NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
431135 |
2jpi   |
15246 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2jpi
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 144
_TA_constraint_stats_list.Viol_count 642
_TA_constraint_stats_list.Viol_total 11615.95
_TA_constraint_stats_list.Viol_max 3.87
_TA_constraint_stats_list.Viol_rms 0.53
_TA_constraint_stats_list.Viol_average_all_restraints 0.20
_TA_constraint_stats_list.Viol_average_violations_only 0.90
_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 23 MET C 1 24 PHE N 1 24 PHE CA 1 24 PHE C -128.00 -76.00 -94.80 -89.11 -94.28 . . 0 "[ . 1 . 2]"
2 . 1 24 PHE C 1 25 ARG N 1 25 ARG CA 1 25 ARG C -168.00 -96.00 -148.45 -147.93 -148.25 . . 0 "[ . 1 . 2]"
3 . 1 25 ARG C 1 26 SER N 1 26 SER CA 1 26 SER C -152.00 -100.00 -115.86 -114.47 -114.89 . . 0 "[ . 1 . 2]"
4 . 1 26 SER C 1 27 THR N 1 27 THR CA 1 27 THR C -145.00 -105.00 -145.91 -145.85 -145.89 1.08 20 0 "[ . 1 . 2]"
5 . 1 27 THR C 1 28 SER N 1 28 SER CA 1 28 SER C -174.00 -78.00 -109.45 -113.60 -107.03 . . 0 "[ . 1 . 2]"
6 . 1 28 SER C 1 29 HIS N 1 29 HIS CA 1 29 HIS C -142.00 -62.00 -114.85 -117.35 -119.12 . . 0 "[ . 1 . 2]"
7 . 1 29 HIS C 1 30 VAL N 1 30 VAL CA 1 30 VAL C -139.00 -75.00 -140.19 -140.49 -139.83 1.49 17 0 "[ . 1 . 2]"
8 . 1 30 VAL C 1 31 ARG N 1 31 ARG CA 1 31 ARG C -134.00 -46.00 -99.98 -101.85 -98.77 . . 0 "[ . 1 . 2]"
9 . 1 31 ARG C 1 32 THR N 1 32 THR CA 1 32 THR C -127.00 -51.00 -130.22 -130.87 -129.91 3.87 13 0 "[ . 1 . 2]"
10 . 1 34 SER C 1 35 ALA N 1 35 ALA CA 1 35 ALA C -79.00 -39.00 -51.38 -53.08 -50.12 . . 0 "[ . 1 . 2]"
11 . 1 35 ALA C 1 36 ALA N 1 36 ALA CA 1 36 ALA C -82.00 -42.00 -42.49 -52.12 -41.39 0.61 14 0 "[ . 1 . 2]"
12 . 1 36 ALA C 1 37 ARG N 1 37 ARG CA 1 37 ARG C -81.00 -41.00 -80.44 -81.73 -75.79 0.73 2 0 "[ . 1 . 2]"
13 . 1 37 ARG C 1 38 TYR N 1 38 TYR CA 1 38 TYR C -85.00 -45.00 -65.44 -64.99 -65.30 . . 0 "[ . 1 . 2]"
14 . 1 38 TYR C 1 39 VAL N 1 39 VAL CA 1 39 VAL C -84.00 -44.00 -76.31 -84.50 -56.34 0.50 16 0 "[ . 1 . 2]"
15 . 1 39 VAL C 1 40 ASN N 1 40 ASN CA 1 40 ASN C -81.00 -41.00 -70.17 -76.61 -68.03 . . 0 "[ . 1 . 2]"
16 . 1 40 ASN C 1 41 ARG N 1 41 ARG CA 1 41 ARG C -87.00 -47.00 -78.56 -77.50 -77.57 . . 0 "[ . 1 . 2]"
