NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
630388 |
5zr0   |
36181 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_5zr0
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 128
_TA_constraint_stats_list.Viol_count 917
_TA_constraint_stats_list.Viol_total 34625.83
_TA_constraint_stats_list.Viol_max 7.14
_TA_constraint_stats_list.Viol_rms 1.20
_TA_constraint_stats_list.Viol_average_all_restraints 0.68
_TA_constraint_stats_list.Viol_average_violations_only 1.89
_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 ILE C 1 3 ALA N 1 3 ALA CA 1 3 ALA C -79.00 -58.00 -64.87 -76.12 -57.14 0.86 17 0 "[ . 1 . 2]"
2 . 1 3 ALA N 1 3 ALA CA 1 3 ALA C 1 4 GLU N -42.50 -25.70 -29.81 -42.84 -24.04 1.66 13 0 "[ . 1 . 2]"
3 . 1 3 ALA C 1 4 GLU N 1 4 GLU CA 1 4 GLU C -78.10 -58.90 -71.59 -80.48 -62.12 2.38 11 0 "[ . 1 . 2]"
4 . 1 4 GLU N 1 4 GLU CA 1 4 GLU C 1 5 ALA N -43.70 -26.00 -38.17 -35.19 -36.93 4.08 14 0 "[ . 1 . 2]"
5 . 1 4 GLU C 1 5 ALA N 1 5 ALA CA 1 5 ALA C -78.90 -55.20 -74.31 -67.74 -69.21 2.89 13 0 "[ . 1 . 2]"
6 . 1 5 ALA N 1 5 ALA CA 1 5 ALA C 1 6 ALA N -45.70 -26.80 -36.26 -32.94 -36.65 5.28 3 1 "[ + . 1 . 2]"
7 . 1 5 ALA C 1 6 ALA N 1 6 ALA CA 1 6 ALA C -125.70 4.10 -90.93 -106.41 -117.60 1.25 10 0 "[ . 1 . 2]"
8 . 1 6 ALA N 1 6 ALA CA 1 6 ALA C 1 7 PHE N 112.00 163.60 124.20 128.81 118.97 4.27 8 0 "[ . 1 . 2]"
9 . 1 6 ALA C 1 7 PHE N 1 7 PHE CA 1 7 PHE C -170.70 -38.20 -79.31 -148.48 -54.91 . . 0 "[ . 1 . 2]"
10 . 1 7 PHE N 1 7 PHE CA 1 7 PHE C 1 8 ASN N 104.50 -175.30 109.49 100.25 125.10 4.25 5 0 "[ . 1 . 2]"
11 . 1 7 PHE C 1 8 ASN N 1 8 ASN CA 1 8 ASN C -121.80 -51.00 -109.42 -111.76 -116.25 3.69 13 0 "[ . 1 . 2]"
12 . 1 8 ASN N 1 8 ASN CA 1 8 ASN C 1 9 LYS N 96.80 148.80 140.93 147.83 145.59 4.00 6 0 "[ . 1 . 2]"
13 . 1 8 ASN C 1 9 LYS N 1 9 LYS CA 1 9 LYS C -109.40 -61.00 -75.56 -81.10 -84.11 0.96 20 0 "[ . 1 . 2]"
14 . 1 9 LYS N 1 9 LYS CA 1 9 LYS C 1 10 GLY N -30.00 7.00 -26.20 -34.24 -0.15 4.24 14 0 "[ . 1 . 2]"
15 . 1 9 LYS C 1 10 GLY N 1 10 GLY CA 1 10 GLY C 179.80 10.30 -94.06 -162.62 -68.72 . . 0 "[ . 1 . 2]"
