NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
532060 |
2lfj   |
17762 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2lfj
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 2
_TA_constraint_stats_list.Viol_count 8
_TA_constraint_stats_list.Viol_total 208.78
_TA_constraint_stats_list.Viol_max 6.00
_TA_constraint_stats_list.Viol_rms 1.98
_TA_constraint_stats_list.Viol_average_all_restraints 1.04
_TA_constraint_stats_list.Viol_average_violations_only 2.61
_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 GLU CA 1 2 GLU N 1 1 LYS C 1 1 LYS CA 170.00 -170.00 171.30 164.00 -173.28 6.00 7 1 "[ . + 1]"
2 . 1 93 PRO CA 1 93 PRO N 1 92 TYR C 1 92 TYR CA -10.00 10.00 7.83 9.76 8.61 0.97 2 0 "[ . 1]"
stop_
save_
save_dihedral_constraint_statistics_2
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 104
_TA_constraint_stats_list.Viol_count 128
_TA_constraint_stats_list.Viol_total 5732.67
_TA_constraint_stats_list.Viol_max 19.92
_TA_constraint_stats_list.Viol_rms 2.02
_TA_constraint_stats_list.Viol_average_all_restraints 0.55
_TA_constraint_stats_list.Viol_average_violations_only 4.48
_TA_constraint_stats_list.Cutoff_violation_report 5.00
_TA_constraint_stats_list.Details .
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 1 LYS C 1 2 GLU N 1 2 GLU CA 1 2 GLU C -115.00 -55.00 -80.53 -79.93 -84.25 . . 0 "[ . 1]"
2 . 1 2 GLU N 1 2 GLU CA 1 2 GLU C 1 3 SER N 77.00 177.00 133.77 178.31 165.06 9.81 7 3 "[ .-+* 1]"
3 . 1 9 GLU C 1 10 ARG N 1 10 ARG CA 1 10 ARG C -132.90 -52.90 -59.44 -61.49 -62.80 1.74 5 0 "[ . 1]"
4 . 1 10 ARG N 1 10 ARG CA 1 10 ARG C 1 11 GLN N -55.00 55.00 -25.25 -37.22 -11.36 . . 0 "[ . 1]"
5 . 1 11 GLN C 1 12 HIS N 1 12 HIS CA 1 12 HIS C -139.00 -63.00 -125.14 -105.49 -123.21 3.66 8 0 "[ . 1]"
6 . 1 12 HIS N 1 12 HIS CA 1 12 HIS C 1 13 MET N -55.00 55.00 -40.61 -28.24 -37.52 3.64 1 0 "[ . 1]"
7 . 1 17 ASN C 1 18 SER N 1 18 SER CA 1 18 SER C -172.40 -38.40 -124.25 -143.35 -160.57 4.22 6 0 "[ . 1]"
8 . 1 18 SER N 1 18 SER CA 1 18 SER C 1 19 PRO N 91.30 -168.70 132.35 125.41 106.10 6.70 7 1 "[ . + 1]"
9 . 1 30 MET C 1 31 CYS N 1 31 CYS CA 1 31 CYS C 35.00 -35.00 -63.10 -63.46 -64.95 . . 0 "[ . 1]"
10 . 1 31 CYS N 1 31 CYS CA 1 31 CYS C 1 32 CYS N -145.00 145.00 -52.95 -57.11 -47.59 . . 0 "[ . 1]"
11 . 1 31 CYS C 1 32 CYS N 1 32 CYS CA 1 32 CYS C 35.00 -35.00 -57.85 -65.27 -50.38 . . 0 "[ . 1]"
12 . 1 32 CYS N 1 32 CYS CA 1 32 CYS C 1 33 ARG N -145.00 145.00 -42.44 -47.20 -34.72 . . 0 "[ . 1]"