17 . 1 41 ARG C 1 42 LEU N 1 42 LEU CA 1 42 LEU C -84.00 -44.00 -69.45 -74.24 -57.53 . . 0 "[ . 1 . 2]"
18 . 1 42 LEU C 1 43 CYS N 1 43 CYS CA 1 43 CYS C -85.00 -45.00 -54.64 -55.74 -56.15 . . 0 "[ . 1 . 2]"
19 . 1 43 CYS C 1 44 LYS N 1 44 LYS CA 1 44 LYS C -84.00 -44.00 -80.84 -80.93 -81.88 0.46 11 0 "[ . 1 . 2]"
20 . 1 44 LYS C 1 45 HIS N 1 45 HIS CA 1 45 HIS C -84.00 -44.00 -84.83 -84.87 -84.96 1.54 17 0 "[ . 1 . 2]"
21 . 1 45 HIS C 1 46 TRP N 1 46 TRP CA 1 46 TRP C -107.00 -51.00 -86.51 -84.55 -86.09 . . 0 "[ . 1 . 2]"
22 . 1 47 GLY C 1 48 HIS N 1 48 HIS CA 1 48 HIS C -127.00 -39.00 -111.06 -110.68 -110.80 . . 0 "[ . 1 . 2]"
23 . 1 49 LYS C 1 50 PHE N 1 50 PHE CA 1 50 PHE C -140.00 -64.00 -139.72 -140.24 -140.30 0.30 1 0 "[ . 1 . 2]"
24 . 1 50 PHE C 1 51 GLU N 1 51 GLU CA 1 51 GLU C -137.00 -73.00 -78.51 -80.25 -82.21 . . 0 "[ . 1 . 2]"
25 . 1 51 GLU C 1 52 VAL N 1 52 VAL CA 1 52 VAL C -149.00 -105.00 -117.07 -129.53 -104.92 0.08 18 0 "[ . 1 . 2]"
26 . 1 52 VAL C 1 53 GLU N 1 53 GLU CA 1 53 GLU C -169.00 -93.00 -94.79 -92.90 -92.95 0.25 2 0 "[ . 1 . 2]"
27 . 1 53 GLU C 1 54 LEU N 1 54 LEU CA 1 54 LEU C -149.00 -85.00 -132.25 -141.43 -116.13 . . 0 "[ . 1 . 2]"
28 . 1 54 LEU C 1 55 THR N 1 55 THR CA 1 55 THR C -159.00 -75.00 -127.13 -129.88 -122.66 . . 0 "[ . 1 . 2]"
29 . 1 57 GLU C 1 58 ARG N 1 58 ARG CA 1 58 ARG C -169.00 -77.00 -170.18 -170.17 -170.26 1.52 20 0 "[ . 1 . 2]"
30 . 1 58 ARG C 1 59 GLY N 1 59 GLY CA 1 59 GLY C -160.00 -96.00 -110.31 -114.47 -106.35 . . 0 "[ . 1 . 2]"
31 . 1 59 GLY C 1 60 PHE N 1 60 PHE CA 1 60 PHE C -144.00 -100.00 -111.87 -134.42 -99.65 0.35 9 0 "[ . 1 . 2]"
32 . 1 60 PHE C 1 61 ILE N 1 61 ILE CA 1 61 ILE C -159.00 -87.00 -131.50 -134.92 -136.15 . . 0 "[ . 1 . 2]"
33 . 1 61 ILE C 1 62 ASP N 1 62 ASP CA 1 62 ASP C -151.00 -47.00 -107.05 -99.24 -101.70 . . 0 "[ . 1 . 2]"
34 . 1 66 SER C 1 67 ASN N 1 67 ASN CA 1 67 ASN C -167.00 -127.00 -156.58 -167.98 -146.49 0.98 4 0 "[ . 1 . 2]"
35 . 1 67 ASN C 1 68 CYS N 1 68 CYS CA 1 68 CYS C -170.00 -86.00 -151.72 -156.14 -149.35 . . 0 "[ . 1 . 2]"
36 . 1 68 CYS C 1 69 GLU N 1 69 GLU CA 1 69 GLU C -153.00 -77.00 -101.26 -106.10 -94.82 . . 0 "[ . 1 . 2]"
37 . 1 69 GLU C 1 70 LEU N 1 70 LEU CA 1 70 LEU C -144.00 -104.00 -140.79 -143.80 -134.50 . . 0 "[ . 1 . 2]"
38 . 1 70 LEU C 1 71 LEU N 1 71 LEU CA 1 71 LEU C -152.00 -72.00 -89.93 -95.08 -84.85 . . 0 "[ . 1 . 2]"
