NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
466691 |
2kq3   |
16585 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2kq3
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 147
_TA_constraint_stats_list.Viol_count 727
_TA_constraint_stats_list.Viol_total 3072.81
_TA_constraint_stats_list.Viol_max 1.73
_TA_constraint_stats_list.Viol_rms 0.13
_TA_constraint_stats_list.Viol_average_all_restraints 0.05
_TA_constraint_stats_list.Viol_average_violations_only 0.21
_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 8 HIS C 1 9 LYS N 1 9 LYS CA 1 9 LYS C -116.68 -76.68 -105.53 -107.96 -110.76 0.12 3 0 "[ . 1 . 2]"
2 . 1 9 LYS C 1 10 GLU N 1 10 GLU CA 1 10 GLU C -156.55 -116.55 -130.53 -156.55 -116.33 0.22 15 0 "[ . 1 . 2]"
3 . 1 11 PRO C 1 12 ALA N 1 12 ALA CA 1 12 ALA C -164.02 -124.02 -164.18 -164.33 -164.06 0.31 8 0 "[ . 1 . 2]"
4 . 1 12 ALA C 1 13 THR N 1 13 THR CA 1 13 THR C -137.66 -97.66 -123.72 -134.27 -112.75 . . 0 "[ . 1 . 2]"
5 . 1 13 THR C 1 14 LEU N 1 14 LEU CA 1 14 LEU C -93.28 -53.28 -73.30 -65.72 -73.79 0.25 19 0 "[ . 1 . 2]"
6 . 1 15 ILE C 1 16 LYS N 1 16 LYS CA 1 16 LYS C -169.00 -139.00 -169.38 -169.46 -169.50 0.56 16 0 "[ . 1 . 2]"
7 . 1 16 LYS C 1 17 ALA N 1 17 ALA CA 1 17 ALA C -119.00 -79.00 -78.83 -78.69 -78.78 0.37 14 0 "[ . 1 . 2]"
8 . 1 21 ASP C 1 22 THR N 1 22 THR CA 1 22 THR C -125.00 -95.00 -115.66 -125.28 -94.66 0.34 17 0 "[ . 1 . 2]"
9 . 1 22 THR C 1 23 VAL N 1 23 VAL CA 1 23 VAL C -155.00 -125.00 -154.67 -155.41 -146.92 0.41 14 0 "[ . 1 . 2]"
10 . 1 23 VAL C 1 24 LYS N 1 24 LYS CA 1 24 LYS C -128.00 -88.00 -87.84 -87.64 -87.66 0.71 15 0 "[ . 1 . 2]"
11 . 1 24 LYS C 1 25 LEU N 1 25 LEU CA 1 25 LEU C -134.00 -104.00 -128.83 -134.07 -118.58 0.07 11 0 "[ . 1 . 2]"
12 . 1 25 LEU C 1 26 MET N 1 26 MET CA 1 26 MET C -131.32 -81.32 -85.85 -89.84 -81.25 0.07 15 0 "[ . 1 . 2]"
13 . 1 26 MET C 1 27 TYR N 1 27 TYR CA 1 27 TYR C -139.00 -109.00 -129.16 -134.68 -122.41 . . 0 "[ . 1 . 2]"
14 . 1 27 TYR C 1 28 LYS N 1 28 LYS CA 1 28 LYS C 38.00 68.00 59.41 59.31 58.92 . . 0 "[ . 1 . 2]"
