NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
602279 |
5iay   |
30019 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_5iay
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 1254
_TA_constraint_stats_list.Viol_total 49510.63
_TA_constraint_stats_list.Viol_max 13.43
_TA_constraint_stats_list.Viol_rms 1.77
_TA_constraint_stats_list.Viol_average_all_restraints 0.67
_TA_constraint_stats_list.Viol_average_violations_only 1.97
_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 TYR C 1 3 LYS N 1 3 LYS CA 1 3 LYS C -110.00 -64.00 -110.65 -110.93 -111.78 2.29 8 0 "[ . 1 . 2]"
2 . 1 3 LYS N 1 3 LYS CA 1 3 LYS C 1 4 VAL N 116.00 156.00 155.68 149.61 158.46 2.46 9 0 "[ . 1 . 2]"
3 . 1 7 TYR C 1 8 VAL N 1 8 VAL CA 1 8 VAL C -139.00 -115.00 -133.26 -135.09 -131.46 . . 0 "[ . 1 . 2]"
4 . 1 8 VAL N 1 8 VAL CA 1 8 VAL C 1 9 ASP N 159.00 171.00 158.60 158.30 158.97 0.70 8 0 "[ . 1 . 2]"
5 . 1 8 VAL C 1 9 ASP N 1 9 ASP CA 1 9 ASP C -121.00 -77.00 -89.87 -88.33 -90.95 . . 0 "[ . 1 . 2]"
6 . 1 9 ASP N 1 9 ASP CA 1 9 ASP C 1 10 ALA N 116.00 156.00 138.89 129.34 144.82 . . 0 "[ . 1 . 2]"
7 . 1 9 ASP C 1 10 ALA N 1 10 ALA CA 1 10 ALA C -140.00 -116.00 -114.81 -115.43 -113.47 2.53 14 0 "[ . 1 . 2]"
8 . 1 10 ALA N 1 10 ALA CA 1 10 ALA C 1 11 ARG N 118.00 140.00 140.97 141.95 141.67 2.17 5 0 "[ . 1 . 2]"
9 . 1 10 ALA C 1 11 ARG N 1 11 ARG CA 1 11 ARG C -126.00 -102.00 -110.27 -101.17 -106.87 1.48 18 0 "[ . 1 . 2]"
10 . 1 11 ARG N 1 11 ARG CA 1 11 ARG C 1 12 ASP N 103.00 141.00 142.56 138.88 147.12 6.12 13 2 "[ . - + . 2]"
11 . 1 11 ARG C 1 12 ASP N 1 12 ASP CA 1 12 ASP C -158.00 -96.00 -92.44 -92.68 -92.77 4.58 13 0 "[ . 1 . 2]"
12 . 1 12 ASP N 1 12 ASP CA 1 12 ASP C 1 13 THR N 107.00 139.00 110.53 112.05 110.52 0.51 17 0 "[ . 1 . 2]"
13 . 1 12 ASP C 1 13 THR N 1 13 THR CA 1 13 THR C -60.00 -54.00 -57.51 -61.72 -53.54 1.72 18 0 "[ . 1 . 2]"
14 . 1 13 THR N 1 13 THR CA 1 13 THR C 1 14 ASN N -45.00 -29.00 -34.26 -36.98 -28.46 0.54 13 0 "[ . 1 . 2]"
15 . 1 13 THR C 1 14 ASN N 1 14 ASN CA 1 14 ASN C -79.00 -67.00 -62.63 -63.53 -61.75 5.25 13 1 "[ . 1 + . 2]"
16 . 1 14 ASN N 1 14 ASN CA 1 14 ASN C 1 15 MET N -48.00 -20.00 -40.74 -46.46 -38.41 . . 0 "[ . 1 . 2]"
17 . 1 14 ASN C 1 15 MET N 1 15 MET CA 1 15 MET C -114.00 -88.00 -111.92 -114.55 -108.68 0.55 16 0 "[ . 1 . 2]"
18 . 1 15 MET N 1 15 MET CA 1 15 MET C 1 16 GLY N -16.00 12.00 -16.77 -17.58 -16.32 1.58 15 0 "[ . 1 . 2]"
19 . 1 16 GLY C 1 17 ALA N 1 17 ALA CA 1 17 ALA C -156.00 -98.00 -99.76 -101.25 -101.76 0.20 20 0 "[ . 1 . 2]"
20 . 1 17 ALA N 1 17 ALA CA 1 17 ALA C 1 18 TRP N 136.00 164.00 146.12 147.35 146.83 . . 0 "[ . 1 . 2]"
