "[ . 1 . 2]"
70 . 1 43 LEU N 1 43 LEU CA 1 43 LEU C 1 44 MET N 103.82 163.82 124.27 125.45 124.76 . . 0 "[ . 1 . 2]"
71 . 1 43 LEU C 1 44 MET N 1 44 MET CA 1 44 MET C -162.64 -102.64 -156.86 -162.88 -146.63 0.24 3 0 "[ . 1 . 2]"
72 . 1 44 MET N 1 44 MET CA 1 44 MET C 1 45 ASP N 123.72 -176.28 161.96 161.25 158.09 . . 0 "[ . 1 . 2]"
73 . 1 44 MET C 1 45 ASP N 1 45 ASP CA 1 45 ASP C -146.31 -86.31 -98.02 -106.95 -93.52 . . 0 "[ . 1 . 2]"
74 . 1 45 ASP N 1 45 ASP CA 1 45 ASP C 1 46 ILE N 114.37 174.37 122.30 136.56 118.78 0.34 8 0 "[ . 1 . 2]"
75 . 1 45 ASP C 1 46 ILE N 1 46 ILE CA 1 46 ILE C -160.03 -100.03 -128.68 -155.75 -116.67 . . 0 "[ . 1 . 2]"
76 . 1 46 ILE N 1 46 ILE CA 1 46 ILE C 1 47 PRO N 81.97 141.97 145.97 146.46 146.23 5.30 13 2 "[ . - 1 + . 2]"
77 . 1 46 ILE C 1 47 PRO N 1 47 PRO CA 1 47 PRO C -106.63 -46.63 -53.17 -64.31 -45.34 1.29 14 0 "[ . 1 . 2]"
78 . 1 47 PRO N 1 47 PRO CA 1 47 PRO C 1 48 ALA N 102.98 162.98 143.05 143.60 143.26 . . 0 "[ . 1 . 2]"
79 . 1 47 PRO C 1 48 ALA N 1 48 ALA CA 1 48 ALA C -76.02 -36.02 -64.45 -70.60 -60.13 . . 0 "[ . 1 . 2]"
80 . 1 48 ALA N 1 48 ALA CA 1 48 ALA C 1 49 GLU N -61.25 -21.25 -22.40 -29.52 -19.89 1.36 10 0 "[ . 1 . 2]"
81 . 1 48 ALA C 1 49 GLU N 1 49 GLU CA 1 49 GLU C -81.87 -41.87 -66.10 -77.18 -77.29 . . 0 "[ . 1 . 2]"
82 . 1 49 GLU N 1 49 GLU CA 1 49 GLU C 1 50 LYS N -54.98 -14.98 -22.50 -38.85 -13.50 1.48 7 0 "[ . 1 . 2]"
83 . 1 49 GLU C 1 50 LYS N 1 50 LYS CA 1 50 LYS C -84.56 -44.56 -77.23 -85.50 -63.05 0.94 20 0 "[ . 1 . 2]"
84 . 1 50 LYS N 1 50 LYS CA 1 50 LYS C 1 51 ILE N -47.69 -7.69 -22.11 -10.08 -10.45 . . 0 "[ . 1 . 2]"
85 . 1 50 LYS C 1 51 ILE N 1 51 ILE CA 1 51 ILE C -127.45 -67.45 -97.50 -103.57 -104.53 . . 0 "[ . 1 . 2]"
86 . 1 51 ILE N 1 51 ILE CA 1 51 ILE C 1 52 GLY N -29.13 30.87 5.86 2.47 1.73 . . 0 "[ . 1 . 2]"
87 . 1 51 ILE C 1 52 GLY N 1 52 GLY CA 1 52 GLY C 61.87 121.87 89.75 62.10 100.43 . . 0 "[ . 1 . 2]"
88 . 1 52 GLY N 1 52 GLY CA 1 52 GLY C 1 53 ILE N -22.03 37.97 -2.20 -17.19 36.44 . . 0 "[ . 1 . 2]"
89 . 1 52 GLY C 1 53 ILE N 1 53 ILE CA 1 53 ILE C -138.80 -78.80 -84.30 -110.16 -78.27 0.53 12 0 "[ . 1 . 2]"
90 . 1 53 ILE N 1 53 ILE CA 1 53 ILE C 1 54 ASN N 95.42 155.42 133.64 126.61 146.51 . . 0 "[ . 1 . 2]"