16 . 1 10 GLY N 1 10 GLY CA 1 10 GLY C 1 11 GLU N 111.50 166.40 160.76 112.18 173.54 7.14 20 4 "[ *.* 1 .- +]"
17 . 1 11 GLU N 1 11 GLU CA 1 11 GLU C 1 12 THR N 104.40 159.40 124.24 98.46 159.54 5.94 12 1 "[ . 1 + . 2]"
18 . 1 11 GLU C 1 12 THR N 1 12 THR CA 1 12 THR C -136.20 -68.50 -91.30 -65.69 -66.55 4.40 16 0 "[ . 1 . 2]"
19 . 1 13 ALA N 1 13 ALA CA 1 13 ALA C 1 14 MET N 102.30 -178.00 151.61 166.20 146.78 4.28 15 0 "[ . 1 . 2]"
20 . 1 13 ALA C 1 14 MET N 1 14 MET CA 1 14 MET C -148.80 -23.40 -80.33 -65.41 -66.35 . . 0 "[ . 1 . 2]"
21 . 1 14 MET N 1 14 MET CA 1 14 MET C 1 15 THR N 99.70 -178.30 160.55 172.82 169.92 3.68 13 0 "[ . 1 . 2]"
22 . 1 14 MET C 1 15 THR N 1 15 THR CA 1 15 THR C -174.20 -52.40 -71.81 -148.89 -50.75 1.65 5 0 "[ . 1 . 2]"
23 . 1 15 THR N 1 15 THR CA 1 15 THR C 1 16 ILE N 117.40 161.40 151.01 138.67 127.64 3.85 13 0 "[ . 1 . 2]"
24 . 1 15 THR C 1 16 ILE N 1 16 ILE CA 1 16 ILE C -173.90 -43.00 -57.97 -102.97 -42.85 0.15 14 0 "[ . 1 . 2]"
25 . 1 16 ILE N 1 16 ILE CA 1 16 ILE C 1 17 ASN N 101.40 140.70 127.14 100.33 141.10 1.07 8 0 "[ . 1 . 2]"
26 . 1 16 ILE C 1 17 ASN N 1 17 ASN CA 1 17 ASN C -122.60 -79.20 -83.89 -81.61 -87.35 5.18 10 1 "[ . + . 2]"
27 . 1 19 PRO C 1 20 TRP N 1 20 TRP CA 1 20 TRP C -139.60 -81.40 -86.17 -81.12 -82.05 4.02 16 0 "[ . 1 . 2]"
28 . 1 20 TRP N 1 20 TRP CA 1 20 TRP C 1 21 ALA N 115.80 152.60 122.44 110.59 140.68 5.21 20 1 "[ . 1 . +]"
29 . 1 20 TRP C 1 21 ALA N 1 21 ALA CA 1 21 ALA C -122.40 -56.30 -99.54 -125.93 -78.05 3.53 15 0 "[ . 1 . 2]"
30 . 1 21 ALA N 1 21 ALA CA 1 21 ALA C 1 22 TRP N 96.40 147.10 111.35 114.41 105.26 1.87 17 0 "[ . 1 . 2]"
31 . 1 22 TRP C 1 23 SER N 1 23 SER CA 1 23 SER C -174.60 -18.80 -86.81 -69.28 -71.87 . . 0 "[ . 1 . 2]"
32 . 1 23 SER N 1 23 SER CA 1 23 SER C 1 24 ASN N 86.20 170.10 105.45 82.84 173.67 3.57 5 0 "[ . 1 . 2]"
33 . 1 25 ILE C 1 26 ASP N 1 26 ASP CA 1 26 ASP C -171.90 -13.60 -82.13 -153.24 -45.77 . . 0 "[ . 1 . 2]"
34 . 1 27 THR N 1 27 THR CA 1 27 THR C 1 28 SER N -57.90 10.70 -37.91 -60.80 6.83 2.90 18 0 "[ . 1 . 2]"