21 . 1 17 ALA C 1 18 TRP N 1 18 TRP CA 1 18 TRP C -137.00 -99.00 -107.30 -106.23 -107.43 . . 0 "[ . 1 . 2]"
22 . 1 18 TRP N 1 18 TRP CA 1 18 TRP C 1 19 PHE N 132.00 160.00 139.72 142.45 141.72 . . 0 "[ . 1 . 2]"
23 . 1 20 GLU C 1 21 ALA N 1 21 ALA CA 1 21 ALA C -149.00 -97.00 -148.91 -149.61 -147.11 0.61 8 0 "[ . 1 . 2]"
24 . 1 21 ALA N 1 21 ALA CA 1 21 ALA C 1 22 GLN N 131.00 171.00 153.19 153.03 152.77 . . 0 "[ . 1 . 2]"
25 . 1 21 ALA C 1 22 GLN N 1 22 GLN CA 1 22 GLN C -141.00 -79.00 -115.52 -115.07 -116.24 . . 0 "[ . 1 . 2]"
26 . 1 22 GLN N 1 22 GLN CA 1 22 GLN C 1 23 VAL N 126.00 154.00 150.98 144.94 155.18 1.18 6 0 "[ . 1 . 2]"
27 . 1 22 GLN C 1 23 VAL N 1 23 VAL CA 1 23 VAL C -125.00 -77.00 -84.32 -83.65 -89.07 0.28 7 0 "[ . 1 . 2]"
28 . 1 23 VAL N 1 23 VAL CA 1 23 VAL C 1 24 VAL N 105.00 131.00 127.44 131.13 131.04 0.26 17 0 "[ . 1 . 2]"
29 . 1 23 VAL C 1 24 VAL N 1 24 VAL CA 1 24 VAL C -113.00 -79.00 -100.27 -113.61 -81.92 0.61 9 0 "[ . 1 . 2]"
30 . 1 24 VAL N 1 24 VAL CA 1 24 VAL C 1 25 ARG N -43.00 -7.00 -40.25 -43.34 -43.39 1.32 7 0 "[ . 1 . 2]"
31 . 1 24 VAL C 1 25 ARG N 1 25 ARG CA 1 25 ARG C -168.00 -124.00 -158.38 -152.66 -153.23 0.39 3 0 "[ . 1 . 2]"
32 . 1 25 ARG N 1 25 ARG CA 1 25 ARG C 1 26 VAL N 119.00 163.00 148.40 139.75 155.36 . . 0 "[ . 1 . 2]"
33 . 1 25 ARG C 1 26 VAL N 1 26 VAL CA 1 26 VAL C -133.00 -83.00 -123.98 -132.77 -117.44 . . 0 "[ . 1 . 2]"
34 . 1 26 VAL N 1 26 VAL CA 1 26 VAL C 1 27 THR N 107.00 145.00 119.15 106.79 131.05 0.21 5 0 "[ . 1 . 2]"
35 . 1 26 VAL C 1 27 THR N 1 27 THR CA 1 27 THR C -146.00 -106.00 -146.88 -148.00 -146.18 2.00 5 0 "[ . 1 . 2]"
36 . 1 27 THR N 1 27 THR CA 1 27 THR C 1 28 ARG N 143.00 173.00 166.53 156.73 173.09 0.09 12 0 "[ . 1 . 2]"
37 . 1 27 THR C 1 28 ARG N 1 28 ARG CA 1 28 ARG C -146.00 -106.00 -135.30 -135.63 -139.02 0.32 15 0 "[ . 1 . 2]"
38 . 1 28 ARG N 1 28 ARG CA 1 28 ARG C 1 29 LYS N 143.00 173.00 152.49 143.57 168.81 . . 0 "[ . 1 . 2]"
39 . 1 28 ARG C 1 29 LYS N 1 29 LYS CA 1 29 LYS C -118.00 -76.00 -96.00 -89.24 -93.15 1.71 12 0 "[ . 1 . 2]"
40 . 1 29 LYS N 1 29 LYS CA 1 29 LYS C 1 30 ALA N 121.00 153.00 130.97 119.79 142.25 1.21 15 0 "[ . 1 . 2]"
41 . 1 29 LYS C 1 30 ALA N 1 30 ALA CA 1 30 ALA C -62.00 -116.00 -114.80 -109.88 -112.12 9.09 8 4 "[ * . +*1 .- 2]"
42 . 1 30 ALA N 1 30 ALA CA 1 30 ALA C 1 31 PRO N 101.00 165.00 160.30 163.85 163.37 0.89 6 0 "[ . 1 . 2]"
43 . 1 30 ALA C 1 31 PRO N 1 31 PRO CA 1 31 PRO C -83.00 -69.00 -72.87 -81.04 -68.49 0.51 15 0 "[ . 1 . 2]"
44 . 1 31 PRO N 1 31 PRO CA 1 31 PRO C 1 32 SER N 137.00 161.00 141.42 136.10 148.18 0.90 12 0 "[ . 1 . 2]"