91 . 1 58 ARG C 1 59 VAL N 1 59 VAL CA 1 59 VAL C -164.39 -104.39 -134.04 -134.14 -134.58 . . 0 "[ . 1 . 2]"
92 . 1 59 VAL N 1 59 VAL CA 1 59 VAL C 1 60 ASP N 128.68 -171.32 159.50 143.61 164.22 . . 0 "[ . 1 . 2]"
93 . 1 59 VAL C 1 60 ASP N 1 60 ASP CA 1 60 ASP C -149.48 -89.48 -95.60 -100.66 -100.73 1.29 12 0 "[ . 1 . 2]"
94 . 1 60 ASP N 1 60 ASP CA 1 60 ASP C 1 61 VAL N 105.56 165.56 134.28 127.58 141.62 . . 0 "[ . 1 . 2]"
95 . 1 60 ASP C 1 61 VAL N 1 61 VAL CA 1 61 VAL C -166.11 -106.11 -135.02 -137.87 -131.07 . . 0 "[ . 1 . 2]"
96 . 1 61 VAL N 1 61 VAL CA 1 61 VAL C 1 62 ILE N 130.33 -169.67 156.29 158.28 157.91 . . 0 "[ . 1 . 2]"
97 . 1 61 VAL C 1 62 ILE N 1 62 ILE CA 1 62 ILE C -161.64 -101.64 -134.62 -141.59 -130.93 . . 0 "[ . 1 . 2]"
98 . 1 62 ILE N 1 62 ILE CA 1 62 ILE C 1 63 ASP N 128.54 -171.46 150.27 150.97 150.51 . . 0 "[ . 1 . 2]"
99 . 1 63 ASP C 1 64 LEU N 1 64 LEU CA 1 64 LEU C -154.43 -94.43 -130.93 -141.10 -115.70 . . 0 "[ . 1 . 2]"
100 . 1 64 LEU N 1 64 LEU CA 1 64 LEU C 1 65 LYS N 104.31 164.31 134.89 156.79 131.92 . . 0 "[ . 1 . 2]"
101 . 1 64 LEU C 1 65 LYS N 1 65 LYS CA 1 65 LYS C -142.43 -82.43 -87.27 -88.36 -88.96 0.41 13 0 "[ . 1 . 2]"
102 . 1 65 LYS N 1 65 LYS CA 1 65 LYS C 1 66 VAL N 100.15 160.15 134.10 134.83 132.20 . . 0 "[ . 1 . 2]"
103 . 1 65 LYS C 1 66 VAL N 1 66 VAL CA 1 66 VAL C -165.02 -105.02 -140.94 -146.76 -133.23 . . 0 "[ . 1 . 2]"
104 . 1 66 VAL N 1 66 VAL CA 1 66 VAL C 1 67 GLN N 125.92 -174.08 163.84 158.35 169.65 . . 0 "[ . 1 . 2]"
105 . 1 66 VAL C 1 67 GLN N 1 67 GLN CA 1 67 GLN C -110.44 -50.44 -80.27 -93.32 -70.25 . . 0 "[ . 1 . 2]"
106 . 1 67 GLN N 1 67 GLN CA 1 67 GLN C 1 68 PRO N 109.76 169.76 153.41 133.96 158.71 . . 0 "[ . 1 . 2]"
107 . 1 67 GLN C 1 68 PRO N 1 68 PRO CA 1 68 PRO C -82.65 -22.65 -55.86 -65.57 -44.69 . . 0 "[ . 1 . 2]"
108 . 1 68 PRO N 1 68 PRO CA 1 68 PRO C 1 69 GLU N -65.08 -5.08 -26.10 -23.85 -24.62 . . 0 "[ . 1 . 2]"
109 . 1 69 GLU C 1 70 LEU N 1 70 LEU CA 1 70 LEU C -112.34 -72.34 -91.98 -97.38 -84.67 . . 0 "[ . 1 . 2]"
110 . 1 70 LEU N 1 70 LEU CA 1 70 LEU C 1 71 VAL N -28.84 11.16 0.06 5.02 2.66 . . 0 "[ . 1 . 2]"
111 . 1 70 LEU C 1 71 VAL N 1 71 VAL CA 1 71 VAL C -81.65 -41.65 -64.61 -63.70 -63.95 . . 0 "[ . 1 . 2]"
