NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
476319 |
2rop   |
11041 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2rop
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 194
_TA_constraint_stats_list.Viol_count 882
_TA_constraint_stats_list.Viol_total 52375.49
_TA_constraint_stats_list.Viol_max 21.51
_TA_constraint_stats_list.Viol_rms 1.74
_TA_constraint_stats_list.Viol_average_all_restraints 0.67
_TA_constraint_stats_list.Viol_average_violations_only 2.97
_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 20 VAL N 1 20 VAL CA 1 20 VAL C 1 21 THR N 60.00 180.00 157.47 159.02 158.80 . . 0 "[ . 1 . 2]"
2 . 1 20 VAL C 1 21 THR N 1 21 THR CA 1 21 THR C -140.00 -100.00 -106.91 -101.40 -107.37 8.19 5 1 "[ + 1 . 2]"
3 . 1 21 THR N 1 21 THR CA 1 21 THR C 1 22 LEU N 60.00 180.00 143.05 142.13 138.25 . . 0 "[ . 1 . 2]"
4 . 1 21 THR C 1 22 LEU N 1 22 LEU CA 1 22 LEU C -140.00 -100.00 -136.69 -146.24 -112.16 6.24 14 2 "[ - . 1 +. 2]"
5 . 1 22 LEU N 1 22 LEU CA 1 22 LEU C 1 23 GLN N 60.00 180.00 143.58 126.44 176.42 . . 0 "[ . 1 . 2]"
6 . 1 22 LEU C 1 23 GLN N 1 23 GLN CA 1 23 GLN C -140.00 -100.00 -105.36 -103.89 -109.71 7.00 5 1 "[ + 1 . 2]"
7 . 1 23 GLN N 1 23 GLN CA 1 23 GLN C 1 24 LEU N 60.00 180.00 130.61 110.33 161.97 . . 0 "[ . 1 . 2]"
8 . 1 23 GLN C 1 24 LEU N 1 24 LEU CA 1 24 LEU C -140.00 -100.00 -142.44 -145.13 -146.46 8.82 7 6 "[* *. + -1* . *2]"
9 . 1 24 LEU N 1 24 LEU CA 1 24 LEU C 1 25 ARG N 60.00 180.00 144.68 127.45 160.52 . . 0 "[ . 1 . 2]"
10 . 1 24 LEU C 1 25 ARG N 1 25 ARG CA 1 25 ARG C -140.00 -100.00 -104.30 -98.70 -99.43 4.88 8 0 "[ . 1 . 2]"
11 . 1 25 ARG N 1 25 ARG CA 1 25 ARG C 1 26 ILE N 60.00 180.00 117.34 101.57 155.64 . . 0 "[ . 1 . 2]"
12 . 1 25 ARG C 1 26 ILE N 1 26 ILE CA 1 26 ILE C -160.00 -80.00 -89.62 -107.32 -135.16 3.63 5 0 "[ . 1 . 2]"
13 . 1 26 ILE N 1 26 ILE CA 1 26 ILE C 1 27 ASP N 60.00 180.00 142.76 128.99 157.37 . . 0 "[ . 1 . 2]"
14 . 1 26 ILE C 1 27 ASP N 1 27 ASP CA 1 27 ASP C -140.00 -100.00 -101.83 -96.64 -97.22 4.46 2 0 "[ . 1 . 2]"
15 . 1 27 ASP N 1 27 ASP CA 1 27 ASP C 1 28 GLY N 60.00 180.00 135.39 133.97 129.90 . . 0 "[ . 1 . 2]"