45 . 1 34 ASP C 1 35 GLU N 1 35 GLU CA 1 35 GLU C -137.00 -91.00 -128.86 -133.62 -124.84 . . 0 "[ . 1 . 2]"
46 . 1 35 GLU N 1 35 GLU CA 1 35 GLU C 1 36 PRO N 76.00 138.00 66.29 62.57 82.25 13.43 12 17 "[ ****** ***+**- ****]"
47 . 1 41 SER C 1 42 ARG N 1 42 ARG CA 1 42 ARG C -110.00 -68.00 -78.32 -68.36 -68.98 0.85 4 0 "[ . 1 . 2]"
48 . 1 42 ARG N 1 42 ARG CA 1 42 ARG C 1 43 PRO N 120.00 154.00 148.36 135.96 154.67 0.67 6 0 "[ . 1 . 2]"
49 . 1 42 ARG C 1 43 PRO N 1 43 PRO CA 1 43 PRO C -70.00 -56.00 -59.71 -66.10 -52.93 3.07 6 0 "[ . 1 . 2]"
50 . 1 43 PRO N 1 43 PRO CA 1 43 PRO C 1 44 ALA N 135.00 157.00 142.90 139.93 147.28 . . 0 "[ . 1 . 2]"
51 . 1 48 ASP C 1 49 VAL N 1 49 VAL CA 1 49 VAL C -129.00 -103.00 -120.33 -120.29 -120.91 . . 0 "[ . 1 . 2]"
52 . 1 49 VAL N 1 49 VAL CA 1 49 VAL C 1 50 ILE N 128.00 168.00 168.54 165.25 169.53 1.53 4 0 "[ . 1 . 2]"
53 . 1 49 VAL C 1 50 ILE N 1 50 ILE CA 1 50 ILE C -132.00 -108.00 -105.52 -106.58 -104.50 3.50 12 0 "[ . 1 . 2]"
54 . 1 50 ILE N 1 50 ILE CA 1 50 ILE C 1 51 TYR N 128.00 158.00 143.06 137.36 149.50 . . 0 "[ . 1 . 2]"
55 . 1 50 ILE C 1 51 TYR N 1 51 TYR CA 1 51 TYR C -138.00 -118.00 -116.60 -117.44 -115.53 2.47 6 0 "[ . 1 . 2]"
56 . 1 51 TYR N 1 51 TYR CA 1 51 TYR C 1 52 HIS N 125.00 151.00 137.78 134.03 141.47 . . 0 "[ . 1 . 2]"
57 . 1 51 TYR C 1 52 HIS N 1 52 HIS CA 1 52 HIS C -145.00 -105.00 -107.37 -105.61 -106.34 0.31 9 0 "[ . 1 . 2]"
58 . 1 52 HIS N 1 52 HIS CA 1 52 HIS C 1 53 VAL N 118.00 162.00 123.06 122.23 121.15 0.13 1 0 "[ . 1 . 2]"
59 . 1 52 HIS C 1 53 VAL N 1 53 VAL CA 1 53 VAL C -144.00 -122.00 -129.64 -133.23 -126.76 . . 0 "[ . 1 . 2]"
60 . 1 53 VAL N 1 53 VAL CA 1 53 VAL C 1 54 LYS N 146.00 172.00 155.21 153.58 152.98 . . 0 "[ . 1 . 2]"
61 . 1 53 VAL C 1 54 LYS N 1 54 LYS CA 1 54 LYS C -139.00 -105.00 -123.15 -131.09 -117.07 . . 0 "[ . 1 . 2]"
62 . 1 54 LYS N 1 54 LYS CA 1 54 LYS C 1 55 TYR N 127.00 159.00 154.28 138.66 159.20 0.20 5 0 "[ . 1 . 2]"
63 . 1 54 LYS C 1 55 TYR N 1 55 TYR CA 1 55 TYR C -109.00 -63.00 -93.12 -92.56 -93.59 . . 0 "[ . 1 . 2]"
64 . 1 55 TYR N 1 55 TYR CA 1 55 TYR C 1 56 ASP N 98.00 144.00 119.55 112.60 122.84 . . 0 "[ . 1 . 2]"
65 . 1 55 TYR C 1 56 ASP N 1 56 ASP CA 1 56 ASP C -94.00 -48.00 -60.31 -58.87 -59.30 . . 0 "[ . 1 . 2]"
66 . 1 56 ASP N 1 56 ASP CA 1 56 ASP C 1 57 ASP N -42.00 -26.00 -39.07 -38.57 -38.72 . . 0 "[ . 1 . 2]"
67 . 1 62 GLY C 1 63 VAL N 1 63 VAL CA 1 63 VAL C -121.00 -81.00 -118.32 -121.83 -97.08 0.83 18 0 "[ . 1 . 2]"
68 . 1 63 VAL N 1 63 VAL CA 1 63 VAL C 1 64 VAL N 119.00 139.00 130.73 130.01 128.46 0.82 18 0 "[ . 1 . 2]"