15 . 1 29 GLY C 1 30 GLN N 1 30 GLN CA 1 30 GLN C -134.81 -94.81 -134.83 -135.11 -133.31 0.30 14 0 "[ . 1 . 2]"
16 . 1 31 PRO C 1 32 MET N 1 32 MET CA 1 32 MET C -135.72 -95.72 -122.59 -125.45 -118.45 . . 0 "[ . 1 . 2]"
17 . 1 32 MET C 1 33 THR N 1 33 THR CA 1 33 THR C -123.24 -73.24 -86.16 -87.01 -87.33 . . 0 "[ . 1 . 2]"
18 . 1 33 THR C 1 34 PHE N 1 34 PHE CA 1 34 PHE C -141.87 -101.87 -103.17 -101.65 -101.71 0.42 14 0 "[ . 1 . 2]"
19 . 1 34 PHE C 1 35 ARG N 1 35 ARG CA 1 35 ARG C -132.50 -102.50 -130.47 -129.66 -132.12 0.27 11 0 "[ . 1 . 2]"
20 . 1 38 LEU C 1 39 VAL N 1 39 VAL CA 1 39 VAL C -139.29 -109.29 -125.42 -138.81 -108.76 0.53 17 0 "[ . 1 . 2]"
21 . 1 39 VAL C 1 40 ASP N 1 40 ASP CA 1 40 ASP C -124.58 -94.58 -107.19 -124.23 -94.45 0.13 1 0 "[ . 1 . 2]"
22 . 1 40 ASP C 1 41 THR N 1 41 THR CA 1 41 THR C -110.76 -80.76 -102.20 -94.88 -98.62 0.58 6 0 "[ . 1 . 2]"
23 . 1 56 PRO C 1 57 GLU N 1 57 GLU CA 1 57 GLU C -79.00 -49.00 -75.26 -79.65 -51.90 0.65 10 0 "[ . 1 . 2]"
24 . 1 57 GLU C 1 58 ALA N 1 58 ALA CA 1 58 ALA C -80.00 -50.00 -77.41 -80.69 -70.09 0.69 18 0 "[ . 1 . 2]"
25 . 1 58 ALA C 1 59 SER N 1 59 SER CA 1 59 SER C -82.00 -52.00 -61.15 -59.75 -61.83 0.25 20 0 "[ . 1 . 2]"
26 . 1 59 SER C 1 60 ALA N 1 60 ALA CA 1 60 ALA C -84.00 -54.00 -63.05 -57.67 -61.68 . . 0 "[ . 1 . 2]"
27 . 1 60 ALA C 1 61 PHE N 1 61 PHE CA 1 61 PHE C -78.00 -48.00 -54.87 -63.39 -47.97 0.03 6 0 "[ . 1 . 2]"
28 . 1 61 PHE C 1 62 THR N 1 62 THR CA 1 62 THR C -82.00 -52.00 -51.87 -53.90 -51.41 0.59 15 0 "[ . 1 . 2]"
29 . 1 62 THR C 1 63 LYS N 1 63 LYS CA 1 63 LYS C -78.00 -48.00 -74.17 -77.96 -66.69 . . 0 "[ . 1 . 2]"
30 . 1 63 LYS C 1 64 LYS N 1 64 LYS CA 1 64 LYS C -75.54 -45.54 -60.80 -64.89 -54.53 . . 0 "[ . 1 . 2]"
31 . 1 64 LYS C 1 65 MET N 1 65 MET CA 1 65 MET C -82.34 -42.34 -68.12 -62.87 -63.63 0.07 9 0 "[ . 1 . 2]"
32 . 1 65 MET C 1 66 VAL N 1 66 VAL CA 1 66 VAL C -86.28 -56.28 -63.21 -67.71 -58.97 . . 0 "[ . 1 . 2]"
33 . 1 66 VAL C 1 67 GLU N 1 67 GLU CA 1 67 GLU C -81.06 -51.06 -71.27 -81.12 -60.09 0.06 7 0 "[ . 1 . 2]"