39 . 1 71 LEU C 1 72 ALA N 1 72 ALA CA 1 72 ALA C -144.00 -64.00 -142.00 -139.95 -141.58 0.61 20 0 "[ . 1 . 2]"
40 . 1 76 HIS C 1 77 VAL N 1 77 VAL CA 1 77 VAL C -154.00 -106.00 -140.62 -140.98 -141.30 . . 0 "[ . 1 . 2]"
41 . 1 77 VAL C 1 78 LEU N 1 78 LEU CA 1 78 LEU C -144.00 -92.00 -119.45 -120.63 -120.89 . . 0 "[ . 1 . 2]"
42 . 1 78 LEU C 1 79 MET N 1 79 MET CA 1 79 MET C -149.00 -97.00 -127.29 -128.32 -128.73 . . 0 "[ . 1 . 2]"
43 . 1 79 MET C 1 80 ILE N 1 80 ILE CA 1 80 ILE C -151.00 -95.00 -124.80 -125.96 -122.61 . . 0 "[ . 1 . 2]"
44 . 1 80 ILE C 1 81 LEU N 1 81 LEU CA 1 81 LEU C -151.00 -103.00 -121.71 -121.85 -122.33 . . 0 "[ . 1 . 2]"
45 . 1 81 LEU C 1 82 ASN N 1 82 ASN CA 1 82 ASN C -151.00 -95.00 -121.75 -133.64 -119.30 . . 0 "[ . 1 . 2]"
46 . 1 82 ASN C 1 83 SER N 1 83 SER CA 1 83 SER C -163.00 -111.00 -145.84 -150.32 -140.44 . . 0 "[ . 1 . 2]"
47 . 1 84 PRO C 1 85 ASP N 1 85 ASP CA 1 85 ASP C -174.00 -62.00 -140.78 -147.98 -133.25 . . 0 "[ . 1 . 2]"
48 . 1 85 ASP C 1 86 GLU N 1 86 GLU CA 1 86 GLU C -77.00 -37.00 -59.86 -58.40 -58.83 . . 0 "[ . 1 . 2]"
49 . 1 86 GLU C 1 87 ASP N 1 87 ASP CA 1 87 ASP C -87.00 -47.00 -48.04 -49.54 -46.82 0.18 9 0 "[ . 1 . 2]"
50 . 1 87 ASP C 1 88 SER N 1 88 SER CA 1 88 SER C -89.00 -49.00 -61.28 -61.05 -61.14 . . 0 "[ . 1 . 2]"
51 . 1 88 SER C 1 89 LEU N 1 89 LEU CA 1 89 LEU C -81.00 -41.00 -40.06 -40.22 -40.28 1.38 18 0 "[ . 1 . 2]"
52 . 1 89 LEU C 1 90 ALA N 1 90 ALA CA 1 90 ALA C -84.00 -44.00 -65.75 -66.81 -64.24 . . 0 "[ . 1 . 2]"
53 . 1 90 ALA C 1 91 HIS N 1 91 HIS CA 1 91 HIS C -86.00 -46.00 -54.71 -53.62 -53.91 . . 0 "[ . 1 . 2]"
54 . 1 91 HIS C 1 92 MET N 1 92 MET CA 1 92 MET C -87.00 -47.00 -79.55 -81.10 -77.37 . . 0 "[ . 1 . 2]"
55 . 1 92 MET C 1 93 GLN N 1 93 GLN CA 1 93 GLN C -85.00 -45.00 -55.20 -55.34 -56.16 . . 0 "[ . 1 . 2]"
56 . 1 93 GLN C 1 94 ASN N 1 94 ASN CA 1 94 ASN C -82.00 -42.00 -81.83 -80.78 -82.01 0.31 14 0 "[ . 1 . 2]"
57 . 1 94 ASN C 1 95 VAL N 1 95 VAL CA 1 95 VAL C -84.00 -44.00 -45.41 -47.36 -43.92 0.08 13 0 "[ . 1 . 2]"
58 . 1 95 VAL C 1 96 VAL N 1 96 VAL CA 1 96 VAL C -83.00 -43.00 -70.53 -71.39 -71.45 . . 0 "[ . 1 . 2]"
59 . 1 96 VAL C 1 97 ALA N 1 97 ALA CA 1 97 ALA C -82.00 -42.00 -47.88 -49.82 -45.09 . . 0 "[ . 1 . 2]"