13 . 1 38 GLY C 1 39 LYS N 1 39 LYS CA 1 39 LYS C -169.00 -57.20 -155.43 -172.77 -133.36 3.77 3 0 "[ . 1]"
14 . 1 39 LYS N 1 39 LYS CA 1 39 LYS C 1 40 CYS N 73.80 -152.80 158.34 159.59 150.81 . . 0 "[ . 1]"
15 . 1 39 LYS C 1 40 CYS N 1 40 CYS CA 1 40 CYS C -170.50 -91.00 -98.44 -128.83 -80.74 10.26 7 3 "[ * .-+ 1]"
16 . 1 40 CYS N 1 40 CYS CA 1 40 CYS C 1 41 LYS N 81.80 -178.20 161.25 119.61 -176.75 1.45 6 0 "[ . 1]"
17 . 1 40 CYS C 1 41 LYS N 1 41 LYS CA 1 41 LYS C -129.90 -69.90 -93.60 -86.29 -91.23 . . 0 "[ . 1]"
18 . 1 41 LYS N 1 41 LYS CA 1 41 LYS C 1 42 PRO N 71.30 -178.20 122.47 120.41 114.14 . . 0 "[ . 1]"
19 . 1 43 VAL C 1 44 ASN N 1 44 ASN CA 1 44 ASN C -169.00 -73.50 -156.25 -161.41 -166.18 0.89 1 0 "[ . 1]"
20 . 1 44 ASN N 1 44 ASN CA 1 44 ASN C 1 45 THR N 80.20 -179.80 127.84 150.07 138.91 . . 0 "[ . 1]"
21 . 1 44 ASN C 1 45 THR N 1 45 THR CA 1 45 THR C -142.00 -82.00 -96.95 -144.41 -77.48 4.52 10 0 "[ . 1]"
22 . 1 45 THR N 1 45 THR CA 1 45 THR C 1 46 PHE N 73.00 173.00 116.67 105.13 150.39 . . 0 "[ . 1]"
23 . 1 45 THR C 1 46 PHE N 1 46 PHE CA 1 46 PHE C -149.40 -89.40 -91.92 -88.97 -89.87 7.14 10 3 "[ . *- +]"
24 . 1 46 PHE N 1 46 PHE CA 1 46 PHE C 1 47 VAL N 88.00 -172.00 126.47 98.49 157.12 . . 0 "[ . 1]"
25 . 1 46 PHE C 1 47 VAL N 1 47 VAL CA 1 47 VAL C -137.00 -73.00 -89.91 -69.61 -81.89 5.73 5 2 "[ + -1]"
26 . 1 47 VAL N 1 47 VAL CA 1 47 VAL C 1 48 HIS N 70.00 170.00 140.53 114.06 165.73 . . 0 "[ . 1]"
27 . 1 52 ALA C 1 53 ASP N 1 53 ASP CA 1 53 ASP C -102.20 -42.20 -69.76 -78.36 -63.02 . . 0 "[ . 1]"
28 . 1 53 ASP N 1 53 ASP CA 1 53 ASP C 1 54 VAL N -76.60 23.70 -46.88 -52.31 -36.43 . . 0 "[ . 1]"
29 . 1 53 ASP C 1 54 VAL N 1 54 VAL CA 1 54 VAL C -90.50 -30.50 -50.26 -47.03 -47.61 . . 0 "[ . 1]"
30 . 1 54 VAL N 1 54 VAL CA 1 54 VAL C 1 55 LYS N -88.90 11.10 -45.55 -48.05 -50.02 . . 0 "[ . 1]"
31 . 1 54 VAL C 1 55 LYS N 1 55 LYS CA 1 55 LYS C -95.50 -35.50 -57.71 -52.00 -55.76 . . 0 "[ . 1]"
32 . 1 55 LYS N 1 55 LYS CA 1 55 LYS C 1 56 ALA N -77.00 23.00 -47.28 -57.46 -28.03 . . 0 "[ . 1]"
33 . 1 58 CYS C 1 59 SER N 1 59 SER CA 1 59 SER C -160.80 -53.70 -99.77 -99.65 -102.95 . . 0 "[ . 1]"
34 . 1 59 SER N 1 59 SER CA 1 59 SER C 1 60 GLN N -115.00 125.00 29.11 41.79 37.79 . . 0 "[ . 1]"
35 . 1 60 GLN C 1 61 LYS N 1 61 LYS CA 1 61 LYS C -136.80 -57.80 -114.38 -97.96 -110.69 . . 0 "[ . 1]"