112 . 1 71 VAL N 1 71 VAL CA 1 71 VAL C 1 72 GLY N -66.23 -26.23 -38.95 -38.87 -39.58 . . 0 "[ . 1 . 2]"
113 . 1 71 VAL C 1 72 GLY N 1 72 GLY CA 1 72 GLY C -82.19 -42.19 -67.82 -80.51 -58.46 . . 0 "[ . 1 . 2]"
114 . 1 72 GLY N 1 72 GLY CA 1 72 GLY C 1 73 SER N -55.80 -15.80 -33.11 -21.45 -39.46 1.21 14 0 "[ . 1 . 2]"
115 . 1 72 GLY C 1 73 SER N 1 73 SER CA 1 73 SER C -85.45 -45.45 -63.99 -62.79 -64.73 . . 0 "[ . 1 . 2]"
116 . 1 73 SER N 1 73 SER CA 1 73 SER C 1 74 LEU N -59.14 -19.14 -48.50 -60.60 -26.32 1.46 5 0 "[ . 1 . 2]"
117 . 1 73 SER C 1 74 LEU N 1 74 LEU CA 1 74 LEU C -84.77 -44.77 -79.20 -88.24 -65.56 3.47 14 0 "[ . 1 . 2]"
118 . 1 74 LEU N 1 74 LEU CA 1 74 LEU C 1 75 ARG N -64.06 -24.06 -34.58 -39.10 -42.16 2.49 8 0 "[ . 1 . 2]"
119 . 1 74 LEU C 1 75 ARG N 1 75 ARG CA 1 75 ARG C -85.12 -45.12 -70.74 -67.81 -69.51 . . 0 "[ . 1 . 2]"
120 . 1 75 ARG N 1 75 ARG CA 1 75 ARG C 1 76 LYS N -45.83 -5.83 -24.66 -42.27 -6.54 . . 0 "[ . 1 . 2]"
121 . 1 75 ARG C 1 76 LYS N 1 76 LYS CA 1 76 LYS C -109.70 -69.70 -80.51 -94.28 -67.79 1.91 5 0 "[ . 1 . 2]"
122 . 1 76 LYS N 1 76 LYS CA 1 76 LYS C 1 77 LYS N -30.98 9.02 -11.85 -11.41 -28.61 1.88 1 0 "[ . 1 . 2]"
123 . 1 76 LYS C 1 77 LYS N 1 77 LYS CA 1 77 LYS C -98.36 -38.36 -79.17 -96.49 -58.24 . . 0 "[ . 1 . 2]"
124 . 1 77 LYS N 1 77 LYS CA 1 77 LYS C 1 78 PRO N 109.49 169.49 137.66 146.11 139.99 . . 0 "[ . 1 . 2]"
125 . 1 77 LYS C 1 78 PRO N 1 78 PRO CA 1 78 PRO C -92.92 -32.92 -62.66 -69.10 -69.95 . . 0 "[ . 1 . 2]"
126 . 1 78 PRO N 1 78 PRO CA 1 78 PRO C 1 79 GLY N 118.10 178.10 147.17 140.87 157.84 . . 0 "[ . 1 . 2]"
127 . 1 79 GLY C 1 80 ILE N 1 80 ILE CA 1 80 ILE C -123.70 -63.70 -98.80 -91.83 -93.70 . . 0 "[ . 1 . 2]"
128 . 1 80 ILE N 1 80 ILE CA 1 80 ILE C 1 81 TYR N 96.92 156.92 123.14 120.09 117.11 . . 0 "[ . 1 . 2]"
129 . 1 80 ILE C 1 81 TYR N 1 81 TYR CA 1 81 TYR C -123.46 -63.46 -116.02 -124.60 -105.15 1.14 16 0 "[ . 1 . 2]"
130 . 1 81 TYR N 1 81 TYR CA 1 81 TYR C 1 82 PRO N 97.62 157.62 149.54 126.16 161.22 3.60 6 0 "[ . 1 . 2]"
131 . 1 81 TYR C 1 82 PRO N 1 82 PRO CA 1 82 PRO C -90.25 -30.25 -62.37 -67.95 -68.75 . . 0 "[ . 1 . 2]"
132 . 1 82 PRO N 1 82 PRO CA 1 82 PRO C 1 83 ALA N 114.91 174.91 153.07 158.57 154.77 . . 0 "[ . 1 . 2]"