69 . 1 63 VAL C 1 64 VAL N 1 64 VAL CA 1 64 VAL C -101.00 -77.00 -109.94 -109.99 -110.40 10.21 12 20 [***-*******+********]
70 . 1 64 VAL N 1 64 VAL CA 1 64 VAL C 1 65 GLN N 117.00 149.00 138.18 131.08 149.36 0.36 12 0 "[ . 1 . 2]"
71 . 1 64 VAL C 1 65 GLN N 1 65 GLN CA 1 65 GLN C -119.00 -69.00 -108.57 -114.22 -97.69 . . 0 "[ . 1 . 2]"
72 . 1 65 GLN N 1 65 GLN CA 1 65 GLN C 1 66 MET N 121.00 145.00 123.20 120.57 131.48 0.43 5 0 "[ . 1 . 2]"
73 . 1 65 GLN C 1 66 MET N 1 66 MET CA 1 66 MET C -148.00 -102.00 -143.22 -148.04 -137.51 0.04 12 0 "[ . 1 . 2]"
74 . 1 66 MET N 1 66 MET CA 1 66 MET C 1 67 ASN N 106.00 170.00 163.72 160.42 155.71 . . 0 "[ . 1 . 2]"
75 . 1 67 ASN C 1 68 SER N 1 68 SER CA 1 68 SER C -110.00 -64.00 -63.39 -63.52 -63.56 1.29 8 0 "[ . 1 . 2]"
76 . 1 68 SER N 1 68 SER CA 1 68 SER C 1 69 ARG N -30.00 18.00 -29.34 -30.86 -27.01 0.86 11 0 "[ . 1 . 2]"
77 . 1 69 ARG C 1 70 ASP N 1 70 ASP CA 1 70 ASP C -99.00 -79.00 -92.64 -91.30 -92.60 0.15 4 0 "[ . 1 . 2]"
78 . 1 70 ASP N 1 70 ASP CA 1 70 ASP C 1 71 VAL N -31.00 3.00 -1.44 -19.47 3.14 0.14 8 0 "[ . 1 . 2]"
79 . 1 73 ALA C 1 74 ARG N 1 74 ARG CA 1 74 ARG C -135.00 -63.00 -66.54 -71.93 -62.40 0.60 15 0 "[ . 1 . 2]"
80 . 1 74 ARG N 1 74 ARG CA 1 74 ARG C 1 75 ALA N 127.00 147.00 139.08 132.12 143.77 . . 0 "[ . 1 . 2]"
81 . 1 74 ARG C 1 75 ALA N 1 75 ALA CA 1 75 ALA C -77.00 -57.00 -65.51 -73.65 -58.90 . . 0 "[ . 1 . 2]"
82 . 1 75 ALA N 1 75 ALA CA 1 75 ALA C 1 76 ARG N 118.00 142.00 142.21 142.38 142.29 0.80 3 0 "[ . 1 . 2]"
83 . 1 76 ARG C 1 77 THR N 1 77 THR CA 1 77 THR C -131.00 -99.00 -115.18 -126.76 -98.52 0.48 19 0 "[ . 1 . 2]"
84 . 1 77 THR N 1 77 THR CA 1 77 THR C 1 78 ILE N 112.00 132.00 132.84 133.50 133.13 1.83 2 0 "[ . 1 . 2]"
85 . 1 77 THR C 1 78 ILE N 1 78 ILE CA 1 78 ILE C -100.00 -88.00 -101.14 -101.04 -101.26 2.36 8 0 "[ . 1 . 2]"
86 . 1 78 ILE N 1 78 ILE CA 1 78 ILE C 1 79 ILE N 111.00 127.00 130.99 129.78 131.36 4.36 8 0 "[ . 1 . 2]"
87 . 1 78 ILE C 1 79 ILE N 1 79 ILE CA 1 79 ILE C -131.00 -93.00 -98.55 -110.51 -92.77 0.23 20 0 "[ . 1 . 2]"
88 . 1 79 ILE N 1 79 ILE CA 1 79 ILE C 1 80 LYS N 106.00 150.00 136.20 139.25 135.75 . . 0 "[ . 1 . 2]"
89 . 1 80 LYS C 1 81 TRP N 1 81 TRP CA 1 81 TRP C -69.00 -47.00 -48.95 -55.39 -45.39 1.61 9 0 "[ . 1 . 2]"
90 . 1 81 TRP N 1 81 TRP CA 1 81 TRP C 1 82 GLN N -55.00 -31.00 -42.92 -42.71 -43.69 . . 0 "[ . 1 . 2]"
91 . 1 81 TRP C 1 82 GLN N 1 82 GLN CA 1 82 GLN C -72.00 -58.00 -64.62 -63.51 -64.34 . . 0 "[ . 1 . 2]"
92 . 1 82 GLN N 1 82 GLN CA 1 82 GLN C 1 83 ASP N -50.00 -16.00 -30.37 -32.48 -23.23 . . 0 "[ . 1 . 2]"