16 . 1 28 GLY C 1 29 MET N 1 29 MET CA 1 29 MET C -70.00 -30.00 -64.95 -73.32 -56.52 3.32 18 0 "[ . 1 . 2]"
17 . 1 29 MET N 1 29 MET CA 1 29 MET C 1 30 HIS N -60.00 0.00 -16.25 -7.64 -10.41 3.83 18 0 "[ . 1 . 2]"
18 . 1 32 LYS C 1 33 SER N 1 33 SER CA 1 33 SER C -70.00 -30.00 -54.67 -63.59 -45.27 . . 0 "[ . 1 . 2]"
19 . 1 33 SER N 1 33 SER CA 1 33 SER C 1 34 CYS N -60.00 0.00 -25.70 -25.16 -27.35 . . 0 "[ . 1 . 2]"
20 . 1 33 SER C 1 34 CYS N 1 34 CYS CA 1 34 CYS C -70.00 -30.00 -59.78 -74.75 -45.68 4.75 18 0 "[ . 1 . 2]"
21 . 1 34 CYS N 1 34 CYS CA 1 34 CYS C 1 35 VAL N -60.00 0.00 -45.70 -58.19 -18.05 . . 0 "[ . 1 . 2]"
22 . 1 34 CYS C 1 35 VAL N 1 35 VAL CA 1 35 VAL C -70.00 -30.00 -72.70 -77.14 -62.79 7.14 13 3 "[ * - 1 + . 2]"
23 . 1 35 VAL N 1 35 VAL CA 1 35 VAL C 1 36 LEU N -60.00 0.00 -21.64 -31.66 -6.31 . . 0 "[ . 1 . 2]"
24 . 1 35 VAL C 1 36 LEU N 1 36 LEU CA 1 36 LEU C -70.00 -30.00 -59.69 -61.49 -63.34 . . 0 "[ . 1 . 2]"
25 . 1 36 LEU N 1 36 LEU CA 1 36 LEU C 1 37 ASN N -60.00 0.00 -56.30 -62.77 -47.96 2.77 18 0 "[ . 1 . 2]"
26 . 1 36 LEU C 1 37 ASN N 1 37 ASN CA 1 37 ASN C -70.00 -30.00 -60.13 -63.11 -65.15 . . 0 "[ . 1 . 2]"
27 . 1 37 ASN N 1 37 ASN CA 1 37 ASN C 1 38 ILE N -60.00 0.00 -35.02 -26.40 -28.59 . . 0 "[ . 1 . 2]"
28 . 1 37 ASN C 1 38 ILE N 1 38 ILE CA 1 38 ILE C -70.00 -30.00 -63.41 -70.50 -56.81 0.50 4 0 "[ . 1 . 2]"
29 . 1 38 ILE N 1 38 ILE CA 1 38 ILE C 1 39 GLU N -60.00 0.00 -49.44 -53.07 -54.97 . . 0 "[ . 1 . 2]"
30 . 1 38 ILE C 1 39 GLU N 1 39 GLU CA 1 39 GLU C -70.00 -30.00 -62.42 -68.98 -52.36 . . 0 "[ . 1 . 2]"
31 . 1 39 GLU N 1 39 GLU CA 1 39 GLU C 1 40 GLU N -60.00 0.00 -32.58 -33.80 -34.63 . . 0 "[ . 1 . 2]"
32 . 1 39 GLU C 1 40 GLU N 1 40 GLU CA 1 40 GLU C -70.00 -30.00 -67.19 -75.64 -56.03 5.64 5 1 "[ + 1 . 2]"
33 . 1 40 GLU N 1 40 GLU CA 1 40 GLU C 1 41 ASN N -60.00 0.00 -43.01 -39.91 -40.40 . . 0 "[ . 1 . 2]"
34 . 1 40 GLU C 1 41 ASN N 1 41 ASN CA 1 41 ASN C -90.00 -10.00 -92.48 -96.35 -83.47 6.35 14 3 "[ . -* +. 2]"
35 . 1 41 ASN N 1 41 ASN CA 1 41 ASN C 1 42 ILE N -60.00 0.00 -27.46 -25.01 -28.44 . . 0 "[ . 1 . 2]"
36 . 1 41 ASN C 1 42 ILE N 1 42 ILE CA 1 42 ILE C -140.00 -100.00 -103.44 -122.48 -93.04 6.96 11 1 "[ . 1+ . 2]"