34 . 1 67 GLU C 1 68 ASN N 1 68 ASN CA 1 68 ASN C -95.42 -65.42 -66.92 -69.28 -70.38 0.16 11 0 "[ . 1 . 2]"
35 . 1 68 ASN C 1 69 ALA N 1 69 ALA CA 1 69 ALA C -106.00 -66.00 -72.75 -88.90 -65.98 0.02 8 0 "[ . 1 . 2]"
36 . 1 70 LYS C 1 71 LYS N 1 71 LYS CA 1 71 LYS C -145.00 -115.00 -137.58 -139.28 -140.77 0.04 5 0 "[ . 1 . 2]"
37 . 1 71 LYS C 1 72 ILE N 1 72 ILE CA 1 72 ILE C -127.00 -97.00 -119.92 -123.99 -117.03 . . 0 "[ . 1 . 2]"
38 . 1 72 ILE C 1 73 GLU N 1 73 GLU CA 1 73 GLU C -142.00 -112.00 -127.01 -127.93 -128.35 . . 0 "[ . 1 . 2]"
39 . 1 73 GLU C 1 74 VAL N 1 74 VAL CA 1 74 VAL C -149.00 -109.00 -124.66 -121.05 -122.28 . . 0 "[ . 1 . 2]"
40 . 1 74 VAL C 1 75 GLU N 1 75 GLU CA 1 75 GLU C -139.00 -99.00 -127.99 -129.61 -129.62 . . 0 "[ . 1 . 2]"
41 . 1 75 GLU C 1 76 PHE N 1 76 PHE CA 1 76 PHE C -114.00 -74.00 -73.92 -74.94 -73.49 0.51 15 0 "[ . 1 . 2]"
42 . 1 89 LEU C 1 90 ALA N 1 90 ALA CA 1 90 ALA C -152.00 -112.00 -146.61 -146.99 -147.63 . . 0 "[ . 1 . 2]"
43 . 1 90 ALA C 1 91 TYR N 1 91 TYR CA 1 91 TYR C -121.00 -81.00 -100.94 -106.67 -93.21 . . 0 "[ . 1 . 2]"
44 . 1 91 TYR C 1 92 ILE N 1 92 ILE CA 1 92 ILE C -124.39 -94.39 -93.77 -93.66 -93.72 0.96 13 0 "[ . 1 . 2]"
45 . 1 92 ILE C 1 93 TYR N 1 93 TYR CA 1 93 TYR C -135.00 -95.00 -101.46 -105.62 -95.84 . . 0 "[ . 1 . 2]"
46 . 1 93 TYR C 1 94 ALA N 1 94 ALA CA 1 94 ALA C -144.00 -94.00 -142.01 -142.63 -143.60 0.14 20 0 "[ . 1 . 2]"
47 . 1 97 LYS C 1 98 MET N 1 98 MET CA 1 98 MET C -96.00 -56.00 -67.19 -75.17 -61.38 . . 0 "[ . 1 . 2]"
48 . 1 98 MET C 1 99 VAL N 1 99 VAL CA 1 99 VAL C -73.00 -43.00 -57.14 -55.09 -55.58 . . 0 "[ . 1 . 2]"
49 . 1 99 VAL C 1 100 ASN N 1 100 ASN CA 1 100 ASN C -74.00 -44.00 -54.30 -52.52 -54.50 . . 0 "[ . 1 . 2]"
50 . 1 100 ASN C 1 101 GLU N 1 101 GLU CA 1 101 GLU C -75.53 -45.53 -56.87 -58.26 -58.88 . . 0 "[ . 1 . 2]"
51 . 1 101 GLU C 1 102 ALA N 1 102 ALA CA 1 102 ALA C -81.14 -51.14 -57.89 -58.18 -59.39 . . 0 "[ . 1 . 2]"
52 . 1 102 ALA C 1 103 LEU N 1 103 LEU CA 1 103 LEU C -78.77 -48.77 -60.00 -56.95 -57.45 . . 0 "[ . 1 . 2]"
