NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
485631 |
2k5w   |
15850 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2k5w
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 137
_TA_constraint_stats_list.Viol_count 526
_TA_constraint_stats_list.Viol_total 10292.97
_TA_constraint_stats_list.Viol_max 6.64
_TA_constraint_stats_list.Viol_rms 0.52
_TA_constraint_stats_list.Viol_average_all_restraints 0.19
_TA_constraint_stats_list.Viol_average_violations_only 0.98
_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 9 ILE C 1 10 GLY N 1 10 GLY CA 1 10 GLY C -157.97 -117.97 -133.99 -158.15 -115.79 2.18 5 0 "[ . 1 . 2]"
2 . 1 10 GLY N 1 10 GLY CA 1 10 GLY C 1 11 LYS N -171.18 -131.18 -168.43 -173.58 -132.36 2.40 20 0 "[ . 1 . 2]"
3 . 1 12 ASP C 1 13 VAL N 1 13 VAL CA 1 13 VAL C -129.97 -89.97 -104.61 -114.47 -118.95 0.99 13 0 "[ . 1 . 2]"
4 . 1 13 VAL N 1 13 VAL CA 1 13 VAL C 1 14 TYR N 114.35 154.35 122.19 113.71 134.95 0.64 5 0 "[ . 1 . 2]"
5 . 1 13 VAL C 1 14 TYR N 1 14 TYR CA 1 14 TYR C -145.07 -105.07 -113.13 -114.93 -115.62 1.63 20 0 "[ . 1 . 2]"
6 . 1 14 TYR N 1 14 TYR CA 1 14 TYR C 1 15 TYR N 133.84 173.84 148.37 132.23 164.39 1.61 12 0 "[ . 1 . 2]"
7 . 1 14 TYR C 1 15 TYR N 1 15 TYR CA 1 15 TYR C -137.50 -97.50 -120.18 -125.92 -127.98 0.25 14 0 "[ . 1 . 2]"
8 . 1 15 TYR N 1 15 TYR CA 1 15 TYR C 1 16 MET N 116.28 156.28 123.36 115.79 140.90 0.49 20 0 "[ . 1 . 2]"
9 . 1 15 TYR C 1 16 MET N 1 16 MET CA 1 16 MET C -162.31 -122.31 -127.76 -123.84 -127.33 0.49 19 0 "[ . 1 . 2]"
10 . 1 16 MET N 1 16 MET CA 1 16 MET C 1 17 GLN N 122.62 162.62 140.51 125.07 162.61 . . 0 "[ . 1 . 2]"
11 . 1 16 MET C 1 17 GLN N 1 17 GLN CA 1 17 GLN C -125.36 -85.36 -103.29 -106.00 -111.97 1.20 1 0 "[ . 1 . 2]"
12 . 1 17 GLN N 1 17 GLN CA 1 17 GLN C 1 18 ILE N 104.07 144.07 125.87 103.98 140.32 0.09 10 0 "[ . 1 . 2]"
13 . 1 17 GLN C 1 18 ILE N 1 18 ILE CA 1 18 ILE C -100.22 -60.22 -71.21 -72.22 -73.08 0.44 20 0 "[ . 1 . 2]"
14 . 1 18 ILE N 1 18 ILE CA 1 18 ILE C 1 19 LYS N 113.13 153.13 122.58 137.15 130.72 1.94 13 0 "[ . 1 . 2]"
15 . 1 22 GLY C 1 23 THR N 1 23 THR CA 1 23 THR C -123.56 -83.56 -98.03 -124.48 -81.76 1.80 20 0 "[ . 1 . 2]"
16 . 1 23 THR N 1 23 THR CA 1 23 THR C 1 24 ILE N 123.01 163.01 142.20 128.70 122.81 1.33 15 0 "[ . 1 . 2]"