37 . 1 42 ILE N 1 42 ILE CA 1 42 ILE C 1 43 GLY N 60.00 180.00 119.31 121.69 119.64 . . 0 "[ . 1 . 2]"
38 . 1 45 LEU C 1 46 LEU N 1 46 LEU CA 1 46 LEU C -120.00 80.00 -52.48 -38.24 -48.29 . . 0 "[ . 1 . 2]"
39 . 1 46 LEU N 1 46 LEU CA 1 46 LEU C 1 47 GLY N -100.00 60.00 -60.44 -82.78 -23.70 . . 0 "[ . 1 . 2]"
40 . 1 48 VAL N 1 48 VAL CA 1 48 VAL C 1 49 GLN N 90.00 180.00 118.85 109.58 130.62 . . 0 "[ . 1 . 2]"
41 . 1 49 GLN C 1 50 SER N 1 50 SER CA 1 50 SER C -140.00 -100.00 -147.69 -146.10 -147.36 11.08 20 19 "[*-*** *************+]"
42 . 1 50 SER N 1 50 SER CA 1 50 SER C 1 51 ILE N 60.00 180.00 165.99 148.09 -178.56 1.44 8 0 "[ . 1 . 2]"
43 . 1 50 SER C 1 51 ILE N 1 51 ILE CA 1 51 ILE C -140.00 -100.00 -132.79 -138.16 -138.78 4.79 18 0 "[ . 1 . 2]"
44 . 1 51 ILE N 1 51 ILE CA 1 51 ILE C 1 52 GLN N 60.00 180.00 139.73 121.14 155.07 . . 0 "[ . 1 . 2]"
45 . 1 51 ILE C 1 52 GLN N 1 52 GLN CA 1 52 GLN C -140.00 -100.00 -133.77 -144.16 -110.14 4.16 5 0 "[ . 1 . 2]"
46 . 1 52 GLN N 1 52 GLN CA 1 52 GLN C 1 53 VAL N 60.00 180.00 152.05 153.93 149.45 1.92 18 0 "[ . 1 . 2]"
47 . 1 52 GLN C 1 53 VAL N 1 53 VAL CA 1 53 VAL C -140.00 -100.00 -121.78 -141.80 -99.40 1.80 17 0 "[ . 1 . 2]"
48 . 1 53 VAL N 1 53 VAL CA 1 53 VAL C 1 54 SER N 60.00 180.00 139.45 86.97 166.96 . . 0 "[ . 1 . 2]"
49 . 1 53 VAL C 1 54 SER N 1 54 SER CA 1 54 SER C -140.00 -100.00 -130.70 -130.36 -133.82 1.48 17 0 "[ . 1 . 2]"
50 . 1 54 SER N 1 54 SER CA 1 54 SER C 1 55 LEU N 60.00 180.00 56.49 49.58 70.85 10.42 6 6 "[ .+ *** - *]"
51 . 1 58 LYS C 1 59 THR N 1 59 THR CA 1 59 THR C -140.00 -100.00 -101.23 -124.16 -94.28 5.72 6 1 "[ .+ 1 . 2]"
52 . 1 59 THR N 1 59 THR CA 1 59 THR C 1 60 ALA N 60.00 180.00 158.38 167.07 166.99 . . 0 "[ . 1 . 2]"
53 . 1 59 THR C 1 60 ALA N 1 60 ALA CA 1 60 ALA C -140.00 -100.00 -113.93 -106.10 -108.46 2.52 17 0 "[ . 1 . 2]"
54 . 1 60 ALA N 1 60 ALA CA 1 60 ALA C 1 61 GLN N 60.00 180.00 158.57 -179.71 171.70 0.30 2 0 "[ . 1 . 2]"
55 . 1 60 ALA C 1 61 GLN N 1 61 GLN CA 1 61 GLN C -140.00 -100.00 -132.41 -145.52 -112.29 5.52 17 1 "[ . 1 . + 2]"
56 . 1 61 GLN N 1 61 GLN CA 1 61 GLN C 1 62 VAL N 60.00 180.00 122.97 133.22 128.24 . . 0 "[ . 1 . 2]"