93 . 1 82 GLN C 1 83 ASP N 1 83 ASP CA 1 83 ASP C -106.00 -86.00 -91.80 -92.16 -93.60 0.33 5 0 "[ . 1 . 2]"
94 . 1 83 ASP N 1 83 ASP CA 1 83 ASP C 1 84 LEU N -25.00 9.00 9.24 8.28 9.59 0.59 10 0 "[ . 1 . 2]"
95 . 1 83 ASP C 1 84 LEU N 1 84 LEU CA 1 84 LEU C -113.00 -55.00 -78.91 -90.07 -72.84 . . 0 "[ . 1 . 2]"
96 . 1 84 LEU N 1 84 LEU CA 1 84 LEU C 1 85 GLU N 113.00 157.00 138.73 136.51 135.52 . . 0 "[ . 1 . 2]"
97 . 1 85 GLU C 1 86 VAL N 1 86 VAL CA 1 86 VAL C -96.00 -42.00 -95.38 -96.88 -91.44 0.88 19 0 "[ . 1 . 2]"
98 . 1 86 VAL N 1 86 VAL CA 1 86 VAL C 1 87 GLY N 129.00 143.00 134.43 133.97 133.34 . . 0 "[ . 1 . 2]"
99 . 1 88 GLN C 1 89 VAL N 1 89 VAL CA 1 89 VAL C -101.00 -69.00 -99.04 -101.42 -92.40 0.42 3 0 "[ . 1 . 2]"
100 . 1 89 VAL N 1 89 VAL CA 1 89 VAL C 1 90 VAL N 118.00 150.00 127.70 124.21 131.06 . . 0 "[ . 1 . 2]"
101 . 1 89 VAL C 1 90 VAL N 1 90 VAL CA 1 90 VAL C -141.00 -107.00 -135.26 -137.95 -132.38 . . 0 "[ . 1 . 2]"
102 . 1 90 VAL N 1 90 VAL CA 1 90 VAL C 1 91 MET N 155.00 173.00 164.00 160.72 166.71 . . 0 "[ . 1 . 2]"
103 . 1 90 VAL C 1 91 MET N 1 91 MET CA 1 91 MET C -147.00 -113.00 -111.53 -111.43 -111.60 1.93 18 0 "[ . 1 . 2]"
104 . 1 91 MET N 1 91 MET CA 1 91 MET C 1 92 LEU N 127.00 161.00 133.17 130.36 136.39 . . 0 "[ . 1 . 2]"
105 . 1 91 MET C 1 92 LEU N 1 92 LEU CA 1 92 LEU C -140.00 -112.00 -139.48 -139.96 -140.07 0.61 17 0 "[ . 1 . 2]"
106 . 1 92 LEU N 1 92 LEU CA 1 92 LEU C 1 93 ASN N 145.00 171.00 171.18 171.49 171.43 0.90 9 0 "[ . 1 . 2]"
107 . 1 92 LEU C 1 93 ASN N 1 93 ASN CA 1 93 ASN C -113.00 -83.00 -89.56 -91.67 -93.44 . . 0 "[ . 1 . 2]"
108 . 1 93 ASN N 1 93 ASN CA 1 93 ASN C 1 94 TYR N 114.00 142.00 117.40 113.76 120.63 0.24 7 0 "[ . 1 . 2]"
109 . 1 93 ASN C 1 94 TYR N 1 94 TYR CA 1 94 TYR C -130.00 -96.00 -127.42 -128.06 -128.56 0.11 18 0 "[ . 1 . 2]"
110 . 1 94 TYR N 1 94 TYR CA 1 94 TYR C 1 95 ASN N 118.00 140.00 135.84 133.79 133.38 . . 0 "[ . 1 . 2]"
111 . 1 95 ASN C 1 96 PRO N 1 96 PRO CA 1 96 PRO C -70.00 -50.00 -52.70 -53.72 -54.07 0.00 18 0 "[ . 1 . 2]"
112 . 1 96 PRO N 1 96 PRO CA 1 96 PRO C 1 97 ASP N -42.00 -24.00 -42.00 -42.08 -42.13 0.22 13 0 "[ . 1 . 2]"
113 . 1 96 PRO C 1 97 ASP N 1 97 ASP CA 1 97 ASP C -107.00 -63.00 -65.31 -66.65 -64.12 . . 0 "[ . 1 . 2]"
114 . 1 97 ASP N 1 97 ASP CA 1 97 ASP C 1 98 ASN N -42.00 -14.00 -44.25 -45.02 -43.77 3.02 14 0 "[ . 1 . 2]"
115 . 1 97 ASP C 1 98 ASN N 1 98 ASN CA 1 98 ASN C -138.00 -88.00 -139.91 -140.91 -137.79 2.92 13 0 "[ . 1 . 2]"
116 . 1 98 ASN N 1 98 ASN CA 1 98 ASN C 1 99 PRO N 60.00 86.00 80.43 78.20 82.83 . . 0 "[ . 1 . 2]"