17 . 1 23 THR C 1 24 ILE N 1 24 ILE CA 1 24 ILE C -121.37 -81.37 -102.93 -109.04 -113.72 0.74 11 0 "[ . 1 . 2]"
18 . 1 24 ILE N 1 24 ILE CA 1 24 ILE C 1 25 GLU N 109.06 149.06 121.61 107.45 143.60 1.61 10 0 "[ . 1 . 2]"
19 . 1 24 ILE C 1 25 GLU N 1 25 GLU CA 1 25 GLU C -145.88 -105.88 -117.96 -125.97 -128.97 0.94 7 0 "[ . 1 . 2]"
20 . 1 25 GLU N 1 25 GLU CA 1 25 GLU C 1 26 LYS N 110.76 150.76 118.29 109.84 133.26 0.92 20 0 "[ . 1 . 2]"
21 . 1 25 GLU C 1 26 LYS N 1 26 LYS CA 1 26 LYS C -117.28 -77.28 -85.45 -79.47 -81.46 . . 0 "[ . 1 . 2]"
22 . 1 26 LYS N 1 26 LYS CA 1 26 LYS C 1 27 VAL N 105.53 145.53 107.37 103.48 130.97 2.05 20 0 "[ . 1 . 2]"
23 . 1 26 LYS C 1 27 VAL N 1 27 VAL CA 1 27 VAL C -135.97 -95.97 -110.38 -126.88 -94.95 1.02 10 0 "[ . 1 . 2]"
24 . 1 27 VAL N 1 27 VAL CA 1 27 VAL C 1 28 ASP N 105.36 145.36 127.46 138.52 137.44 . . 0 "[ . 1 . 2]"
25 . 1 29 GLY C 1 30 ARG N 1 30 ARG CA 1 30 ARG C -129.78 -89.78 -109.10 -129.64 -89.57 0.21 13 0 "[ . 1 . 2]"
26 . 1 30 ARG N 1 30 ARG CA 1 30 ARG C 1 31 ASN N 121.31 161.31 130.32 150.20 140.82 1.55 19 0 "[ . 1 . 2]"
27 . 1 30 ARG C 1 31 ASN N 1 31 ASN CA 1 31 ASN C -115.38 -75.38 -77.21 -87.63 -73.84 1.54 10 0 "[ . 1 . 2]"
28 . 1 31 ASN N 1 31 ASN CA 1 31 ASN C 1 32 LEU N 101.80 141.80 104.79 99.92 113.05 1.88 19 0 "[ . 1 . 2]"
29 . 1 31 ASN C 1 32 LEU N 1 32 LEU CA 1 32 LEU C -132.00 -90.38 -104.86 -114.78 -92.75 . . 0 "[ . 1 . 2]"
30 . 1 32 LEU N 1 32 LEU CA 1 32 LEU C 1 33 ARG N 110.00 160.80 144.48 153.74 146.41 0.66 12 0 "[ . 1 . 2]"
31 . 1 32 LEU C 1 33 ARG N 1 33 ARG CA 1 33 ARG C -130.00 -90.38 -103.29 -128.18 -89.85 0.53 14 0 "[ . 1 . 2]"
32 . 1 33 ARG N 1 33 ARG CA 1 33 ARG C 1 34 ASN N 105.00 160.00 112.45 101.63 135.75 3.37 4 0 "[ . 1 . 2]"
33 . 1 33 ARG C 1 34 ASN N 1 34 ASN CA 1 34 ASN C -133.23 -93.23 -126.36 -129.24 -131.12 2.43 4 0 "[ . 1 . 2]"
34 . 1 34 ASN N 1 34 ASN CA 1 34 ASN C 1 35 TYR N 120.72 160.72 145.17 122.00 161.16 0.44 6 0 "[ . 1 . 2]"
35 . 1 34 ASN C 1 35 TYR N 1 35 TYR CA 1 35 TYR C -146.56 -106.56 -119.95 -118.40 -120.68 1.19 15 0 "[ . 1 . 2]"
36 . 1 35 TYR N 1 35 TYR CA 1 35 TYR C 1 36 THR N 124.82 164.82 125.88 124.28 124.04 1.51 15 0 "[ . 1 . 2]"