35 . 1 42 ALA C 1 43 THR N 1 43 THR CA 1 43 THR C -125.50 -79.40 -77.71 -81.89 -72.57 6.83 10 1 "[ . + . 2]"
36 . 1 43 THR N 1 43 THR CA 1 43 THR C 1 44 TRP N 118.40 146.50 133.16 117.86 149.22 2.72 13 0 "[ . 1 . 2]"
37 . 1 43 THR C 1 44 TRP N 1 44 TRP CA 1 44 TRP C -141.30 -109.80 -114.19 -132.30 -106.63 3.17 10 0 "[ . 1 . 2]"
38 . 1 44 TRP N 1 44 TRP CA 1 44 TRP C 1 45 LYS N 135.40 160.80 156.32 159.84 158.59 4.80 10 0 "[ . 1 . 2]"
39 . 1 45 LYS N 1 45 LYS CA 1 45 LYS C 1 46 GLU N 128.50 158.10 157.76 160.18 159.62 5.49 14 1 "[ . 1 +. 2]"
40 . 1 45 LYS C 1 46 GLU N 1 46 GLU CA 1 46 GLU C -90.50 -67.20 -66.12 -67.30 -68.70 3.12 5 0 "[ . 1 . 2]"
41 . 1 46 GLU N 1 46 GLU CA 1 46 GLU C 1 47 LYS N 123.00 152.70 126.05 119.42 138.75 3.58 11 0 "[ . 1 . 2]"
42 . 1 46 GLU C 1 47 LYS N 1 47 LYS CA 1 47 LYS C -131.50 -96.80 -100.10 -93.77 -94.48 5.79 6 1 "[ .+ 1 . 2]"
43 . 1 47 LYS N 1 47 LYS CA 1 47 LYS C 1 48 ASP N 132.80 148.50 143.45 141.24 136.05 5.41 18 1 "[ . 1 . + 2]"
44 . 1 47 LYS C 1 48 ASP N 1 48 ASP CA 1 48 ASP C -141.50 -73.90 -119.68 -142.32 -75.56 0.82 11 0 "[ . 1 . 2]"
45 . 1 48 ASP N 1 48 ASP CA 1 48 ASP C 1 49 GLY N 125.10 -176.20 150.16 124.65 -177.76 0.45 17 0 "[ . 1 . 2]"
46 . 1 49 GLY C 1 50 ALA N 1 50 ALA CA 1 50 ALA C -153.40 -85.20 -124.65 -156.08 -82.32 2.88 10 0 "[ . 1 . 2]"
47 . 1 50 ALA N 1 50 ALA CA 1 50 ALA C 1 51 VAL N 117.20 168.40 157.98 168.96 166.58 1.27 14 0 "[ . 1 . 2]"
48 . 1 50 ALA C 1 51 VAL N 1 51 VAL CA 1 51 VAL C -83.00 -57.70 -76.21 -81.70 -82.86 1.38 5 0 "[ . 1 . 2]"
49 . 1 51 VAL N 1 51 VAL CA 1 51 VAL C 1 52 GLU N 120.70 133.60 132.43 125.74 137.68 4.08 7 0 "[ . 1 . 2]"
50 . 1 51 VAL C 1 52 GLU N 1 52 GLU CA 1 52 GLU C -134.10 -97.10 -96.53 -125.49 -92.07 5.03 1 1 "[+ . 1 . 2]"
51 . 1 52 GLU N 1 52 GLU CA 1 52 GLU C 1 53 ALA N 138.00 -153.30 177.45 169.52 -168.49 . . 0 "[ . 1 . 2]"
52 . 1 52 GLU C 1 53 ALA N 1 53 ALA CA 1 53 ALA C -71.80 -52.20 -68.94 -73.04 -58.32 1.24 14 0 "[ . 1 . 2]"
53 . 1 53 ALA N 1 53 ALA CA 1 53 ALA C 1 54 GLU N -45.40 -14.80 -28.01 -17.87 -21.09 0.96 17 0 "[ . 1 . 2]"