117 . 1 98 ASN C 1 99 PRO N 1 99 PRO CA 1 99 PRO C -64.00 -50.00 -53.11 -52.56 -53.00 . . 0 "[ . 1 . 2]"
118 . 1 99 PRO N 1 99 PRO CA 1 99 PRO C 1 100 LYS N -36.00 -16.00 -22.05 -23.08 -21.14 . . 0 "[ . 1 . 2]"
119 . 1 100 LYS C 1 101 GLU N 1 101 GLU CA 1 101 GLU C -152.00 -108.00 -117.21 -119.65 -114.34 . . 0 "[ . 1 . 2]"
120 . 1 101 GLU N 1 101 GLU CA 1 101 GLU C 1 102 ARG N -177.00 -155.00 -169.05 -172.15 -166.73 . . 0 "[ . 1 . 2]"
121 . 1 101 GLU C 1 102 ARG N 1 102 ARG CA 1 102 ARG C -134.00 -74.00 -71.62 -71.55 -71.57 2.66 10 0 "[ . 1 . 2]"
122 . 1 102 ARG N 1 102 ARG CA 1 102 ARG C 1 103 GLY N 121.00 147.00 152.78 151.92 153.47 6.47 8 18 "[*** **-+***********2]"
123 . 1 102 ARG C 1 103 GLY N 1 103 GLY CA 1 103 GLY C -129.00 -63.00 -134.13 -136.08 -127.81 7.08 19 15 "[ ***.** -*****.** +*]"
124 . 1 103 GLY N 1 103 GLY CA 1 103 GLY C 1 104 PHE N 140.00 164.00 174.23 174.22 174.06 10.66 6 20 [*****+***********-**]
125 . 1 105 TRP C 1 106 TYR N 1 106 TYR CA 1 106 TYR C -150.00 -96.00 -105.06 -112.18 -100.16 . . 0 "[ . 1 . 2]"
126 . 1 106 TYR N 1 106 TYR CA 1 106 TYR C 1 107 ASP N 133.00 161.00 140.53 137.91 134.32 . . 0 "[ . 1 . 2]"
127 . 1 108 ALA C 1 109 GLU N 1 109 GLU CA 1 109 GLU C -142.00 -90.00 -111.34 -111.34 -112.83 . . 0 "[ . 1 . 2]"
128 . 1 109 GLU N 1 109 GLU CA 1 109 GLU C 1 110 ILE N 125.00 155.00 155.20 155.25 155.20 0.39 14 0 "[ . 1 . 2]"
129 . 1 109 GLU C 1 110 ILE N 1 110 ILE CA 1 110 ILE C -107.00 -65.00 -81.62 -88.05 -75.11 . . 0 "[ . 1 . 2]"
130 . 1 110 ILE N 1 110 ILE CA 1 110 ILE C 1 111 SER N 113.00 133.00 118.83 118.78 118.44 0.24 7 0 "[ . 1 . 2]"
131 . 1 111 SER C 1 112 ARG N 1 112 ARG CA 1 112 ARG C -161.00 -77.00 -149.68 -146.57 -148.31 0.09 19 0 "[ . 1 . 2]"
132 . 1 112 ARG N 1 112 ARG CA 1 112 ARG C 1 113 LYS N 119.00 157.00 145.06 140.40 153.19 . . 0 "[ . 1 . 2]"
133 . 1 112 ARG C 1 113 LYS N 1 113 LYS CA 1 113 LYS C -148.00 -98.00 -108.40 -101.78 -105.14 0.11 20 0 "[ . 1 . 2]"
134 . 1 113 LYS N 1 113 LYS CA 1 113 LYS C 1 114 ARG N 114.00 140.00 131.62 125.52 136.95 . . 0 "[ . 1 . 2]"
135 . 1 113 LYS C 1 114 ARG N 1 114 ARG CA 1 114 ARG C -154.00 -114.00 -135.15 -135.48 -135.55 . . 0 "[ . 1 . 2]"
136 . 1 114 ARG N 1 114 ARG CA 1 114 ARG C 1 115 GLU N 129.00 153.00 135.51 131.94 137.96 . . 0 "[ . 1 . 2]"
137 . 1 114 ARG C 1 115 GLU N 1 115 GLU CA 1 115 GLU C -141.00 -107.00 -120.47 -115.02 -116.72 . . 0 "[ . 1 . 2]"
138 . 1 115 GLU N 1 115 GLU CA 1 115 GLU C 1 116 THR N 113.00 147.00 147.07 147.09 147.06 0.39 8 0 "[ . 1 . 2]"
139 . 1 115 GLU C 1 116 THR N 1 116 THR CA 1 116 THR C -128.00 -80.00 -116.32 -114.34 -115.10 . . 0 "[ . 1 . 2]"