37 . 1 35 TYR C 1 36 THR N 1 36 THR CA 1 36 THR C -133.12 -93.12 -116.83 -129.14 -106.55 . . 0 "[ . 1 . 2]"
38 . 1 36 THR N 1 36 THR CA 1 36 THR C 1 37 LEU N 110.39 150.39 110.85 108.16 118.40 2.23 19 0 "[ . 1 . 2]"
39 . 1 36 THR C 1 37 LEU N 1 37 LEU CA 1 37 LEU C -145.69 -105.69 -134.37 -129.88 -131.18 . . 0 "[ . 1 . 2]"
40 . 1 37 LEU N 1 37 LEU CA 1 37 LEU C 1 38 PRO N 124.48 164.48 153.44 147.30 157.81 . . 0 "[ . 1 . 2]"
41 . 1 38 PRO N 1 38 PRO CA 1 38 PRO C 1 39 ALA N 109.21 149.21 138.03 124.88 149.96 0.75 20 0 "[ . 1 . 2]"
42 . 1 38 PRO C 1 39 ALA N 1 39 ALA CA 1 39 ALA C -158.53 -118.53 -131.38 -150.89 -117.99 0.54 7 0 "[ . 1 . 2]"
43 . 1 39 ALA N 1 39 ALA CA 1 39 ALA C 1 40 TYR N 137.94 177.94 150.52 137.45 169.67 0.49 13 0 "[ . 1 . 2]"
44 . 1 39 ALA C 1 40 TYR N 1 40 TYR CA 1 40 TYR C -146.47 -106.47 -121.75 -109.56 -118.22 0.96 9 0 "[ . 1 . 2]"
45 . 1 40 TYR N 1 40 TYR CA 1 40 TYR C 1 41 ASP N 123.60 163.60 137.89 141.83 140.67 . . 0 "[ . 1 . 2]"
46 . 1 41 ASP C 1 42 GLU N 1 42 GLU CA 1 42 GLU C -79.28 -39.28 -54.47 -65.52 -45.84 . . 0 "[ . 1 . 2]"
47 . 1 42 GLU N 1 42 GLU CA 1 42 GLU C 1 43 ASP N -50.11 -10.11 -33.79 -29.46 -29.79 0.19 18 0 "[ . 1 . 2]"
48 . 1 42 GLU C 1 43 ASP N 1 43 ASP CA 1 43 ASP C -113.27 -73.27 -82.70 -99.21 -72.92 0.35 11 0 "[ . 1 . 2]"
49 . 1 43 ASP N 1 43 ASP CA 1 43 ASP C 1 44 GLY N -30.59 9.41 -19.50 -32.52 10.65 1.93 18 0 "[ . 1 . 2]"
50 . 1 44 GLY C 1 45 VAL N 1 45 VAL CA 1 45 VAL C -99.72 -59.72 -76.40 -88.88 -64.82 . . 0 "[ . 1 . 2]"
51 . 1 45 VAL N 1 45 VAL CA 1 45 VAL C 1 46 LYS N 109.49 149.49 125.30 110.27 134.29 . . 0 "[ . 1 . 2]"
52 . 1 46 LYS C 1 47 LYS N 1 47 LYS CA 1 47 LYS C -151.82 -111.82 -121.26 -130.06 -136.27 0.97 5 0 "[ . 1 . 2]"
53 . 1 47 LYS N 1 47 LYS CA 1 47 LYS C 1 48 GLN N 130.21 170.21 157.21 170.49 168.96 2.02 2 0 "[ . 1 . 2]"
54 . 1 47 LYS C 1 48 GLN N 1 48 GLN CA 1 48 GLN C -138.46 -98.46 -117.75 -137.75 -138.96 2.51 16 0 "[ . 1 . 2]"
55 . 1 48 GLN N 1 48 GLN CA 1 48 GLN C 1 49 ILE N 107.44 147.44 117.69 124.83 120.45 0.53 4 0 "[ . 1 . 2]"
56 . 1 48 GLN C 1 49 ILE N 1 49 ILE CA 1 49 ILE C -144.37 -100.37 -115.60 -115.22 -118.41 0.53 18 0 "[ . 1 . 2]"
57 . 1 49 ILE N 1 49 ILE CA 1 49 ILE C 1 50 THR N 115.00 160.06 133.64 149.73 142.88 . . 0 "[ . 1 . 2]"