36 . 1 61 LYS N 1 61 LYS CA 1 61 LYS C 1 62 LYS N 67.40 171.20 104.24 106.82 105.30 . . 0 "[ . 1]"
37 . 1 61 LYS C 1 62 LYS N 1 62 LYS CA 1 62 LYS C -122.20 -62.20 -60.73 -63.72 -56.60 5.60 4 1 "[ +. 1]"
38 . 1 62 LYS N 1 62 LYS CA 1 62 LYS C 1 63 VAL N 65.40 165.40 130.08 135.14 133.26 . . 0 "[ . 1]"
39 . 1 64 THR C 1 65 CYS N 1 65 CYS CA 1 65 CYS C -170.80 -37.20 -64.81 -48.46 -58.53 . . 0 "[ . 1]"
40 . 1 65 CYS N 1 65 CYS CA 1 65 CYS C 1 66 LYS N 93.80 -166.20 171.66 152.88 -171.36 . . 0 "[ . 1]"
41 . 1 72 CYS C 1 73 TYR N 1 73 TYR CA 1 73 TYR C -168.20 -98.20 -121.41 -132.74 -98.87 . . 0 "[ . 1]"
42 . 1 73 TYR N 1 73 TYR CA 1 73 TYR C 1 74 GLN N 93.10 -166.90 130.75 132.96 124.43 . . 0 "[ . 1]"
43 . 1 73 TYR C 1 74 GLN N 1 74 GLN CA 1 74 GLN C -139.10 -79.10 -88.46 -96.59 -78.19 0.91 3 0 "[ . 1]"
44 . 1 74 GLN N 1 74 GLN CA 1 74 GLN C 1 75 SER N 73.40 173.40 135.46 130.54 139.46 . . 0 "[ . 1]"
45 . 1 74 GLN C 1 75 SER N 1 75 SER CA 1 75 SER C -137.10 -53.70 -59.93 -65.15 -51.76 1.94 6 0 "[ . 1]"
46 . 1 75 SER N 1 75 SER CA 1 75 SER C 1 76 LYS N 60.90 160.90 148.67 139.77 162.32 1.42 3 0 "[ . 1]"
47 . 1 80 ARG C 1 81 ILE N 1 81 ILE CA 1 81 ILE C -171.30 -102.70 -121.20 -102.01 -112.50 0.77 8 0 "[ . 1]"
48 . 1 81 ILE N 1 81 ILE CA 1 81 ILE C 1 82 THR N 94.40 -165.60 143.31 123.27 155.64 . . 0 "[ . 1]"
49 . 1 81 ILE C 1 82 THR N 1 82 THR CA 1 82 THR C -142.40 -69.50 -107.77 -77.43 -90.07 . . 0 "[ . 1]"
50 . 1 82 THR N 1 82 THR CA 1 82 THR C 1 83 ASP N 61.00 161.00 93.42 82.39 101.54 . . 0 "[ . 1]"
51 . 1 82 THR C 1 83 ASP N 1 83 ASP CA 1 83 ASP C -147.00 -59.00 -72.70 -74.82 -76.44 . . 0 "[ . 1]"
52 . 1 83 ASP N 1 83 ASP CA 1 83 ASP C 1 84 CYS N 70.00 170.00 122.72 118.94 113.78 . . 0 "[ . 1]"
53 . 1 83 ASP C 1 84 CYS N 1 84 CYS CA 1 84 CYS C -160.20 -100.20 -108.39 -143.92 -90.72 9.48 10 6 "[* * .**- +]"
54 . 1 84 CYS N 1 84 CYS CA 1 84 CYS C 1 85 ARG N 108.80 -151.20 119.82 107.57 135.12 1.23 2 0 "[ . 1]"
55 . 1 84 CYS C 1 85 ARG N 1 85 ARG CA 1 85 ARG C -150.10 -83.30 -129.35 -122.97 -128.79 . . 0 "[ . 1]"
56 . 1 85 ARG N 1 85 ARG CA 1 85 ARG C 1 86 GLU N 71.50 171.50 156.00 160.87 155.43 . . 0 "[ . 1]"
57 . 1 85 ARG C 1 86 GLU N 1 86 GLU CA 1 86 GLU C -154.00 -94.00 -79.75 -78.81 -80.19 19.92 5 10 [****+*-***]
58 . 1 86 GLU N 1 86 GLU CA 1 86 GLU C 1 87 THR N 96.20 -163.80 137.16 143.39 139.45 . . 0 "[ . 1]"
59 . 1 86 GLU C 1 87 THR N 1 87 THR CA 1 87 THR C -161.20 -70.50 -104.83 -148.64 -68.75 1.75 7 0 "[ . 1]"