57 . 1 61 GLN C 1 62 VAL N 1 62 VAL CA 1 62 VAL C -140.00 -100.00 -110.05 -140.31 -96.22 3.78 16 0 "[ . 1 . 2]"
58 . 1 62 VAL N 1 62 VAL CA 1 62 VAL C 1 63 LYS N 60.00 180.00 136.57 132.14 143.53 . . 0 "[ . 1 . 2]"
59 . 1 62 VAL C 1 63 LYS N 1 63 LYS CA 1 63 LYS C -140.00 -100.00 -106.83 -117.83 -98.03 1.97 7 0 "[ . 1 . 2]"
60 . 1 63 LYS N 1 63 LYS CA 1 63 LYS C 1 64 TYR N 60.00 180.00 93.16 79.07 108.85 . . 0 "[ . 1 . 2]"
61 . 1 63 LYS C 1 64 TYR N 1 64 TYR CA 1 64 TYR C -140.00 -100.00 -121.10 -135.38 -100.39 . . 0 "[ . 1 . 2]"
62 . 1 64 TYR N 1 64 TYR CA 1 64 TYR C 1 65 ASP N 60.00 180.00 161.30 155.12 154.60 1.13 12 0 "[ . 1 . 2]"
63 . 1 64 TYR C 1 65 ASP N 1 65 ASP CA 1 65 ASP C -140.00 -100.00 -105.38 -96.57 -97.10 6.41 13 1 "[ . 1 + . 2]"
64 . 1 65 ASP N 1 65 ASP CA 1 65 ASP C 1 66 PRO N 60.00 180.00 121.83 103.02 142.64 . . 0 "[ . 1 . 2]"
65 . 1 66 PRO C 1 67 SER N 1 67 SER CA 1 67 SER C -120.00 80.00 -83.25 -121.96 -58.41 1.96 15 0 "[ . 1 . 2]"
66 . 1 67 SER N 1 67 SER CA 1 67 SER C 1 68 CYS N -100.00 60.00 -27.18 -5.98 -11.15 . . 0 "[ . 1 . 2]"
67 . 1 68 CYS C 1 69 THR N 1 69 THR CA 1 69 THR C -140.00 -100.00 -144.83 -128.51 -142.18 8.49 11 13 "[ *. ****+*- *****2]"
68 . 1 69 THR N 1 69 THR CA 1 69 THR C 1 70 SER N 60.00 180.00 -178.88 -176.31 -177.36 4.37 18 0 "[ . 1 . 2]"
69 . 1 71 PRO C 1 72 VAL N 1 72 VAL CA 1 72 VAL C -70.00 -30.00 -66.54 -64.28 -64.78 0.64 19 0 "[ . 1 . 2]"
70 . 1 72 VAL N 1 72 VAL CA 1 72 VAL C 1 73 ALA N -60.00 0.00 -35.79 -36.05 -36.65 . . 0 "[ . 1 . 2]"
71 . 1 72 VAL C 1 73 ALA N 1 73 ALA CA 1 73 ALA C -70.00 -30.00 -69.20 -74.43 -66.26 4.43 2 0 "[ . 1 . 2]"
72 . 1 73 ALA N 1 73 ALA CA 1 73 ALA C 1 74 LEU N -60.00 0.00 -40.42 -52.68 -30.09 . . 0 "[ . 1 . 2]"
73 . 1 73 ALA C 1 74 LEU N 1 74 LEU CA 1 74 LEU C -70.00 -30.00 -65.53 -71.90 -57.35 1.90 7 0 "[ . 1 . 2]"
74 . 1 74 LEU N 1 74 LEU CA 1 74 LEU C 1 75 GLN N -60.00 0.00 -45.89 -48.87 -53.16 . . 0 "[ . 1 . 2]"
75 . 1 74 LEU C 1 75 GLN N 1 75 GLN CA 1 75 GLN C -70.00 -30.00 -56.89 -69.78 -49.77 . . 0 "[ . 1 . 2]"
76 . 1 75 GLN N 1 75 GLN CA 1 75 GLN C 1 76 ARG N -60.00 0.00 -50.10 -47.96 -51.73 . . 0 "[ . 1 . 2]"