60 . 1 97 ALA C 1 98 ASP N 1 98 ASP CA 1 98 ASP C -84.00 -44.00 -76.68 -76.76 -76.94 . . 0 "[ . 1 . 2]"
61 . 1 98 ASP C 1 99 HIS N 1 99 HIS CA 1 99 HIS C -84.00 -44.00 -60.63 -58.61 -59.07 . . 0 "[ . 1 . 2]"
62 . 1 99 HIS C 1 100 LEU N 1 100 LEU CA 1 100 LEU C -83.00 -43.00 -64.71 -69.05 -58.96 . . 0 "[ . 1 . 2]"
63 . 1 100 LEU C 1 101 GLN N 1 101 GLN CA 1 101 GLN C -83.00 -43.00 -72.76 -78.81 -69.16 . . 0 "[ . 1 . 2]"
64 . 1 101 GLN C 1 102 ARG N 1 102 ARG CA 1 102 ARG C -89.00 -49.00 -58.52 -67.19 -52.39 . . 0 "[ . 1 . 2]"
65 . 1 102 ARG C 1 103 MET N 1 103 MET CA 1 103 MET C -107.00 -55.00 -81.24 -84.74 -77.10 . . 0 "[ . 1 . 2]"
66 . 1 106 SER C 1 107 GLU N 1 107 GLU CA 1 107 GLU C -170.00 -58.00 -139.21 -125.20 -153.99 0.24 8 0 "[ . 1 . 2]"
67 . 1 107 GLU C 1 108 SER N 1 108 SER CA 1 108 SER C -142.00 -58.00 -74.30 -89.90 -70.07 . . 0 "[ . 1 . 2]"
68 . 1 109 LEU C 1 110 GLU N 1 110 GLU CA 1 110 GLU C -123.00 -51.00 -71.18 -71.12 -71.19 . . 0 "[ . 1 . 2]"
69 . 1 110 GLU C 1 111 ILE N 1 111 ILE CA 1 111 ILE C -164.00 -48.00 -132.24 -132.77 -132.91 . . 0 "[ . 1 . 2]"
70 . 1 111 ILE C 1 112 ALA N 1 112 ALA CA 1 112 ALA C -124.00 -84.00 -96.46 -100.81 -83.90 0.10 6 0 "[ . 1 . 2]"
71 . 1 112 ALA C 1 113 TRP N 1 113 TRP CA 1 113 TRP C -130.00 -86.00 -93.89 -94.83 -94.96 . . 0 "[ . 1 . 2]"
72 . 1 113 TRP C 1 114 GLN N 1 114 GLN CA 1 114 GLN C -154.00 -90.00 -89.29 -89.67 -89.17 0.83 14 0 "[ . 1 . 2]"
73 . 1 24 PHE N 1 24 PHE CA 1 24 PHE C 1 25 ARG N 106.00 170.00 170.43 170.34 170.28 0.69 19 0 "[ . 1 . 2]"
74 . 1 25 ARG N 1 25 ARG CA 1 25 ARG C 1 26 SER N 118.00 178.00 125.16 124.37 128.34 . . 0 "[ . 1 . 2]"
75 . 1 26 SER N 1 26 SER CA 1 26 SER C 1 27 THR N 108.00 180.00 163.50 162.47 164.81 . . 0 "[ . 1 . 2]"
76 . 1 27 THR N 1 27 THR CA 1 27 THR C 1 28 SER N 119.00 167.00 127.30 127.77 127.07 . . 0 "[ . 1 . 2]"
77 . 1 28 SER N 1 28 SER CA 1 28 SER C 1 29 HIS N 102.00 162.00 130.70 124.74 135.31 . . 0 "[ . 1 . 2]"
78 . 1 29 HIS N 1 29 HIS CA 1 29 HIS C 1 30 VAL N 105.00 145.00 130.82 130.75 130.70 . . 0 "[ . 1 . 2]"
79 . 1 30 VAL N 1 30 VAL CA 1 30 VAL C 1 31 ARG N 105.00 153.00 153.49 153.57 153.55 0.61 15 0 "[ . 1 . 2]"
80 . 1 31 ARG N 1 31 ARG CA 1 31 ARG C 1 32 THR N 109.00 149.00 105.95 105.24 106.31 3.76 13 0 "[ . 1 . 2]"