140 . 1 116 THR N 1 116 THR CA 1 116 THR C 1 117 ARG N 151.00 177.00 166.95 164.85 169.59 . . 0 "[ . 1 . 2]"
141 . 1 118 THR C 1 119 ALA N 1 119 ALA CA 1 119 ALA C -168.00 -110.00 -153.09 -155.61 -150.92 . . 0 "[ . 1 . 2]"
142 . 1 119 ALA N 1 119 ALA CA 1 119 ALA C 1 120 ARG N 122.00 164.00 158.15 157.23 155.41 . . 0 "[ . 1 . 2]"
143 . 1 119 ALA C 1 120 ARG N 1 120 ARG CA 1 120 ARG C -159.00 -95.00 -124.23 -123.23 -124.46 . . 0 "[ . 1 . 2]"
144 . 1 120 ARG N 1 120 ARG CA 1 120 ARG C 1 121 GLU N 112.00 150.00 137.29 136.65 136.39 . . 0 "[ . 1 . 2]"
145 . 1 120 ARG C 1 121 GLU N 1 121 GLU CA 1 121 GLU C -138.00 -102.00 -132.07 -127.61 -129.76 0.40 12 0 "[ . 1 . 2]"
146 . 1 121 GLU N 1 121 GLU CA 1 121 GLU C 1 122 LEU N 127.00 153.00 132.49 133.83 130.37 1.26 12 0 "[ . 1 . 2]"
147 . 1 121 GLU C 1 122 LEU N 1 122 LEU CA 1 122 LEU C -126.00 -86.00 -122.32 -127.38 -116.45 1.38 12 0 "[ . 1 . 2]"
148 . 1 122 LEU N 1 122 LEU CA 1 122 LEU C 1 123 TYR N 119.00 143.00 140.14 134.93 143.55 0.55 18 0 "[ . 1 . 2]"
149 . 1 122 LEU C 1 123 TYR N 1 123 TYR CA 1 123 TYR C -136.00 -114.00 -113.60 -114.02 -113.19 0.81 18 0 "[ . 1 . 2]"
150 . 1 123 TYR N 1 123 TYR CA 1 123 TYR C 1 124 ALA N 136.00 166.00 133.03 132.33 133.97 3.67 10 0 "[ . 1 . 2]"
151 . 1 123 TYR C 1 124 ALA N 1 124 ALA CA 1 124 ALA C -141.00 -101.00 -144.27 -144.35 -144.44 3.72 11 0 "[ . 1 . 2]"
152 . 1 124 ALA N 1 124 ALA CA 1 124 ALA C 1 125 ASN N 128.00 156.00 159.45 158.96 160.25 4.25 1 0 "[ . 1 . 2]"
153 . 1 124 ALA C 1 125 ASN N 1 125 ASN CA 1 125 ASN C -139.00 -107.00 -103.55 -104.04 -102.85 4.15 1 0 "[ . 1 . 2]"
154 . 1 125 ASN N 1 125 ASN CA 1 125 ASN C 1 126 VAL N 109.00 131.00 126.57 121.36 131.71 0.71 8 0 "[ . 1 . 2]"
155 . 1 125 ASN C 1 126 VAL N 1 126 VAL CA 1 126 VAL C -112.00 -70.00 -109.75 -112.43 -100.32 0.43 13 0 "[ . 1 . 2]"
156 . 1 126 VAL N 1 126 VAL CA 1 126 VAL C 1 127 VAL N 110.00 136.00 136.16 135.08 136.46 0.46 6 0 "[ . 1 . 2]"
157 . 1 126 VAL C 1 127 VAL N 1 127 VAL CA 1 127 VAL C -119.00 -95.00 -118.27 -120.46 -111.61 1.46 2 0 "[ . 1 . 2]"
158 . 1 127 VAL N 1 127 VAL CA 1 127 VAL C 1 128 LEU N 112.00 138.00 133.38 136.28 131.82 0.08 4 0 "[ . 1 . 2]"
159 . 1 127 VAL C 1 128 LEU N 1 128 LEU CA 1 128 LEU C -138.00 -84.00 -98.58 -102.35 -96.80 . . 0 "[ . 1 . 2]"
160 . 1 128 LEU N 1 128 LEU CA 1 128 LEU C 1 129 GLY N 106.00 174.00 163.42 159.99 166.00 . . 0 "[ . 1 . 2]"
161 . 1 130 ASP C 1 131 ASP N 1 131 ASP CA 1 131 ASP C -138.00 -86.00 -93.99 -85.46 -85.50 0.88 4 0 "[ . 1 . 2]"
162 . 1 131 ASP N 1 131 ASP CA 1 131 ASP C 1 132 SER N 145.00 157.00 157.31 156.26 158.40 1.40 13 0 "[ . 1 . 2]"