53 . 1 103 LEU C 1 104 VAL N 1 104 VAL CA 1 104 VAL C -75.73 -45.73 -63.06 -69.27 -57.51 . . 0 "[ . 1 . 2]"
54 . 1 104 VAL C 1 105 ARG N 1 105 ARG CA 1 105 ARG C -78.00 -48.00 -78.16 -78.41 -76.43 0.41 10 0 "[ . 1 . 2]"
55 . 1 109 ALA C 1 110 LYS N 1 110 LYS CA 1 110 LYS C -151.00 -91.00 -139.47 -143.86 -151.01 0.21 5 0 "[ . 1 . 2]"
56 . 1 110 LYS C 1 111 VAL N 1 111 VAL CA 1 111 VAL C -110.00 -60.00 -73.64 -80.70 -81.95 . . 0 "[ . 1 . 2]"
57 . 1 111 VAL C 1 112 ALA N 1 112 ALA CA 1 112 ALA C -144.00 -114.00 -143.11 -144.49 -129.75 0.49 8 0 "[ . 1 . 2]"
58 . 1 115 TYR C 1 116 LYS N 1 116 LYS CA 1 116 LYS C -102.00 -52.00 -92.02 -102.75 -54.61 0.75 6 0 "[ . 1 . 2]"
59 . 1 119 ASN C 1 120 THR N 1 120 THR CA 1 120 THR C -84.00 -44.00 -51.80 -47.87 -50.14 0.18 13 0 "[ . 1 . 2]"
60 . 1 120 THR C 1 121 HIS N 1 121 HIS CA 1 121 HIS C -123.00 -83.00 -116.97 -108.87 -121.60 0.49 3 0 "[ . 1 . 2]"
61 . 1 121 HIS C 1 122 GLU N 1 122 GLU CA 1 122 GLU C -73.00 -43.00 -57.68 -63.84 -47.94 . . 0 "[ . 1 . 2]"
62 . 1 122 GLU C 1 123 GLN N 1 123 GLN CA 1 123 GLN C -82.00 -52.00 -57.86 -56.39 -59.19 0.12 5 0 "[ . 1 . 2]"
63 . 1 123 GLN C 1 124 LEU N 1 124 LEU CA 1 124 LEU C -82.00 -52.00 -79.78 -82.39 -68.79 0.39 12 0 "[ . 1 . 2]"
64 . 1 124 LEU C 1 125 LEU N 1 125 LEU CA 1 125 LEU C -79.00 -49.00 -78.20 -79.02 -79.04 0.22 20 0 "[ . 1 . 2]"
65 . 1 125 LEU C 1 126 ARG N 1 126 ARG CA 1 126 ARG C -82.00 -52.00 -55.20 -57.62 -51.83 0.17 20 0 "[ . 1 . 2]"
66 . 1 126 ARG C 1 127 LYS N 1 127 LYS CA 1 127 LYS C -80.00 -50.00 -80.18 -80.41 -79.97 0.41 3 0 "[ . 1 . 2]"
67 . 1 127 LYS C 1 128 SER N 1 128 SER CA 1 128 SER C -83.00 -53.00 -53.90 -59.08 -52.12 0.88 3 0 "[ . 1 . 2]"
68 . 1 128 SER C 1 129 GLU N 1 129 GLU CA 1 129 GLU C -84.00 -44.00 -68.08 -69.62 -72.32 . . 0 "[ . 1 . 2]"
69 . 1 129 GLU C 1 130 ALA N 1 130 ALA CA 1 130 ALA C -79.00 -49.00 -67.71 -77.82 -56.04 . . 0 "[ . 1 . 2]"
70 . 1 130 ALA C 1 131 GLN N 1 131 GLN CA 1 131 GLN C -80.00 -50.00 -59.96 -62.15 -64.13 . . 0 "[ . 1 . 2]"
71 . 1 131 GLN C 1 132 ALA N 1 132 ALA CA 1 132 ALA C -91.00 -41.00 -75.90 -91.16 -61.14 0.16 17 0 "[ . 1 . 2]"