133 . 1 90 HIS C 1 91 TRP N 1 91 TRP CA 1 91 TRP C -155.19 -95.19 -111.49 -120.57 -93.93 1.26 6 0 "[ . 1 . 2]"
134 . 1 91 TRP N 1 91 TRP CA 1 91 TRP C 1 92 ILE N 119.64 179.64 140.47 122.41 159.40 . . 0 "[ . 1 . 2]"
135 . 1 91 TRP C 1 92 ILE N 1 92 ILE CA 1 92 ILE C -164.61 -104.61 -130.18 -121.14 -125.90 . . 0 "[ . 1 . 2]"
136 . 1 92 ILE N 1 92 ILE CA 1 92 ILE C 1 93 THR N 121.86 -178.14 146.58 133.95 133.39 . . 0 "[ . 1 . 2]"
137 . 1 92 ILE C 1 93 THR N 1 93 THR CA 1 93 THR C -131.81 -71.81 -93.00 -107.77 -81.58 . . 0 "[ . 1 . 2]"
138 . 1 93 THR N 1 93 THR CA 1 93 THR C 1 94 VAL N 102.86 162.86 135.03 137.78 135.49 . . 0 "[ . 1 . 2]"
139 . 1 93 THR C 1 94 VAL N 1 94 VAL CA 1 94 VAL C -141.08 -81.08 -117.27 -124.43 -108.46 . . 0 "[ . 1 . 2]"
140 . 1 94 VAL N 1 94 VAL CA 1 94 VAL C 1 95 LEU N 103.75 163.75 133.65 134.52 133.97 . . 0 "[ . 1 . 2]"
141 . 1 94 VAL C 1 95 LEU N 1 95 LEU CA 1 95 LEU C -144.80 -84.80 -88.61 -84.68 -86.30 0.55 13 0 "[ . 1 . 2]"
142 . 1 95 LEU N 1 95 LEU CA 1 95 LEU C 1 96 LEU N 97.69 157.69 108.57 107.20 105.89 . . 0 "[ . 1 . 2]"
143 . 1 101 GLY C 1 102 ALA N 1 102 ALA CA 1 102 ALA C -88.85 -28.85 -63.16 -67.22 -58.01 . . 0 "[ . 1 . 2]"
144 . 1 102 ALA N 1 102 ALA CA 1 102 ALA C 1 103 LYS N -71.58 -11.58 -39.20 -37.23 -38.94 . . 0 "[ . 1 . 2]"
145 . 1 102 ALA C 1 103 LYS N 1 103 LYS CA 1 103 LYS C -83.07 -43.07 -63.68 -65.55 -70.26 . . 0 "[ . 1 . 2]"
146 . 1 103 LYS N 1 103 LYS CA 1 103 LYS C 1 104 GLU N -59.97 -19.97 -39.62 -42.67 -34.87 . . 0 "[ . 1 . 2]"
147 . 1 103 LYS C 1 104 GLU N 1 104 GLU CA 1 104 GLU C -86.39 -46.39 -64.84 -69.08 -61.00 . . 0 "[ . 1 . 2]"
148 . 1 104 GLU N 1 104 GLU CA 1 104 GLU C 1 105 ILE N -62.80 -22.80 -42.07 -38.84 -40.05 . . 0 "[ . 1 . 2]"
149 . 1 104 GLU C 1 105 ILE N 1 105 ILE CA 1 105 ILE C -84.22 -44.22 -64.15 -63.71 -64.05 . . 0 "[ . 1 . 2]"
150 . 1 105 ILE N 1 105 ILE CA 1 105 ILE C 1 106 HIS N -61.26 -21.26 -43.43 -44.18 -42.91 . . 0 "[ . 1 . 2]"
151 . 1 105 ILE C 1 106 HIS N 1 106 HIS CA 1 106 HIS C -84.69 -44.69 -58.41 -66.03 -55.16 . . 0 "[ . 1 . 2]"
152 . 1 106 HIS N 1 106 HIS CA 1 106 HIS C 1 107 SER N -59.70 -19.70 -43.66 -47.30 -38.51 . . 0 "[ . 1 . 2]"