60 . 1 87 THR N 1 87 THR CA 1 87 THR C 1 88 GLY N 107.10 -152.90 -179.51 152.89 -144.57 8.33 10 1 "[ . +]"
61 . 1 89 SER C 1 90 SER N 1 90 SER CA 1 90 SER C -134.30 -38.20 -59.55 -48.15 -51.76 . . 0 "[ . 1]"
62 . 1 90 SER N 1 90 SER CA 1 90 SER C 1 91 LYS N 60.10 160.10 106.66 58.22 138.74 1.88 8 0 "[ . 1]"
63 . 1 90 SER C 1 91 LYS N 1 91 LYS CA 1 91 LYS C -148.50 -48.70 -124.28 -140.50 -60.71 . . 0 "[ . 1]"
64 . 1 91 LYS N 1 91 LYS CA 1 91 LYS C 1 92 TYR N 59.00 159.00 78.87 65.29 163.43 4.43 5 0 "[ . 1]"
65 . 1 91 LYS C 1 92 TYR N 1 92 TYR CA 1 92 TYR C -139.30 -51.60 -50.50 -44.36 -44.73 9.21 8 9 [****.-*+**]
66 . 1 92 TYR N 1 92 TYR CA 1 92 TYR C 1 93 PRO N 77.80 -159.00 129.11 126.06 134.20 . . 0 "[ . 1]"
67 . 1 93 PRO C 1 94 ASN N 1 94 ASN CA 1 94 ASN C -124.80 -64.80 -74.89 -77.04 -72.18 . . 0 "[ . 1]"
68 . 1 94 ASN N 1 94 ASN CA 1 94 ASN C 1 95 CYS N 55.00 154.90 64.13 60.18 70.31 . . 0 "[ . 1]"
69 . 1 94 ASN C 1 95 CYS N 1 95 CYS CA 1 95 CYS C -163.30 -70.70 -74.36 -82.79 -69.74 0.96 1 0 "[ . 1]"
70 . 1 95 CYS N 1 95 CYS CA 1 95 CYS C 1 96 ALA N 89.20 -170.80 130.79 88.71 157.03 0.49 3 0 "[ . 1]"
71 . 1 95 CYS C 1 96 ALA N 1 96 ALA CA 1 96 ALA C -141.20 -81.20 -110.71 -129.33 -135.38 8.22 3 3 "[ +*- 1]"
72 . 1 96 ALA N 1 96 ALA CA 1 96 ALA C 1 97 TYR N 77.50 177.40 91.12 108.15 103.32 6.44 4 1 "[ +. 1]"
73 . 1 96 ALA C 1 97 TYR N 1 97 TYR CA 1 97 TYR C -152.30 -92.30 -92.72 -90.62 -97.07 10.35 9 4 "[ * - * +1]"
74 . 1 97 TYR N 1 97 TYR CA 1 97 TYR C 1 98 LYS N 84.50 -175.50 147.97 165.18 152.77 . . 0 "[ . 1]"
75 . 1 97 TYR C 1 98 LYS N 1 98 LYS CA 1 98 LYS C -149.70 -68.80 -137.51 -147.25 -118.70 . . 0 "[ . 1]"
76 . 1 98 LYS N 1 98 LYS CA 1 98 LYS C 1 99 THR N 64.10 164.10 132.21 109.52 162.48 . . 0 "[ . 1]"
77 . 1 98 LYS C 1 99 THR N 1 99 THR CA 1 99 THR C -133.10 -73.10 -95.71 -89.91 -95.22 3.14 3 0 "[ . 1]"
78 . 1 99 THR N 1 99 THR CA 1 99 THR C 1 100 THR N 68.50 168.50 145.42 129.59 158.18 . . 0 "[ . 1]"
79 . 1 99 THR C 1 100 THR N 1 100 THR CA 1 100 THR C -148.50 -68.10 -120.77 -138.82 -101.75 . . 0 "[ . 1]"
80 . 1 100 THR N 1 100 THR CA 1 100 THR C 1 101 GLN N 75.60 175.60 105.16 87.79 121.21 . . 0 "[ . 1]"
81 . 1 100 THR C 1 101 GLN N 1 101 GLN CA 1 101 GLN C -125.40 -65.40 -72.65 -81.68 -64.41 0.99 1 0 "[ . 1]"
82 . 1 101 GLN N 1 101 GLN CA 1 101 GLN C 1 102 VAL N 76.60 176.60 123.32 114.38 134.42 . . 0 "[ . 1]"