72 . 1 132 ALA C 1 133 LYS N 1 133 LYS CA 1 133 LYS C -83.00 -53.00 -61.45 -65.15 -67.12 0.15 11 0 "[ . 1 . 2]"
73 . 1 133 LYS C 1 134 LYS N 1 134 LYS CA 1 134 LYS C -87.00 -47.00 -59.51 -55.49 -56.20 0.06 5 0 "[ . 1 . 2]"
74 . 1 134 LYS C 1 135 GLU N 1 135 GLU CA 1 135 GLU C -108.00 -78.00 -98.70 -108.05 -93.77 0.05 5 0 "[ . 1 . 2]"
75 . 1 9 LYS N 1 9 LYS CA 1 9 LYS C 1 10 GLU N 102.08 162.08 161.39 152.66 162.49 0.41 8 0 "[ . 1 . 2]"
76 . 1 10 GLU N 1 10 GLU CA 1 10 GLU C 1 11 PRO N 132.03 172.03 132.89 133.24 132.63 0.22 10 0 "[ . 1 . 2]"
77 . 1 12 ALA N 1 12 ALA CA 1 12 ALA C 1 13 THR N 134.89 174.89 165.59 153.83 175.08 0.19 10 0 "[ . 1 . 2]"
78 . 1 13 THR N 1 13 THR CA 1 13 THR C 1 14 LEU N 128.89 168.89 143.00 128.76 163.84 0.13 6 0 "[ . 1 . 2]"
79 . 1 14 LEU N 1 14 LEU CA 1 14 LEU C 1 15 ILE N 108.50 138.50 108.30 108.16 108.49 0.34 14 0 "[ . 1 . 2]"
80 . 1 16 LYS N 1 16 LYS CA 1 16 LYS C 1 17 ALA N 121.00 161.00 131.26 125.71 137.48 . . 0 "[ . 1 . 2]"
81 . 1 17 ALA N 1 17 ALA CA 1 17 ALA C 1 18 ILE N 107.00 137.00 128.30 123.10 137.22 0.22 10 0 "[ . 1 . 2]"
82 . 1 22 THR N 1 22 THR CA 1 22 THR C 1 23 VAL N 125.00 165.00 129.22 124.62 132.56 0.38 10 0 "[ . 1 . 2]"
83 . 1 23 VAL N 1 23 VAL CA 1 23 VAL C 1 24 LYS N 131.00 161.00 144.37 146.24 145.97 . . 0 "[ . 1 . 2]"
84 . 1 24 LYS N 1 24 LYS CA 1 24 LYS C 1 25 LEU N 115.00 145.00 129.86 129.59 127.76 . . 0 "[ . 1 . 2]"
85 . 1 25 LEU N 1 25 LEU CA 1 25 LEU C 1 26 MET N 127.00 157.00 156.73 156.90 156.86 0.21 13 0 "[ . 1 . 2]"
86 . 1 26 MET N 1 26 MET CA 1 26 MET C 1 27 TYR N 101.75 141.75 114.87 112.21 109.71 . . 0 "[ . 1 . 2]"
87 . 1 27 TYR N 1 27 TYR CA 1 27 TYR C 1 28 LYS N 100.00 140.00 120.84 116.47 125.58 . . 0 "[ . 1 . 2]"
88 . 1 28 LYS N 1 28 LYS CA 1 28 LYS C 1 29 GLY N 28.00 58.00 46.31 45.85 45.45 . . 0 "[ . 1 . 2]"
89 . 1 30 GLN N 1 30 GLN CA 1 30 GLN C 1 31 PRO N 126.04 156.04 155.56 156.23 156.18 0.37 4 0 "[ . 1 . 2]"
90 . 1 32 MET N 1 32 MET CA 1 32 MET C 1 33 THR N 110.27 150.27 149.55 150.43 150.38 0.44 3 0 "[ . 1 . 2]"