58 . 1 49 ILE C 1 50 THR N 1 50 THR CA 1 50 THR C -133.11 -93.11 -107.79 -116.95 -98.21 . . 0 "[ . 1 . 2]"
59 . 1 50 THR N 1 50 THR CA 1 50 THR C 1 51 PHE N 115.87 155.87 119.11 124.48 123.32 1.02 7 0 "[ . 1 . 2]"
60 . 1 50 THR C 1 51 PHE N 1 51 PHE CA 1 51 PHE C -151.77 -111.77 -123.13 -140.71 -110.98 0.79 6 0 "[ . 1 . 2]"
61 . 1 51 PHE N 1 51 PHE CA 1 51 PHE C 1 52 ARG N 132.07 172.07 152.46 131.57 172.34 0.50 18 0 "[ . 1 . 2]"
62 . 1 55 LYS C 1 56 LYS N 1 56 LYS CA 1 56 LYS C -93.67 -53.67 -79.96 -94.99 -56.64 1.32 12 0 "[ . 1 . 2]"
63 . 1 56 LYS N 1 56 LYS CA 1 56 LYS C 1 57 GLU N -49.93 -9.93 -30.82 -9.70 -11.57 1.49 8 0 "[ . 1 . 2]"
64 . 1 66 ALA C 1 67 PHE N 1 67 PHE CA 1 67 PHE C -131.54 -91.54 -103.28 -103.78 -110.22 0.42 9 0 "[ . 1 . 2]"
65 . 1 67 PHE N 1 67 PHE CA 1 67 PHE C 1 68 LEU N 127.94 167.94 137.19 126.29 168.60 1.65 5 0 "[ . 1 . 2]"
66 . 1 67 PHE C 1 68 LEU N 1 68 LEU CA 1 68 LEU C -147.94 -107.94 -120.87 -124.17 -125.69 0.92 14 0 "[ . 1 . 2]"
67 . 1 68 LEU N 1 68 LEU CA 1 68 LEU C 1 69 ARG N 125.65 165.65 150.65 145.36 155.78 . . 0 "[ . 1 . 2]"
68 . 1 68 LEU C 1 69 ARG N 1 69 ARG CA 1 69 ARG C -155.24 -115.24 -114.77 -116.02 -129.67 2.53 19 0 "[ . 1 . 2]"
69 . 1 69 ARG N 1 69 ARG CA 1 69 ARG C 1 70 LEU N 118.21 158.21 115.98 117.02 116.75 3.54 1 0 "[ . 1 . 2]"
70 . 1 69 ARG C 1 70 LEU N 1 70 LEU CA 1 70 LEU C -132.00 -90.38 -100.01 -103.81 -106.02 . . 0 "[ . 1 . 2]"
71 . 1 70 LEU N 1 70 LEU CA 1 70 LEU C 1 71 TYR N 110.00 160.80 140.39 128.87 148.04 . . 0 "[ . 1 . 2]"
72 . 1 73 ASP C 1 74 GLN N 1 74 GLN CA 1 74 GLN C -130.00 -90.38 -100.52 -132.17 -87.62 2.76 12 0 "[ . 1 . 2]"
73 . 1 74 GLN N 1 74 GLN CA 1 74 GLN C 1 75 ASP N 105.00 160.00 129.41 150.31 144.11 1.36 2 0 "[ . 1 . 2]"
74 . 1 91 GLU C 1 92 GLU N 1 92 GLU CA 1 92 GLU C -130.00 -90.38 -89.52 -90.45 -88.56 1.82 9 0 "[ . 1 . 2]"
75 . 1 92 GLU N 1 92 GLU CA 1 92 GLU C 1 93 ILE N 105.00 160.00 116.94 104.58 129.72 0.42 6 0 "[ . 1 . 2]"
76 . 1 71 TYR C 1 72 VAL N 1 72 VAL CA 1 72 VAL C -145.95 -105.95 -114.95 -110.16 -113.41 2.52 7 0 "[ . 1 . 2]"
77 . 1 72 VAL N 1 72 VAL CA 1 72 VAL C 1 73 ASP N 129.13 169.13 145.18 146.79 143.36 0.98 5 0 "[ . 1 . 2]"