153 . 1 106 HIS C 1 107 SER N 1 107 SER CA 1 107 SER C -84.37 -44.37 -61.82 -61.43 -61.90 . . 0 "[ . 1 . 2]"
154 . 1 107 SER N 1 107 SER CA 1 107 SER C 1 108 LEU N -60.83 -20.83 -43.62 -44.27 -44.57 . . 0 "[ . 1 . 2]"
155 . 1 107 SER C 1 108 LEU N 1 108 LEU CA 1 108 LEU C -85.46 -45.46 -64.01 -64.81 -62.90 . . 0 "[ . 1 . 2]"
156 . 1 108 LEU N 1 108 LEU CA 1 108 LEU C 1 109 ILE N -59.75 -19.75 -42.03 -44.96 -39.75 . . 0 "[ . 1 . 2]"
157 . 1 108 LEU C 1 109 ILE N 1 109 ILE CA 1 109 ILE C -84.41 -44.41 -63.87 -66.16 -62.73 . . 0 "[ . 1 . 2]"
158 . 1 109 ILE N 1 109 ILE CA 1 109 ILE C 1 110 GLU N -64.87 -24.87 -42.89 -43.20 -42.43 . . 0 "[ . 1 . 2]"
159 . 1 109 ILE C 1 110 GLU N 1 110 GLU CA 1 110 GLU C -83.43 -43.43 -55.51 -61.19 -51.64 . . 0 "[ . 1 . 2]"
160 . 1 110 GLU N 1 110 GLU CA 1 110 GLU C 1 111 ASP N -58.67 -18.67 -41.68 -42.87 -43.68 . . 0 "[ . 1 . 2]"
161 . 1 110 GLU C 1 111 ASP N 1 111 ASP CA 1 111 ASP C -83.32 -43.32 -62.76 -65.19 -60.06 . . 0 "[ . 1 . 2]"
162 . 1 111 ASP N 1 111 ASP CA 1 111 ASP C 1 112 SER N -60.98 -20.98 -41.30 -42.28 -42.91 . . 0 "[ . 1 . 2]"
163 . 1 111 ASP C 1 112 SER N 1 112 SER CA 1 112 SER C -85.31 -45.31 -64.50 -67.34 -70.02 . . 0 "[ . 1 . 2]"
164 . 1 112 SER N 1 112 SER CA 1 112 SER C 1 113 PHE N -60.73 -20.73 -36.87 -42.12 -23.55 . . 0 "[ . 1 . 2]"
165 . 1 112 SER C 1 113 PHE N 1 113 PHE CA 1 113 PHE C -85.70 -45.70 -59.79 -62.11 -55.20 . . 0 "[ . 1 . 2]"
166 . 1 113 PHE N 1 113 PHE CA 1 113 PHE C 1 114 GLN N -63.18 -23.18 -44.86 -48.97 -42.90 . . 0 "[ . 1 . 2]"
167 . 1 113 PHE C 1 114 GLN N 1 114 GLN CA 1 114 GLN C -84.73 -44.73 -59.06 -77.00 -47.81 . . 0 "[ . 1 . 2]"
168 . 1 114 GLN N 1 114 GLN CA 1 114 GLN C 1 115 LEU N -62.39 -22.39 -37.10 -29.15 -31.01 1.80 6 0 "[ . 1 . 2]"
169 . 1 114 GLN C 1 115 LEU N 1 115 LEU CA 1 115 LEU C -85.17 -45.17 -69.08 -79.53 -82.37 0.93 11 0 "[ . 1 . 2]"
170 . 1 115 LEU N 1 115 LEU CA 1 115 LEU C 1 116 THR N -54.28 -14.28 -34.05 -15.70 -17.43 1.13 16 0 "[ . 1 . 2]"
171 . 1 115 LEU C 1 116 THR N 1 116 THR CA 1 116 THR C -129.43 -89.43 -97.45 -120.43 -88.08 1.35 10 0 "[ . 1 . 2]"
172 . 1 116 THR N 1 116 THR CA 1 116 THR C 1 117 ARG N -26.30 13.70 12.80 4.94 16.77 3.07 6 0 "[ . 1 . 2]"
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