91 . 1 33 THR N 1 33 THR CA 1 33 THR C 1 34 PHE N 112.70 152.70 114.49 112.19 132.93 0.51 13 0 "[ . 1 . 2]"
92 . 1 34 PHE N 1 34 PHE CA 1 34 PHE C 1 35 ARG N 126.01 166.01 151.16 139.97 157.20 . . 0 "[ . 1 . 2]"
93 . 1 35 ARG N 1 35 ARG CA 1 35 ARG C 1 36 LEU N 117.85 147.85 144.69 146.32 144.88 0.14 7 0 "[ . 1 . 2]"
94 . 1 39 VAL N 1 39 VAL CA 1 39 VAL C 1 40 ASP N 140.60 170.60 142.90 140.34 163.88 0.26 5 0 "[ . 1 . 2]"
95 . 1 40 ASP N 1 40 ASP CA 1 40 ASP C 1 41 THR N 120.08 150.08 139.39 139.28 134.26 1.07 6 0 "[ . 1 . 2]"
96 . 1 41 THR N 1 41 THR CA 1 41 THR C 1 42 PRO N 121.35 151.35 143.18 121.24 151.74 0.39 19 0 "[ . 1 . 2]"
97 . 1 57 GLU N 1 57 GLU CA 1 57 GLU C 1 58 ALA N -54.00 -24.00 -36.10 -54.64 -23.53 0.64 2 0 "[ . 1 . 2]"
98 . 1 58 ALA N 1 58 ALA CA 1 58 ALA C 1 59 SER N -57.00 -27.00 -52.96 -57.40 -44.48 0.40 10 0 "[ . 1 . 2]"
99 . 1 59 SER N 1 59 SER CA 1 59 SER C 1 60 ALA N -50.00 -20.00 -41.38 -50.16 -30.30 0.16 18 0 "[ . 1 . 2]"
100 . 1 60 ALA N 1 60 ALA CA 1 60 ALA C 1 61 PHE N -57.00 -27.00 -55.23 -57.33 -48.81 0.33 10 0 "[ . 1 . 2]"
101 . 1 61 PHE N 1 61 PHE CA 1 61 PHE C 1 62 THR N -55.00 -25.00 -54.18 -55.32 -50.57 0.32 11 0 "[ . 1 . 2]"
102 . 1 62 THR N 1 62 THR CA 1 62 THR C 1 63 LYS N -57.00 -27.00 -44.34 -41.19 -42.24 . . 0 "[ . 1 . 2]"
103 . 1 63 LYS N 1 63 LYS CA 1 63 LYS C 1 64 LYS N -67.00 -27.00 -29.94 -29.88 -30.65 0.15 4 0 "[ . 1 . 2]"
104 . 1 64 LYS N 1 64 LYS CA 1 64 LYS C 1 65 MET N -61.84 -21.84 -48.51 -57.52 -35.89 . . 0 "[ . 1 . 2]"
105 . 1 65 MET N 1 65 MET CA 1 65 MET C 1 66 VAL N -52.34 -22.34 -51.63 -51.05 -51.83 0.28 9 0 "[ . 1 . 2]"
106 . 1 66 VAL N 1 66 VAL CA 1 66 VAL C 1 67 GLU N -49.22 -19.22 -41.26 -39.84 -41.79 0.03 15 0 "[ . 1 . 2]"
107 . 1 67 GLU N 1 67 GLU CA 1 67 GLU C 1 68 ASN N -52.48 -22.48 -48.07 -52.66 -41.66 0.18 8 0 "[ . 1 . 2]"
108 . 1 68 ASN N 1 68 ASN CA 1 68 ASN C 1 69 ALA N -45.31 -5.31 -30.05 -28.42 -29.14 . . 0 "[ . 1 . 2]"
109 . 1 69 ALA N 1 69 ALA CA 1 69 ALA C 1 70 LYS N 112.00 152.00 119.44 112.02 132.52 . . 0 "[ . 1 . 2]"
110 . 1 71 LYS N 1 71 LYS CA 1 71 LYS C 1 72 ILE N 127.00 157.00 140.46 138.79 147.92 . . 0 "[ . 1 . 2]"