54 . 1 53 ALA C 1 54 GLU N 1 54 GLU CA 1 54 GLU C -107.80 -84.80 -106.09 -111.45 -83.86 3.65 20 0 "[ . 1 . 2]"
55 . 1 54 GLU N 1 54 GLU CA 1 54 GLU C 1 55 ASP N -15.50 19.00 -8.59 -17.42 10.65 1.92 15 0 "[ . 1 . 2]"
56 . 1 54 GLU C 1 55 ASP N 1 55 ASP CA 1 55 ASP C -90.80 -59.90 -80.67 -74.61 -78.08 2.01 20 0 "[ . 1 . 2]"
57 . 1 55 ASP N 1 55 ASP CA 1 55 ASP C 1 56 ARG N 138.00 154.60 153.66 155.16 154.91 2.51 13 0 "[ . 1 . 2]"
58 . 1 55 ASP C 1 56 ARG N 1 56 ARG CA 1 56 ARG C -145.00 -105.30 -108.56 -122.32 -100.55 4.75 12 0 "[ . 1 . 2]"
59 . 1 56 ARG N 1 56 ARG CA 1 56 ARG C 1 57 VAL N 131.40 166.00 137.07 127.24 150.42 4.16 17 0 "[ . 1 . 2]"
60 . 1 56 ARG C 1 57 VAL N 1 57 VAL CA 1 57 VAL C -143.30 -120.50 -142.71 -142.36 -143.66 2.12 4 0 "[ . 1 . 2]"
61 . 1 58 THR N 1 58 THR CA 1 58 THR C 1 59 ILE N 106.90 160.10 119.37 114.83 112.72 0.31 6 0 "[ . 1 . 2]"
62 . 1 59 ILE N 1 59 ILE CA 1 59 ILE C 1 60 ASP N 144.20 175.70 169.24 144.48 178.47 2.77 12 0 "[ . 1 . 2]"
63 . 1 59 ILE C 1 60 ASP N 1 60 ASP CA 1 60 ASP C -150.70 -94.00 -125.84 -126.77 -130.82 . . 0 "[ . 1 . 2]"
64 . 1 60 ASP C 1 61 PHE N 1 61 PHE CA 1 61 PHE C -156.20 -117.60 -146.62 -117.29 -142.98 3.72 2 0 "[ . 1 . 2]"
65 . 1 63 GLY C 1 64 SER N 1 64 SER CA 1 64 SER C -157.90 -114.10 -140.16 -160.19 -111.67 2.43 17 0 "[ . 1 . 2]"
66 . 1 64 SER N 1 64 SER CA 1 64 SER C 1 65 VAL N 133.60 168.50 164.73 155.32 171.22 2.72 5 0 "[ . 1 . 2]"
67 . 1 64 SER C 1 65 VAL N 1 65 VAL CA 1 65 VAL C -144.00 -120.80 -121.98 -120.75 -121.53 3.53 13 0 "[ . 1 . 2]"
68 . 1 65 VAL N 1 65 VAL CA 1 65 VAL C 1 66 ASP N 110.40 124.50 111.09 111.37 110.02 6.06 12 1 "[ . 1 + . 2]"
69 . 1 65 VAL C 1 66 ASP N 1 66 ASP CA 1 66 ASP C 48.90 55.80 57.73 55.79 54.32 4.09 6 0 "[ . 1 . 2]"
70 . 1 66 ASP C 1 67 GLY N 1 67 GLY CA 1 67 GLY C 72.70 89.50 86.84 76.11 91.77 2.27 10 0 "[ . 1 . 2]"
71 . 1 67 GLY N 1 67 GLY CA 1 67 GLY C 1 68 GLU N -13.00 13.20 0.65 -4.70 -7.01 1.48 11 0 "[ . 1 . 2]"
72 . 1 67 GLY C 1 68 GLU N 1 68 GLU CA 1 68 GLU C -128.40 -94.90 -101.94 -123.58 -92.46 2.44 20 0 "[ . 1 . 2]"