78 . 1 72 VAL C 1 73 ASP N 1 73 ASP CA 1 73 ASP C -144.80 -104.80 -122.56 -102.67 -103.90 2.32 2 0 "[ . 1 . 2]"
79 . 1 73 ASP N 1 73 ASP CA 1 73 ASP C 1 74 GLN N 112.78 152.78 134.36 110.81 157.57 4.79 1 0 "[ . 1 . 2]"
80 . 1 74 GLN C 1 75 ASP N 1 75 ASP CA 1 75 ASP C -84.36 -44.36 -68.77 -84.99 -45.12 0.63 4 0 "[ . 1 . 2]"
81 . 1 75 ASP N 1 75 ASP CA 1 75 ASP C 1 76 ASP N -47.80 -7.80 -38.29 -40.41 -44.69 3.24 20 0 "[ . 1 . 2]"
82 . 1 81 GLU C 1 82 ILE N 1 82 ILE CA 1 82 ILE C -135.32 -95.32 -104.46 -137.03 -93.16 2.16 6 0 "[ . 1 . 2]"
83 . 1 82 ILE N 1 82 ILE CA 1 82 ILE C 1 83 SER N 105.04 145.04 123.20 103.41 147.42 2.38 8 0 "[ . 1 . 2]"
84 . 1 84 SER C 1 85 ILE N 1 85 ILE CA 1 85 ILE C -108.56 -68.56 -91.99 -109.37 -66.50 2.06 12 0 "[ . 1 . 2]"
85 . 1 85 ILE N 1 85 ILE CA 1 85 ILE C 1 86 GLU N -36.69 3.31 -7.98 -16.44 -18.86 1.52 20 0 "[ . 1 . 2]"
86 . 1 89 SER C 1 90 TYR N 1 90 TYR CA 1 90 TYR C -152.62 -112.62 -146.47 -135.77 -140.25 0.75 15 0 "[ . 1 . 2]"
87 . 1 90 TYR N 1 90 TYR CA 1 90 TYR C 1 91 GLU N 125.64 165.64 154.20 138.81 166.43 0.79 10 0 "[ . 1 . 2]"
88 . 1 90 TYR C 1 91 GLU N 1 91 GLU CA 1 91 GLU C -158.07 -118.07 -130.27 -119.70 -123.09 0.75 4 0 "[ . 1 . 2]"
89 . 1 91 GLU N 1 91 GLU CA 1 91 GLU C 1 92 GLU N 124.80 164.80 149.09 142.30 140.23 . . 0 "[ . 1 . 2]"
90 . 1 92 GLU C 1 93 ILE N 1 93 ILE CA 1 93 ILE C -154.94 -114.94 -123.12 -117.79 -120.92 1.55 3 0 "[ . 1 . 2]"
91 . 1 93 ILE N 1 93 ILE CA 1 93 ILE C 1 94 GLN N 137.58 177.58 177.40 177.76 176.21 1.62 12 0 "[ . 1 . 2]"
92 . 1 93 ILE C 1 94 GLN N 1 94 GLN CA 1 94 GLN C -127.03 -87.03 -108.96 -108.87 -108.89 0.50 3 0 "[ . 1 . 2]"
93 . 1 94 GLN N 1 94 GLN CA 1 94 GLN C 1 95 LYS N 132.98 172.98 169.10 156.23 174.26 1.28 12 0 "[ . 1 . 2]"
94 . 1 94 GLN C 1 95 LYS N 1 95 LYS CA 1 95 LYS C -78.32 -38.32 -57.78 -58.62 -59.43 . . 0 "[ . 1 . 2]"
95 . 1 95 LYS N 1 95 LYS CA 1 95 LYS C 1 96 ALA N -55.11 -15.11 -29.62 -26.53 -26.74 . . 0 "[ . 1 . 2]"
96 . 1 95 LYS C 1 96 ALA N 1 96 ALA CA 1 96 ALA C -93.22 -53.22 -67.59 -82.78 -58.20 . . 0 "[ . 1 . 2]"
97 . 1 96 ALA N 1 96 ALA CA 1 96 ALA C 1 97 ASP N -45.79 -5.79 -25.58 -29.25 -33.44 0.20 10 0 "[ . 1 . 2]"
98 . 1 96 ALA C 1 97 ASP N 1 97 ASP CA 1 97 ASP C -106.76 -66.76 -79.19 -70.38 -71.41 0.42 8 0 "[ . 1 . 2]"