77 . 1 75 GLN C 1 76 ARG N 1 76 ARG CA 1 76 ARG C -70.00 -30.00 -63.09 -61.89 -63.29 2.20 5 0 "[ . 1 . 2]"
78 . 1 76 ARG N 1 76 ARG CA 1 76 ARG C 1 77 ALA N -60.00 0.00 -33.12 -48.34 -22.56 . . 0 "[ . 1 . 2]"
79 . 1 76 ARG C 1 77 ALA N 1 77 ALA CA 1 77 ALA C -70.00 -30.00 -68.77 -66.71 -69.10 4.25 6 0 "[ . 1 . 2]"
80 . 1 77 ALA N 1 77 ALA CA 1 77 ALA C 1 78 ILE N -60.00 0.00 -57.44 -56.99 -58.44 2.43 6 0 "[ . 1 . 2]"
81 . 1 77 ALA C 1 78 ILE N 1 78 ILE CA 1 78 ILE C -70.00 -30.00 -71.55 -74.56 -60.68 4.56 20 0 "[ . 1 . 2]"
82 . 1 78 ILE N 1 78 ILE CA 1 78 ILE C 1 79 GLU N -60.00 0.00 -30.07 -37.42 -17.30 . . 0 "[ . 1 . 2]"
83 . 1 78 ILE C 1 79 GLU N 1 79 GLU CA 1 79 GLU C -70.00 -30.00 -66.71 -73.81 -54.65 3.81 6 0 "[ . 1 . 2]"
84 . 1 79 GLU N 1 79 GLU CA 1 79 GLU C 1 80 ALA N -60.00 0.00 -25.22 -17.99 -19.42 . . 0 "[ . 1 . 2]"
85 . 1 85 ASN C 1 86 PHE N 1 86 PHE CA 1 86 PHE C -140.00 -100.00 -111.09 -109.49 -115.78 6.78 9 1 "[ . +1 . 2]"
86 . 1 86 PHE N 1 86 PHE CA 1 86 PHE C 1 87 LYS N 60.00 180.00 116.91 98.00 134.77 . . 0 "[ . 1 . 2]"
87 . 1 86 PHE C 1 87 LYS N 1 87 LYS CA 1 87 LYS C -140.00 -100.00 -100.64 -120.09 -92.31 7.69 4 2 "[ +. 1 . -2]"
88 . 1 87 LYS N 1 87 LYS CA 1 87 LYS C 1 88 VAL N 60.00 180.00 153.39 139.42 136.11 . . 0 "[ . 1 . 2]"
89 . 1 87 LYS C 1 88 VAL N 1 88 VAL CA 1 88 VAL C -140.00 -100.00 -121.81 -140.82 -98.66 1.34 3 0 "[ . 1 . 2]"
90 . 1 88 VAL N 1 88 VAL CA 1 88 VAL C 1 89 SER N 60.00 180.00 138.52 130.28 156.72 . . 0 "[ . 1 . 2]"
91 . 1 88 VAL C 1 89 SER N 1 89 SER CA 1 89 SER C -140.00 -100.00 -120.41 -134.13 -134.72 . . 0 "[ . 1 . 2]"
92 . 1 89 SER N 1 89 SER CA 1 89 SER C 1 90 LEU N 60.00 180.00 126.70 120.93 118.43 . . 0 "[ . 1 . 2]"
93 . 1 89 SER C 1 90 LEU N 1 90 LEU CA 1 90 LEU C -140.00 -100.00 -111.62 -145.22 -95.63 5.22 13 1 "[ . 1 + . 2]"
94 . 1 121 CYS C 1 122 SER N 1 122 SER CA 1 122 SER C -140.00 -100.00 -142.90 -145.37 -146.34 8.00 15 6 "[* .* 1* + - *]"
95 . 1 122 SER N 1 122 SER CA 1 122 SER C 1 123 THR N 60.00 180.00 150.26 141.44 160.17 . . 0 "[ . 1 . 2]"
96 . 1 122 SER C 1 123 THR N 1 123 THR CA 1 123 THR C -140.00 -100.00 -103.18 -114.53 -121.55 3.02 18 0 "[ . 1 . 2]"