81 . 1 32 THR N 1 32 THR CA 1 32 THR C 1 33 GLU N 83.00 155.00 156.90 156.97 156.94 2.35 16 0 "[ . 1 . 2]"
82 . 1 35 ALA N 1 35 ALA CA 1 35 ALA C 1 36 ALA N -61.00 -21.00 -52.33 -49.99 -51.18 . . 0 "[ . 1 . 2]"
83 . 1 36 ALA N 1 36 ALA CA 1 36 ALA C 1 37 ARG N -63.00 -23.00 -25.30 -28.28 -22.47 0.53 6 0 "[ . 1 . 2]"
84 . 1 37 ARG N 1 37 ARG CA 1 37 ARG C 1 38 TYR N -65.00 -25.00 -40.10 -39.40 -39.82 . . 0 "[ . 1 . 2]"
85 . 1 38 TYR N 1 38 TYR CA 1 38 TYR C 1 39 VAL N -64.00 -24.00 -26.69 -23.46 -23.63 1.00 16 0 "[ . 1 . 2]"
86 . 1 39 VAL N 1 39 VAL CA 1 39 VAL C 1 40 ASN N -66.00 -26.00 -44.07 -45.14 -45.84 . . 0 "[ . 1 . 2]"
87 . 1 40 ASN N 1 40 ASN CA 1 40 ASN C 1 41 ARG N -62.00 -22.00 -30.23 -38.27 -26.34 . . 0 "[ . 1 . 2]"
88 . 1 41 ARG N 1 41 ARG CA 1 41 ARG C 1 42 LEU N -59.00 -19.00 -19.82 -18.59 -18.62 0.70 17 0 "[ . 1 . 2]"
89 . 1 42 LEU N 1 42 LEU CA 1 42 LEU C 1 43 CYS N -61.00 -21.00 -47.26 -46.60 -46.87 . . 0 "[ . 1 . 2]"
90 . 1 43 CYS N 1 43 CYS CA 1 43 CYS C 1 44 LYS N -61.00 -21.00 -37.25 -42.96 -32.71 . . 0 "[ . 1 . 2]"
91 . 1 44 LYS N 1 44 LYS CA 1 44 LYS C 1 45 HIS N -61.00 -21.00 -20.52 -20.39 -20.45 1.41 16 0 "[ . 1 . 2]"
92 . 1 45 HIS N 1 45 HIS CA 1 45 HIS C 1 46 TRP N -65.00 -21.00 -61.58 -65.16 -58.92 0.16 5 0 "[ . 1 . 2]"
93 . 1 46 TRP N 1 46 TRP CA 1 46 TRP C 1 47 GLY N -70.00 34.00 -11.12 -13.24 -8.15 . . 0 "[ . 1 . 2]"
94 . 1 48 HIS N 1 48 HIS CA 1 48 HIS C 1 49 LYS N -50.00 -10.00 -28.85 -32.51 -25.48 . . 0 "[ . 1 . 2]"
95 . 1 50 PHE N 1 50 PHE CA 1 50 PHE C 1 51 GLU N 119.00 171.00 158.33 147.42 165.73 . . 0 "[ . 1 . 2]"
96 . 1 51 GLU N 1 51 GLU CA 1 51 GLU C 1 52 VAL N 89.00 161.00 104.35 115.48 111.44 0.29 10 0 "[ . 1 . 2]"
97 . 1 52 VAL N 1 52 VAL CA 1 52 VAL C 1 53 GLU N 112.00 176.00 115.91 111.35 125.05 0.65 20 0 "[ . 1 . 2]"
98 . 1 53 GLU N 1 53 GLU CA 1 53 GLU C 1 54 LEU N 109.00 157.00 150.53 152.08 141.03 0.41 16 0 "[ . 1 . 2]"
99 . 1 54 LEU N 1 54 LEU CA 1 54 LEU C 1 55 THR N 109.00 149.00 108.98 109.39 109.01 0.64 1 0 "[ . 1 . 2]"
100 . 1 55 THR N 1 55 THR CA 1 55 THR C 1 56 PRO N 97.00 169.00 159.41 150.40 166.13 . . 0 "[ . 1 . 2]"
101 . 1 58 ARG N 1 58 ARG CA 1 58 ARG C 1 59 GLY N 113.00 169.00 169.43 169.70 169.61 0.71 17 0 "[ . 1 . 2]"
102 . 1 59 GLY N 1 59 GLY CA 1 59 GLY C 1 60 PHE N 112.00 168.00 133.01 143.89 123.30 . . 0 "[ . 1 . 2]"