111 . 1 72 ILE N 1 72 ILE CA 1 72 ILE C 1 73 GLU N 114.00 144.00 144.21 144.14 144.10 0.35 15 0 "[ . 1 . 2]"
112 . 1 73 GLU N 1 73 GLU CA 1 73 GLU C 1 74 VAL N 134.00 164.00 141.85 140.25 139.88 . . 0 "[ . 1 . 2]"
113 . 1 74 VAL N 1 74 VAL CA 1 74 VAL C 1 75 GLU N 110.00 160.00 139.62 142.26 141.89 . . 0 "[ . 1 . 2]"
114 . 1 75 GLU N 1 75 GLU CA 1 75 GLU C 1 76 PHE N 104.00 154.00 106.89 103.93 109.77 0.07 4 0 "[ . 1 . 2]"
115 . 1 76 PHE N 1 76 PHE CA 1 76 PHE C 1 77 ASP N 106.00 156.00 142.51 130.24 156.05 0.05 1 0 "[ . 1 . 2]"
116 . 1 90 ALA N 1 90 ALA CA 1 90 ALA C 1 91 TYR N 126.00 176.00 173.41 175.83 173.81 0.32 2 0 "[ . 1 . 2]"
117 . 1 91 TYR N 1 91 TYR CA 1 91 TYR C 1 92 ILE N 108.00 138.00 135.74 136.20 135.20 0.13 2 0 "[ . 1 . 2]"
118 . 1 92 ILE N 1 92 ILE CA 1 92 ILE C 1 93 TYR N 115.07 155.07 124.13 126.62 125.30 . . 0 "[ . 1 . 2]"
119 . 1 94 ALA N 1 94 ALA CA 1 94 ALA C 1 95 ASP N 115.00 155.00 114.69 114.44 114.82 0.56 14 0 "[ . 1 . 2]"
120 . 1 98 MET N 1 98 MET CA 1 98 MET C 1 99 VAL N 104.00 134.00 110.92 107.86 121.33 . . 0 "[ . 1 . 2]"
121 . 1 99 VAL N 1 99 VAL CA 1 99 VAL C 1 100 ASN N -59.00 -29.00 -34.73 -45.17 -28.80 0.20 11 0 "[ . 1 . 2]"
122 . 1 100 ASN N 1 100 ASN CA 1 100 ASN C 1 101 GLU N -59.00 -29.00 -53.28 -48.47 -48.71 0.43 20 0 "[ . 1 . 2]"
123 . 1 101 GLU N 1 101 GLU CA 1 101 GLU C 1 102 ALA N -58.78 -28.78 -37.04 -44.08 -31.96 . . 0 "[ . 1 . 2]"
124 . 1 102 ALA N 1 102 ALA CA 1 102 ALA C 1 103 LEU N -59.42 -19.42 -55.60 -56.61 -56.99 0.03 12 0 "[ . 1 . 2]"
125 . 1 103 LEU N 1 103 LEU CA 1 103 LEU C 1 104 VAL N -59.30 -29.30 -39.85 -39.10 -39.91 . . 0 "[ . 1 . 2]"
126 . 1 104 VAL N 1 104 VAL CA 1 104 VAL C 1 105 ARG N -56.23 -26.23 -43.18 -48.97 -39.48 . . 0 "[ . 1 . 2]"
127 . 1 105 ARG N 1 105 ARG CA 1 105 ARG C 1 106 GLN N -54.00 -4.00 -35.26 -27.11 -28.24 . . 0 "[ . 1 . 2]"
128 . 1 110 LYS N 1 110 LYS CA 1 110 LYS C 1 111 VAL N 116.00 166.00 163.01 152.80 166.45 0.45 17 0 "[ . 1 . 2]"
129 . 1 111 VAL N 1 111 VAL CA 1 111 VAL C 1 112 ALA N 107.00 147.00 111.04 106.44 122.01 0.56 8 0 "[ . 1 . 2]"