97 . 1 123 THR N 1 123 THR CA 1 123 THR C 1 124 THR N 60.00 180.00 140.42 139.99 138.12 . . 0 "[ . 1 . 2]"
98 . 1 123 THR C 1 124 THR N 1 124 THR CA 1 124 THR C -140.00 -100.00 -140.40 -142.26 -142.78 6.49 8 1 "[ . + 1 . 2]"
99 . 1 124 THR N 1 124 THR CA 1 124 THR C 1 125 LEU N 60.00 180.00 156.27 141.85 167.52 . . 0 "[ . 1 . 2]"
100 . 1 124 THR C 1 125 LEU N 1 125 LEU CA 1 125 LEU C -140.00 -100.00 -110.13 -102.68 -105.17 3.54 15 0 "[ . 1 . 2]"
101 . 1 125 LEU N 1 125 LEU CA 1 125 LEU C 1 126 ILE N 60.00 180.00 135.47 127.46 144.55 . . 0 "[ . 1 . 2]"
102 . 1 125 LEU C 1 126 ILE N 1 126 ILE CA 1 126 ILE C -140.00 -100.00 -122.77 -134.20 -112.28 . . 0 "[ . 1 . 2]"
103 . 1 126 ILE N 1 126 ILE CA 1 126 ILE C 1 127 ALA N 60.00 180.00 137.26 133.26 144.54 . . 0 "[ . 1 . 2]"
104 . 1 126 ILE C 1 127 ALA N 1 127 ALA CA 1 127 ALA C -140.00 -100.00 -101.39 -102.60 -104.51 2.80 15 0 "[ . 1 . 2]"
105 . 1 127 ALA N 1 127 ALA CA 1 127 ALA C 1 128 ILE N 60.00 180.00 129.67 143.05 136.58 . . 0 "[ . 1 . 2]"
106 . 1 127 ALA C 1 128 ILE N 1 128 ILE CA 1 128 ILE C -140.00 -100.00 -125.59 -140.33 -109.66 0.33 8 0 "[ . 1 . 2]"
107 . 1 128 ILE N 1 128 ILE CA 1 128 ILE C 1 129 ALA N 60.00 180.00 136.15 118.44 147.53 . . 0 "[ . 1 . 2]"
108 . 1 128 ILE C 1 129 ALA N 1 129 ALA CA 1 129 ALA C -160.00 -90.00 -117.11 -106.07 -111.31 . . 0 "[ . 1 . 2]"
109 . 1 129 ALA N 1 129 ALA CA 1 129 ALA C 1 130 GLY N 60.00 180.00 61.42 70.55 66.63 6.57 8 2 "[ . + 1 . -2]"
110 . 1 129 ALA C 1 130 GLY N 1 130 GLY CA 1 130 GLY C -160.00 -90.00 -167.35 178.49 -154.73 21.51 2 11 "[*+ .-* * ***** *]"
111 . 1 130 GLY N 1 130 GLY CA 1 130 GLY C 1 131 MET N 60.00 180.00 52.51 45.92 56.23 14.08 6 17 "[ **-+******* ******]"
112 . 1 133 CYS C 1 134 ALA N 1 134 ALA CA 1 134 ALA C -70.00 -30.00 -57.54 -54.44 -56.12 1.77 14 0 "[ . 1 . 2]"
113 . 1 134 ALA N 1 134 ALA CA 1 134 ALA C 1 135 SER N -60.00 0.00 -31.12 -28.49 -29.60 . . 0 "[ . 1 . 2]"
114 . 1 134 ALA C 1 135 SER N 1 135 SER CA 1 135 SER C -70.00 -30.00 -55.34 -65.76 -43.49 . . 0 "[ . 1 . 2]"
115 . 1 135 SER N 1 135 SER CA 1 135 SER C 1 136 CYS N -60.00 0.00 -30.09 -47.53 -20.94 . . 0 "[ . 1 . 2]"