99 . 1 97 ASP N 1 97 ASP CA 1 97 ASP C 1 98 LEU N -41.58 -1.58 -13.99 -16.97 -19.18 0.44 14 0 "[ . 1 . 2]"
100 . 1 99 PRO N 1 99 PRO CA 1 99 PRO C 1 100 GLU N 130.58 170.58 158.58 165.59 162.79 . . 0 "[ . 1 . 2]"
101 . 1 101 LYS C 1 102 VAL N 1 102 VAL CA 1 102 VAL C -93.57 -53.57 -62.98 -72.72 -52.96 0.61 18 0 "[ . 1 . 2]"
102 . 1 102 VAL N 1 102 VAL CA 1 102 VAL C 1 103 LYS N -55.88 -15.88 -46.24 -50.54 -40.62 . . 0 "[ . 1 . 2]"
103 . 1 102 VAL C 1 103 LYS N 1 103 LYS CA 1 103 LYS C -80.78 -40.78 -58.27 -66.19 -51.76 . . 0 "[ . 1 . 2]"
104 . 1 103 LYS N 1 103 LYS CA 1 103 LYS C 1 104 ASP N -61.48 -21.48 -38.58 -36.33 -40.33 . . 0 "[ . 1 . 2]"
105 . 1 103 LYS C 1 104 ASP N 1 104 ASP CA 1 104 ASP C -91.65 -51.65 -66.70 -62.75 -66.67 . . 0 "[ . 1 . 2]"
106 . 1 104 ASP N 1 104 ASP CA 1 104 ASP C 1 105 LYS N -48.24 -8.24 -37.16 -48.79 -18.48 0.55 13 0 "[ . 1 . 2]"
107 . 1 16 MET N 1 16 MET CA 1 16 MET CB 1 16 MET CG 165.00 -165.00 179.37 176.34 173.83 . . 0 "[ . 1 . 2]"
108 . 1 16 MET CA 1 16 MET CB 1 16 MET CG 1 16 MET SD 165.00 -165.00 -174.17 -173.87 -175.23 . . 0 "[ . 1 . 2]"
109 . 1 17 GLN N 1 17 GLN CA 1 17 GLN CB 1 17 GLN CG 165.00 -165.00 -178.15 176.26 -172.44 . . 0 "[ . 1 . 2]"
110 . 1 17 GLN CA 1 17 GLN CB 1 17 GLN CG 1 17 GLN CD 165.00 -165.00 -176.65 -176.74 -177.95 . . 0 "[ . 1 . 2]"
111 . 1 25 GLU N 1 25 GLU CA 1 25 GLU CB 1 25 GLU CG 165.00 -165.00 -177.54 -169.35 -172.74 . . 0 "[ . 1 . 2]"
112 . 1 25 GLU CA 1 25 GLU CB 1 25 GLU CG 1 25 GLU CD 165.00 -165.00 173.89 178.00 175.80 . . 0 "[ . 1 . 2]"
113 . 1 30 ARG N 1 30 ARG CA 1 30 ARG CB 1 30 ARG CG -70.00 -50.00 -56.86 -58.50 -59.64 0.73 14 0 "[ . 1 . 2]"
114 . 1 30 ARG CA 1 30 ARG CB 1 30 ARG CG 1 30 ARG CD 165.00 -165.00 179.30 176.69 174.83 . . 0 "[ . 1 . 2]"
115 . 1 32 LEU N 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG -70.00 -50.00 -57.55 -59.91 -50.22 . . 0 "[ . 1 . 2]"
116 . 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG 1 32 LEU CD1 165.00 -165.00 179.35 174.73 -178.08 . . 0 "[ . 1 . 2]"
117 . 1 33 ARG CA 1 33 ARG CB 1 33 ARG CG 1 33 ARG CD 165.00 -165.00 -177.15 176.60 -164.39 0.61 9 0 "[ . 1 . 2]"
118 . 1 35 TYR N 1 35 TYR CA 1 35 TYR CB 1 35 TYR CG -70.00 -50.00 -56.98 -72.58 -49.49 2.58 12 0 "[ . 1 . 2]"