130 . 1 112 ALA N 1 112 ALA CA 1 112 ALA C 1 113 TYR N 128.00 168.00 153.76 161.87 156.70 0.15 7 0 "[ . 1 . 2]"
131 . 1 116 LYS N 1 116 LYS CA 1 116 LYS C 1 117 PRO N 109.00 159.00 155.71 151.90 148.71 1.73 12 0 "[ . 1 . 2]"
132 . 1 120 THR N 1 120 THR CA 1 120 THR C 1 121 HIS N -49.00 -19.00 -43.37 -31.71 -36.90 0.18 16 0 "[ . 1 . 2]"
133 . 1 121 HIS N 1 121 HIS CA 1 121 HIS C 1 122 GLU N -1.00 29.00 23.34 29.08 28.96 0.13 2 0 "[ . 1 . 2]"
134 . 1 122 GLU N 1 122 GLU CA 1 122 GLU C 1 123 GLN N -56.00 -26.00 -48.78 -50.62 -52.04 0.04 8 0 "[ . 1 . 2]"
135 . 1 123 GLN N 1 123 GLN CA 1 123 GLN C 1 124 LEU N -54.00 -24.00 -25.15 -25.72 -26.16 0.34 20 0 "[ . 1 . 2]"
136 . 1 124 LEU N 1 124 LEU CA 1 124 LEU C 1 125 LEU N -58.00 -28.00 -46.49 -46.88 -47.90 . . 0 "[ . 1 . 2]"
137 . 1 125 LEU N 1 125 LEU CA 1 125 LEU C 1 126 ARG N -55.00 -25.00 -28.71 -36.53 -24.95 0.05 10 0 "[ . 1 . 2]"
138 . 1 126 ARG N 1 126 ARG CA 1 126 ARG C 1 127 LYS N -58.00 -18.00 -38.29 -39.56 -40.81 . . 0 "[ . 1 . 2]"
139 . 1 127 LYS N 1 127 LYS CA 1 127 LYS C 1 128 SER N -58.00 -28.00 -49.59 -57.97 -40.87 . . 0 "[ . 1 . 2]"
140 . 1 128 SER N 1 128 SER CA 1 128 SER C 1 129 GLU N -55.00 -25.00 -36.32 -32.82 -34.06 . . 0 "[ . 1 . 2]"
141 . 1 129 GLU N 1 129 GLU CA 1 129 GLU C 1 130 ALA N -63.00 -23.00 -59.26 -63.17 -51.80 0.17 3 0 "[ . 1 . 2]"
142 . 1 130 ALA N 1 130 ALA CA 1 130 ALA C 1 131 GLN N -56.00 -26.00 -33.14 -28.07 -30.49 0.04 9 0 "[ . 1 . 2]"
143 . 1 131 GLN N 1 131 GLN CA 1 131 GLN C 1 132 ALA N -56.00 -26.00 -51.58 -47.01 -47.75 0.43 13 0 "[ . 1 . 2]"
144 . 1 132 ALA N 1 132 ALA CA 1 132 ALA C 1 133 LYS N -64.00 -24.00 -24.65 -23.89 -23.92 0.80 20 0 "[ . 1 . 2]"
145 . 1 133 LYS N 1 133 LYS CA 1 133 LYS C 1 134 LYS N -53.00 -23.00 -51.67 -53.38 -34.55 0.38 9 0 "[ . 1 . 2]"
146 . 1 134 LYS N 1 134 LYS CA 1 134 LYS C 1 135 GLU N -46.00 -16.00 -34.64 -39.01 -26.18 . . 0 "[ . 1 . 2]"
147 . 1 135 GLU N 1 135 GLU CA 1 135 GLU C 1 136 LYS N -12.00 18.00 -6.08 -4.42 -6.21 0.13 11 0 "[ . 1 . 2]"
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