103 . 1 60 PHE N 1 60 PHE CA 1 60 PHE C 1 61 ILE N 103.00 163.00 118.21 111.92 127.18 . . 0 "[ . 1 . 2]"
104 . 1 61 ILE N 1 61 ILE CA 1 61 ILE C 1 62 ASP N 104.00 160.00 105.68 107.40 103.58 0.89 16 0 "[ . 1 . 2]"
105 . 1 62 ASP N 1 62 ASP CA 1 62 ASP C 1 63 PHE N 92.00 160.00 132.19 120.45 141.57 . . 0 "[ . 1 . 2]"
106 . 1 67 ASN N 1 67 ASN CA 1 67 ASN C 1 68 CYS N 129.00 177.00 167.53 166.07 160.84 . . 0 "[ . 1 . 2]"
107 . 1 68 CYS N 1 68 CYS CA 1 68 CYS C 1 69 GLU N 103.00 151.00 102.56 102.27 102.14 0.94 20 0 "[ . 1 . 2]"
108 . 1 69 GLU N 1 69 GLU CA 1 69 GLU C 1 70 LEU N 106.00 154.00 153.44 151.07 154.75 0.75 18 0 "[ . 1 . 2]"
109 . 1 70 LEU N 1 70 LEU CA 1 70 LEU C 1 71 LEU N 106.00 178.00 117.43 117.61 116.68 . . 0 "[ . 1 . 2]"
110 . 1 71 LEU N 1 71 LEU CA 1 71 LEU C 1 72 ALA N 105.00 149.00 131.09 127.46 132.50 . . 0 "[ . 1 . 2]"
111 . 1 72 ALA N 1 72 ALA CA 1 72 ALA C 1 73 HIS N 79.00 147.00 113.07 107.76 115.97 . . 0 "[ . 1 . 2]"
112 . 1 77 VAL N 1 77 VAL CA 1 77 VAL C 1 78 LEU N 117.00 157.00 137.87 136.29 138.73 . . 0 "[ . 1 . 2]"
113 . 1 78 LEU N 1 78 LEU CA 1 78 LEU C 1 79 MET N 114.00 154.00 145.10 146.55 146.49 . . 0 "[ . 1 . 2]"
114 . 1 79 MET N 1 79 MET CA 1 79 MET C 1 80 ILE N 115.00 155.00 113.87 113.56 114.08 1.44 18 0 "[ . 1 . 2]"
115 . 1 80 ILE N 1 80 ILE CA 1 80 ILE C 1 81 LEU N 102.00 142.00 137.57 138.73 138.32 . . 0 "[ . 1 . 2]"
116 . 1 81 LEU N 1 81 LEU CA 1 81 LEU C 1 82 ASN N 113.00 161.00 146.00 161.25 147.04 0.25 2 0 "[ . 1 . 2]"
117 . 1 82 ASN N 1 82 ASN CA 1 82 ASN C 1 83 SER N 104.00 172.00 102.82 102.33 103.03 1.67 2 0 "[ . 1 . 2]"
118 . 1 83 SER N 1 83 SER CA 1 83 SER C 1 84 PRO N 120.00 160.00 135.82 138.94 136.30 . . 0 "[ . 1 . 2]"
119 . 1 85 ASP N 1 85 ASP CA 1 85 ASP C 1 86 GLU N 109.00 -163.00 147.57 147.09 146.46 . . 0 "[ . 1 . 2]"
120 . 1 86 GLU N 1 86 GLU CA 1 86 GLU C 1 87 ASP N -59.00 -19.00 -43.02 -41.80 -42.44 . . 0 "[ . 1 . 2]"
121 . 1 87 ASP N 1 87 ASP CA 1 87 ASP C 1 88 SER N -53.00 -13.00 -54.39 -54.61 -54.28 1.61 16 0 "[ . 1 . 2]"
122 . 1 88 SER N 1 88 SER CA 1 88 SER C 1 89 LEU N -60.00 -20.00 -56.80 -56.74 -56.80 . . 0 "[ . 1 . 2]"
123 . 1 89 LEU N 1 89 LEU CA 1 89 LEU C 1 90 ALA N -60.00 -20.00 -60.28 -60.29 -60.33 0.41 20 0 "[ . 1 . 2]"