119 . 1 40 TYR N 1 40 TYR CA 1 40 TYR CB 1 40 TYR CG -70.00 -50.00 -59.41 -60.25 -62.06 0.40 7 0 "[ . 1 . 2]"
120 . 1 40 TYR CA 1 40 TYR CB 1 40 TYR CG 1 40 TYR CD1 -100.00 -60.00 -93.10 -100.41 -82.84 0.41 16 0 "[ . 1 . 2]"
121 . 1 42 GLU CA 1 42 GLU CB 1 42 GLU CG 1 42 GLU CD 165.00 -60.00 -131.06 -109.36 -172.37 0.35 19 0 "[ . 1 . 2]"
122 . 1 48 GLN N 1 48 GLN CA 1 48 GLN CB 1 48 GLN CG 165.00 -165.00 -174.58 -170.78 -171.27 . . 0 "[ . 1 . 2]"
123 . 1 48 GLN CA 1 48 GLN CB 1 48 GLN CG 1 48 GLN CD 165.00 -165.00 173.69 166.27 -177.74 . . 0 "[ . 1 . 2]"
124 . 1 51 PHE N 1 51 PHE CA 1 51 PHE CB 1 51 PHE CG 50.00 70.00 61.72 57.02 70.43 0.43 12 0 "[ . 1 . 2]"
125 . 1 51 PHE CA 1 51 PHE CB 1 51 PHE CG 1 51 PHE CD1 -100.00 -80.00 -81.43 -79.82 -80.62 0.81 12 0 "[ . 1 . 2]"
126 . 1 70 LEU N 1 70 LEU CA 1 70 LEU CB 1 70 LEU CG -100.00 -60.00 -69.22 -71.86 -65.49 . . 0 "[ . 1 . 2]"
127 . 1 70 LEU CA 1 70 LEU CB 1 70 LEU CG 1 70 LEU CD1 30.00 60.00 61.45 60.70 62.15 2.15 18 0 "[ . 1 . 2]"
128 . 1 95 LYS N 1 95 LYS CA 1 95 LYS CB 1 95 LYS CG 165.00 -165.00 -174.40 -172.31 -173.34 1.04 19 0 "[ . 1 . 2]"
129 . 1 95 LYS CA 1 95 LYS CB 1 95 LYS CG 1 95 LYS CD 165.00 -165.00 -179.30 171.05 -169.39 . . 0 "[ . 1 . 2]"
130 . 1 100 GLU N 1 100 GLU CA 1 100 GLU CB 1 100 GLU CG 165.00 -165.00 -170.42 -176.46 -163.37 1.63 7 0 "[ . 1 . 2]"
131 . 1 100 GLU CA 1 100 GLU CB 1 100 GLU CG 1 100 GLU CD 165.00 -165.00 171.65 163.50 -168.70 1.50 12 0 "[ . 1 . 2]"
132 . 1 101 LYS N 1 101 LYS CA 1 101 LYS CB 1 101 LYS CG -70.00 -50.00 -59.61 -48.77 -49.24 1.26 13 0 "[ . 1 . 2]"
133 . 1 101 LYS CA 1 101 LYS CB 1 101 LYS CG 1 101 LYS CD -70.00 -50.00 -60.06 -47.93 -48.73 2.79 2 0 "[ . 1 . 2]"
134 . 1 103 LYS N 1 103 LYS CA 1 103 LYS CB 1 103 LYS CG 50.00 70.00 57.44 56.53 55.51 . . 0 "[ . 1 . 2]"
135 . 1 103 LYS CA 1 103 LYS CB 1 103 LYS CG 1 103 LYS CD 160.00 180.00 173.52 160.40 -178.94 1.06 1 0 "[ . 1 . 2]"
136 . 1 104 ASP N 1 104 ASP CA 1 104 ASP CB 1 104 ASP CG -80.00 -60.00 -62.31 -66.64 -61.07 . . 0 "[ . 1 . 2]"
137 . 1 104 ASP N 1 104 ASP CA 1 104 ASP CB 1 104 ASP CG -60.00 0.00 -62.31 -66.64 -61.07 6.64 13 1 "[ . 1 + . 2]"
stop_
save_
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