163 . 1 131 ASP C 1 132 SER N 1 132 SER CA 1 132 SER C -145.00 -109.00 -116.64 -118.26 -113.92 . . 0 "[ . 1 . 2]"
164 . 1 132 SER N 1 132 SER CA 1 132 SER C 1 133 LEU N 114.00 154.00 150.81 150.63 150.14 0.86 7 0 "[ . 1 . 2]"
165 . 1 132 SER C 1 133 LEU N 1 133 LEU CA 1 133 LEU C -174.00 -146.00 -141.56 -141.62 -141.68 6.82 7 1 "[ . + 1 . 2]"
166 . 1 133 LEU N 1 133 LEU CA 1 133 LEU C 1 134 ASN N 22.00 30.00 38.93 38.00 39.68 9.68 9 20 [********+*-*********]
167 . 1 136 CYS C 1 137 ARG N 1 137 ARG CA 1 137 ARG C -147.00 -93.00 -95.55 -115.64 -92.18 0.82 14 0 "[ . 1 . 2]"
168 . 1 137 ARG N 1 137 ARG CA 1 137 ARG C 1 138 ILE N 108.00 140.00 141.34 141.36 141.30 1.73 16 0 "[ . 1 . 2]"
169 . 1 137 ARG C 1 138 ILE N 1 138 ILE CA 1 138 ILE C -135.00 -99.00 -101.86 -99.21 -100.09 0.32 6 0 "[ . 1 . 2]"
170 . 1 138 ILE N 1 138 ILE CA 1 138 ILE C 1 139 ILE N 116.00 136.00 116.11 115.46 118.85 0.54 6 0 "[ . 1 . 2]"
171 . 1 142 ASP C 1 143 GLU N 1 143 GLU CA 1 143 GLU C -130.00 -68.00 -110.22 -128.53 -81.45 . . 0 "[ . 1 . 2]"
172 . 1 143 GLU N 1 143 GLU CA 1 143 GLU C 1 144 VAL N 88.00 132.00 86.80 87.28 87.17 2.39 16 0 "[ . 1 . 2]"
173 . 1 143 GLU C 1 144 VAL N 1 144 VAL CA 1 144 VAL C -118.00 -98.00 -123.61 -123.08 -123.24 7.15 16 16 "[* -********* *+** *]"
174 . 1 144 VAL N 1 144 VAL CA 1 144 VAL C 1 145 PHE N 115.00 139.00 134.94 129.84 139.26 0.26 16 0 "[ . 1 . 2]"
175 . 1 144 VAL C 1 145 PHE N 1 145 PHE CA 1 145 PHE C -132.00 -106.00 -127.83 -130.14 -130.76 0.31 16 0 "[ . 1 . 2]"
176 . 1 145 PHE N 1 145 PHE CA 1 145 PHE C 1 146 LYS N 136.00 162.00 147.61 147.59 147.39 . . 0 "[ . 1 . 2]"
177 . 1 145 PHE C 1 146 LYS N 1 146 LYS CA 1 146 LYS C -137.00 -101.00 -99.88 -100.01 -100.17 1.97 12 0 "[ . 1 . 2]"
178 . 1 146 LYS N 1 146 LYS CA 1 146 LYS C 1 147 ILE N 123.00 147.00 146.57 147.94 147.68 1.65 4 0 "[ . 1 . 2]"
179 . 1 146 LYS C 1 147 ILE N 1 147 ILE CA 1 147 ILE C -124.00 -70.00 -99.67 -91.66 -101.10 . . 0 "[ . 1 . 2]"
180 . 1 147 ILE N 1 147 ILE CA 1 147 ILE C 1 148 GLU N 115.00 133.00 133.75 133.21 134.04 1.04 12 0 "[ . 1 . 2]"
181 . 1 147 ILE C 1 148 GLU N 1 148 GLU CA 1 148 GLU C -113.00 -87.00 -96.01 -95.89 -96.98 0.07 2 0 "[ . 1 . 2]"
182 . 1 148 GLU N 1 148 GLU CA 1 148 GLU C 1 149 ARG N 118.00 150.00 148.44 142.36 150.42 0.42 18 0 "[ . 1 . 2]"
183 . 1 148 GLU C 1 149 ARG N 1 149 ARG CA 1 149 ARG C -150.00 -128.00 -130.83 -138.52 -127.65 0.35 18 0 "[ . 1 . 2]"
184 . 1 149 ARG N 1 149 ARG CA 1 149 ARG C 1 150 PRO N 137.00 161.00 159.99 155.96 161.36 0.36 11 0 "[ . 1 . 2]"
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