73 . 1 68 GLU N 1 68 GLU CA 1 68 GLU C 1 69 GLU N 131.90 151.50 129.64 129.44 129.07 5.15 16 1 "[ . 1 .+ 2]"
74 . 1 68 GLU C 1 69 GLU N 1 69 GLU CA 1 69 GLU C -96.50 -69.60 -77.19 -75.37 -76.03 2.12 11 0 "[ . 1 . 2]"
75 . 1 69 GLU N 1 69 GLU CA 1 69 GLU C 1 70 PHE N 114.10 152.00 120.41 111.73 111.41 5.65 9 1 "[ . +1 . 2]"
76 . 1 70 PHE C 1 71 GLU N 1 71 GLU CA 1 71 GLU C -97.90 -37.50 -82.97 -99.30 -65.31 1.40 15 0 "[ . 1 . 2]"
77 . 1 71 GLU N 1 71 GLU CA 1 71 GLU C 1 72 GLY N 119.30 141.10 138.09 134.33 130.85 4.37 15 0 "[ . 1 . 2]"
78 . 1 73 GLY C 1 74 LYS N 1 74 LYS CA 1 74 LYS C -146.30 -114.70 -138.01 -136.96 -144.22 2.64 18 0 "[ . 1 . 2]"
79 . 1 74 LYS N 1 74 LYS CA 1 74 LYS C 1 75 ALA N 141.50 164.20 151.69 164.39 159.10 0.19 2 0 "[ . 1 . 2]"
80 . 1 74 LYS C 1 75 ALA N 1 75 ALA CA 1 75 ALA C -149.10 -121.20 -148.64 -150.50 -150.91 2.15 1 0 "[ . 1 . 2]"
81 . 1 75 ALA N 1 75 ALA CA 1 75 ALA C 1 76 SER N 126.00 155.00 133.71 131.74 131.54 1.68 7 0 "[ . 1 . 2]"
82 . 1 75 ALA C 1 76 SER N 1 76 SER CA 1 76 SER C -114.30 -63.10 -94.65 -87.67 -90.03 . . 0 "[ . 1 . 2]"
83 . 1 76 SER N 1 76 SER CA 1 76 SER C 1 77 ASP N 136.40 172.70 145.23 132.76 156.29 3.64 13 0 "[ . 1 . 2]"
84 . 1 77 ASP C 1 78 PHE N 1 78 PHE CA 1 78 PHE C -130.30 -85.30 -84.22 -80.97 -81.33 4.96 3 0 "[ . 1 . 2]"
85 . 1 78 PHE C 1 79 VAL N 1 79 VAL CA 1 79 VAL C -119.30 -94.50 -90.63 -92.58 -89.63 4.87 6 0 "[ . 1 . 2]"
86 . 1 79 VAL C 1 80 LEU N 1 80 LEU CA 1 80 LEU C -130.10 -94.60 -112.52 -132.61 -91.25 3.35 7 0 "[ . 1 . 2]"
87 . 1 80 LEU N 1 80 LEU CA 1 80 LEU C 1 81 ALA N 111.20 130.50 119.45 119.07 114.76 2.27 11 0 "[ . 1 . 2]"
88 . 1 80 LEU C 1 81 ALA N 1 81 ALA CA 1 81 ALA C -94.70 -74.70 -92.17 -96.49 -80.64 1.79 3 0 "[ . 1 . 2]"
89 . 1 81 ALA N 1 81 ALA CA 1 81 ALA C 1 82 MET N 104.30 130.20 131.07 128.01 121.68 5.89 13 2 "[ . 1 + - 2]"
90 . 1 82 MET C 1 83 GLY N 1 83 GLY CA 1 83 GLY C 57.10 87.40 80.95 83.70 78.73 4.89 8 0 "[ . 1 . 2]"
91 . 1 83 GLY N 1 83 GLY CA 1 83 GLY C 1 84 GLN N -15.40 31.80 16.00 -13.37 33.06 1.26 16 0 "[ . 1 . 2]"
92 . 1 83 GLY C 1 84 GLN N 1 84 GLN CA 1 84 GLN C -107.80 -71.70 -99.17 -95.60 -97.78 2.20 5 0 "[ . 1 . 2]"