83 . 1 101 GLN C 1 102 VAL N 1 102 VAL CA 1 102 VAL C -150.00 -90.00 -145.13 -136.78 -140.17 0.62 5 0 "[ . 1]"
84 . 1 102 VAL N 1 102 VAL CA 1 102 VAL C 1 103 GLU N 104.30 -155.70 159.44 140.98 174.56 . . 0 "[ . 1]"
85 . 1 102 VAL C 1 103 GLU N 1 103 GLU CA 1 103 GLU C -165.00 -71.50 -115.97 -128.59 -89.09 . . 0 "[ . 1]"
86 . 1 103 GLU N 1 103 GLU CA 1 103 GLU C 1 104 LYS N 83.60 -176.40 110.23 98.12 93.37 . . 0 "[ . 1]"
87 . 1 103 GLU C 1 104 LYS N 1 104 LYS CA 1 104 LYS C -163.70 -103.70 -144.85 -134.06 -135.78 0.15 6 0 "[ . 1]"
88 . 1 104 LYS N 1 104 LYS CA 1 104 LYS C 1 105 HIS N 109.20 -150.80 165.23 165.38 162.85 . . 0 "[ . 1]"
89 . 1 107 ILE C 1 108 VAL N 1 108 VAL CA 1 108 VAL C -163.00 -97.50 -116.06 -125.77 -93.97 3.53 9 0 "[ . 1]"
90 . 1 108 VAL N 1 108 VAL CA 1 108 VAL C 1 109 ALA N 112.50 -147.50 155.32 144.10 172.41 . . 0 "[ . 1]"
91 . 1 108 VAL C 1 109 ALA N 1 109 ALA CA 1 109 ALA C -165.80 -76.00 -95.02 -100.57 -116.53 . . 0 "[ . 1]"
92 . 1 109 ALA N 1 109 ALA CA 1 109 ALA C 1 110 CYS N 90.20 -169.80 115.85 123.91 117.06 . . 0 "[ . 1]"
93 . 1 109 ALA C 1 110 CYS N 1 110 CYS CA 1 110 CYS C -157.70 -97.70 -105.53 -125.25 -94.94 2.76 7 0 "[ . 1]"
94 . 1 110 CYS N 1 110 CYS CA 1 110 CYS C 1 111 GLY N 105.20 -154.80 145.38 138.90 158.06 . . 0 "[ . 1]"
95 . 1 110 CYS C 1 111 GLY N 1 111 GLY CA 1 111 GLY C 169.70 -100.00 174.90 -178.82 177.98 1.01 7 0 "[ . 1]"
96 . 1 111 GLY N 1 111 GLY CA 1 111 GLY C 1 112 GLY N 106.80 -153.20 -154.91 -150.52 -157.20 5.42 3 3 "[ + .*- 1]"
97 . 1 115 SER C 1 116 VAL N 1 116 VAL CA 1 116 VAL C 176.10 -73.10 -128.08 -132.63 -138.37 . . 0 "[ . 1]"
98 . 1 116 VAL N 1 116 VAL CA 1 116 VAL C 1 117 PRO N 66.60 -165.80 144.71 134.98 151.45 . . 0 "[ . 1]"
99 . 1 118 VAL C 1 119 HIS N 1 119 HIS CA 1 119 HIS C -146.00 -71.00 -148.22 -150.38 -144.79 4.38 4 0 "[ . 1]"
100 . 1 119 HIS N 1 119 HIS CA 1 119 HIS C 1 120 PHE N 84.40 -175.60 170.35 164.33 -174.73 0.87 9 0 "[ . 1]"
101 . 1 119 HIS C 1 120 PHE N 1 120 PHE CA 1 120 PHE C -136.30 -55.40 -110.17 -109.16 -120.33 1.71 9 0 "[ . 1]"
102 . 1 120 PHE N 1 120 PHE CA 1 120 PHE C 1 121 ASP N 67.40 167.40 144.03 138.45 148.24 . . 0 "[ . 1]"
103 . 1 122 ALA C 1 123 SER N 1 123 SER CA 1 123 SER C -142.80 -74.30 -139.18 -144.57 -132.01 1.77 2 0 "[ . 1]"
104 . 1 123 SER N 1 123 SER CA 1 123 SER C 1 124 VAL N 85.70 -174.30 124.51 133.58 130.32 . . 0 "[ . 1]"
stop_
save_
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