124 . 1 90 ALA N 1 90 ALA CA 1 90 ALA C 1 91 HIS N -60.00 -20.00 -35.68 -37.74 -33.18 . . 0 "[ . 1 . 2]"
125 . 1 91 HIS N 1 91 HIS CA 1 91 HIS C 1 92 MET N -62.00 -22.00 -37.88 -38.33 -38.67 . . 0 "[ . 1 . 2]"
126 . 1 92 MET N 1 92 MET CA 1 92 MET C 1 93 GLN N -57.00 -17.00 -57.74 -58.05 -57.53 1.05 19 0 "[ . 1 . 2]"
127 . 1 93 GLN N 1 93 GLN CA 1 93 GLN C 1 94 ASN N -61.00 -21.00 -28.20 -29.36 -27.09 . . 0 "[ . 1 . 2]"
128 . 1 94 ASN N 1 94 ASN CA 1 94 ASN C 1 95 VAL N -62.00 -22.00 -44.65 -45.82 -46.40 . . 0 "[ . 1 . 2]"
129 . 1 95 VAL N 1 95 VAL CA 1 95 VAL C 1 96 VAL N -66.00 -26.00 -42.33 -47.14 -40.20 . . 0 "[ . 1 . 2]"
130 . 1 96 VAL N 1 96 VAL CA 1 96 VAL C 1 97 ALA N -65.00 -25.00 -46.53 -46.78 -46.81 . . 0 "[ . 1 . 2]"
131 . 1 97 ALA N 1 97 ALA CA 1 97 ALA C 1 98 ASP N -58.00 -18.00 -27.73 -31.32 -25.31 . . 0 "[ . 1 . 2]"
132 . 1 98 ASP N 1 98 ASP CA 1 98 ASP C 1 99 HIS N -62.00 -22.00 -41.49 -43.15 -39.84 . . 0 "[ . 1 . 2]"
133 . 1 99 HIS N 1 99 HIS CA 1 99 HIS C 1 100 LEU N -66.00 -26.00 -42.07 -42.15 -42.20 . . 0 "[ . 1 . 2]"
134 . 1 100 LEU N 1 100 LEU CA 1 100 LEU C 1 101 GLN N -60.00 -20.00 -24.63 -26.54 -26.91 0.03 15 0 "[ . 1 . 2]"
135 . 1 101 GLN N 1 101 GLN CA 1 101 GLN C 1 102 ARG N -61.00 -21.00 -51.52 -42.86 -43.80 0.48 4 0 "[ . 1 . 2]"
136 . 1 102 ARG N 1 102 ARG CA 1 102 ARG C 1 103 MET N -52.00 -8.00 -33.65 -37.10 -37.16 . . 0 "[ . 1 . 2]"
137 . 1 103 MET N 1 103 MET CA 1 103 MET C 1 104 ALA N -57.00 19.00 -14.27 -12.19 -13.18 . . 0 "[ . 1 . 2]"
138 . 1 107 GLU N 1 107 GLU CA 1 107 GLU C 1 108 SER N 117.00 -175.00 162.57 145.11 177.42 . . 0 "[ . 1 . 2]"
139 . 1 108 SER N 1 108 SER CA 1 108 SER C 1 109 LEU N 72.00 180.00 70.86 71.05 70.88 1.59 17 0 "[ . 1 . 2]"
140 . 1 110 GLU N 1 110 GLU CA 1 110 GLU C 1 111 ILE N 100.00 152.00 98.26 98.19 98.18 1.84 9 0 "[ . 1 . 2]"
141 . 1 111 ILE N 1 111 ILE CA 1 111 ILE C 1 112 ALA N 110.00 150.00 128.70 126.93 130.15 . . 0 "[ . 1 . 2]"
142 . 1 112 ALA N 1 112 ALA CA 1 112 ALA C 1 113 TRP N 113.00 153.00 110.71 110.57 110.82 2.43 5 0 "[ . 1 . 2]"
143 . 1 113 TRP N 1 113 TRP CA 1 113 TRP C 1 114 GLN N 112.00 152.00 133.14 131.68 134.54 . . 0 "[ . 1 . 2]"
144 . 1 114 GLN N 1 114 GLN CA 1 114 GLN C 1 115 PRO N 101.00 177.00 152.43 152.99 152.63 . . 0 "[ . 1 . 2]"
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