93 . 1 84 GLN N 1 84 GLN CA 1 84 GLN C 1 85 GLY N 128.30 155.50 127.73 125.04 140.66 3.26 4 0 "[ . 1 . 2]"
94 . 1 85 GLY C 1 86 ARG N 1 86 ARG CA 1 86 ARG C -83.80 -59.70 -72.73 -84.73 -60.96 0.93 19 0 "[ . 1 . 2]"
95 . 1 86 ARG N 1 86 ARG CA 1 86 ARG C 1 87 MET N -43.90 -25.10 -28.73 -45.94 -21.46 3.64 7 0 "[ . 1 . 2]"
96 . 1 86 ARG C 1 87 MET N 1 87 MET CA 1 87 MET C -147.90 -99.70 -102.98 -111.96 -115.22 3.81 4 0 "[ . 1 . 2]"
97 . 1 87 MET N 1 87 MET CA 1 87 MET C 1 88 ILE N 152.70 174.70 172.28 170.89 168.09 2.89 18 0 "[ . 1 . 2]"
98 . 1 95 ILE C 1 96 LYS N 1 96 LYS CA 1 96 LYS C -102.40 -61.70 -78.56 -95.22 -63.96 . . 0 "[ . 1 . 2]"
99 . 1 98 HIS C 1 99 LYS N 1 99 LYS CA 1 99 LYS C -143.50 -99.10 -105.04 -98.73 -99.26 3.39 7 0 "[ . 1 . 2]"
100 . 1 99 LYS N 1 99 LYS CA 1 99 LYS C 1 100 ALA N 147.20 170.80 173.58 169.66 177.89 7.09 17 2 "[ . 1 . + -2]"
101 . 1 100 ALA C 1 101 GLY N 1 101 GLY CA 1 101 GLY C 90.50 111.00 94.34 88.47 105.16 2.03 12 0 "[ . 1 . 2]"
102 . 1 101 GLY N 1 101 GLY CA 1 101 GLY C 1 102 GLU N -27.30 -6.20 -26.58 -31.15 -18.85 3.85 12 0 "[ . 1 . 2]"
103 . 1 101 GLY C 1 102 GLU N 1 102 GLU CA 1 102 GLU C -85.90 -68.50 -82.07 -77.29 -79.67 1.46 10 0 "[ . 1 . 2]"
104 . 1 102 GLU N 1 102 GLU CA 1 102 GLU C 1 103 GLU N 115.50 166.60 152.44 141.54 160.73 . . 0 "[ . 1 . 2]"
105 . 1 102 GLU C 1 103 GLU N 1 103 GLU CA 1 103 GLU C -128.70 -104.90 -110.91 -114.04 -116.56 2.34 6 0 "[ . 1 . 2]"
106 . 1 103 GLU N 1 103 GLU CA 1 103 GLU C 1 104 PHE N 138.80 164.80 139.84 138.54 137.92 1.88 4 0 "[ . 1 . 2]"
107 . 1 103 GLU C 1 104 PHE N 1 104 PHE CA 1 104 PHE C -159.80 -106.70 -155.53 -161.81 -144.48 2.01 15 0 "[ . 1 . 2]"
108 . 1 104 PHE N 1 104 PHE CA 1 104 PHE C 1 105 THR N 113.00 168.80 169.88 164.46 172.96 4.16 10 0 "[ . 1 . 2]"
109 . 1 104 PHE C 1 105 THR N 1 105 THR CA 1 105 THR C -134.80 -96.30 -116.63 -115.99 -118.23 . . 0 "[ . 1 . 2]"
110 . 1 105 THR N 1 105 THR CA 1 105 THR C 1 106 ILE N 141.20 163.60 138.38 136.12 142.86 5.08 12 1 "[ . 1 + . 2]"
111 . 1 105 THR C 1 106 ILE N 1 106 ILE CA 1 106 ILE C -139.00 -117.20 -131.56 -131.11 -133.16 . . 0 "[ . 1 . 2]"
112 . 1 106 ILE N 1 106 ILE CA 1 106 ILE C 1 107 ASP N 136.20 163.60 138.31 133.52 133.16 3.24 1 0 "[ . 1 . 2]"
113 . 1 106 ILE C 1 107 ASP N 1 107 ASP CA 1 107 ASP C -127.90 -88.60 -104.46 -92.44 -95.85 0.09 4 0 "[ . 1 . 2]"
114 . 1 107 ASP N 1 107 ASP CA 1 107 ASP C 1 108 VAL N 124.60 149.80 125.09 126.33 125.38 2.75 14 0 "[ . 1 . 2]"
115 . 1 107 ASP C 1 108 VAL N 1 108 VAL CA 1 108 VAL C -151.60 -123.20 -125.05 -122.05 -122.72 3.27 4 0 "[ . 1 . 2]"
116 . 1 108 VAL N 1 108 VAL CA 1 108 VAL C 1 109 THR N 136.30 157.20 141.13 133.09 160.20 3.21 14 0 "[ . 1 . 2]"
117 . 1 108 VAL C 1 109 THR N 1 109 THR CA 1 109 THR C -122.00 -98.50 -102.89 -125.07 -95.24 3.26 19 0 "[ . 1 . 2]"
118 . 1 109 THR N 1 109 THR CA 1 109 THR C 1 110 PHE N 118.40 133.30 125.20 126.49 124.11 0.54 20 0 "[ . 1 . 2]"
119 . 1 113 GLU C 1 114 TYR N 1 114 TYR CA 1 114 TYR C -70.10 -56.80 -65.84 -73.74 -57.86 3.64 16 0 "[ . 1 . 2]"
120 . 1 114 TYR C 1 115 HIS N 1 115 HIS CA 1 115 HIS C -113.50 -66.70 -77.60 -80.79 -82.88 . . 0 "[ . 1 . 2]"
121 . 1 122 LYS C 1 123 ALA N 1 123 ALA CA 1 123 ALA C -115.30 -66.20 -87.22 -109.73 -71.13 . . 0 "[ . 1 . 2]"
122 . 1 123 ALA N 1 123 ALA CA 1 123 ALA C 1 124 ALA N 117.00 137.80 132.69 120.59 140.49 2.69 11 0 "[ . 1 . 2]"
123 . 1 123 ALA C 1 124 ALA N 1 124 ALA CA 1 124 ALA C -139.30 -112.00 -110.53 -106.88 -107.75 5.12 2 1 "[ + . 1 . 2]"
124 . 1 124 ALA N 1 124 ALA CA 1 124 ALA C 1 125 LYS N 136.00 159.60 156.41 162.66 161.92 4.15 6 0 "[ . 1 . 2]"
125 . 1 124 ALA C 1 125 LYS N 1 125 LYS CA 1 125 LYS C -140.30 -111.50 -128.64 -131.86 -134.26 3.37 9 0 "[ . 1 . 2]"
126 . 1 125 LYS N 1 125 LYS CA 1 125 LYS C 1 126 PHE N 124.50 148.70 133.28 135.73 132.36 1.27 5 0 "[ . 1 . 2]"
127 . 1 125 LYS C 1 126 PHE N 1 126 PHE CA 1 126 PHE C -150.30 -121.30 -123.22 -131.34 -116.99 4.31 12 0 "[ . 1 . 2]"
128 . 1 129 ASN N 1 129 ASN CA 1 129 ASN C 1 130 LEU N 111.90 146.20 141.02 124.82 149.48 3.28 7 0 "[ . 1 . 2]"
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