116 . 1 135 SER C 1 136 CYS N 1 136 CYS CA 1 136 CYS C -70.00 -30.00 -62.54 -72.53 -54.15 2.53 17 0 "[ . 1 . 2]"
117 . 1 136 CYS N 1 136 CYS CA 1 136 CYS C 1 137 VAL N -60.00 0.00 -31.91 -30.22 -31.98 . . 0 "[ . 1 . 2]"
118 . 1 136 CYS C 1 137 VAL N 1 137 VAL CA 1 137 VAL C -70.00 -30.00 -58.80 -59.85 -61.22 . . 0 "[ . 1 . 2]"
119 . 1 137 VAL N 1 137 VAL CA 1 137 VAL C 1 138 HIS N -60.00 0.00 -54.88 -60.50 -47.33 0.50 7 0 "[ . 1 . 2]"
120 . 1 137 VAL C 1 138 HIS N 1 138 HIS CA 1 138 HIS C -70.00 -30.00 -65.99 -66.98 -69.14 1.17 19 0 "[ . 1 . 2]"
121 . 1 138 HIS N 1 138 HIS CA 1 138 HIS C 1 139 SER N -60.00 0.00 -23.01 -22.37 -23.27 . . 0 "[ . 1 . 2]"
122 . 1 138 HIS C 1 139 SER N 1 139 SER CA 1 139 SER C -70.00 -30.00 -71.29 -72.24 -72.52 4.62 10 0 "[ . 1 . 2]"
123 . 1 139 SER N 1 139 SER CA 1 139 SER C 1 140 ILE N -60.00 0.00 -53.92 -62.11 -43.35 2.11 13 0 "[ . 1 . 2]"
124 . 1 139 SER C 1 140 ILE N 1 140 ILE CA 1 140 ILE C -70.00 -30.00 -67.47 -67.13 -68.06 0.83 9 0 "[ . 1 . 2]"
125 . 1 140 ILE N 1 140 ILE CA 1 140 ILE C 1 141 GLU N -60.00 0.00 -52.38 -54.48 -55.45 . . 0 "[ . 1 . 2]"
126 . 1 140 ILE C 1 141 GLU N 1 141 GLU CA 1 141 GLU C -70.00 -30.00 -56.40 -63.19 -51.46 . . 0 "[ . 1 . 2]"
127 . 1 141 GLU N 1 141 GLU CA 1 141 GLU C 1 142 GLY N -60.00 0.00 -30.80 -29.96 -30.68 . . 0 "[ . 1 . 2]"
128 . 1 141 GLU C 1 142 GLY N 1 142 GLY CA 1 142 GLY C -70.00 -30.00 -74.32 -75.63 -76.06 7.80 17 9 "[*** - * *1* . + *]"
129 . 1 142 GLY N 1 142 GLY CA 1 142 GLY C 1 143 MET N -60.00 0.00 -58.51 -62.65 -34.31 2.65 16 0 "[ . 1 . 2]"
130 . 1 142 GLY C 1 143 MET N 1 143 MET CA 1 143 MET C -70.00 -30.00 -69.17 -70.56 -71.29 5.56 16 1 "[ . 1 .+ 2]"
131 . 1 143 MET N 1 143 MET CA 1 143 MET C 1 144 ILE N -60.00 0.00 -43.70 -36.26 -38.21 . . 0 "[ . 1 . 2]"
132 . 1 143 MET C 1 144 ILE N 1 144 ILE CA 1 144 ILE C -70.00 -30.00 -70.98 -68.70 -70.67 5.52 18 1 "[ . 1 . + 2]"
133 . 1 144 ILE N 1 144 ILE CA 1 144 ILE C 1 145 SER N -60.00 0.00 -32.50 -54.08 -19.38 . . 0 "[ . 1 . 2]"
134 . 1 144 ILE C 1 145 SER N 1 145 SER CA 1 145 SER C -70.00 -30.00 -64.05 -66.11 -66.83 1.40 5 0 "[ . 1 . 2]"
135 . 1 145 SER N 1 145 SER CA 1 145 SER C 1 146 GLN N -60.00 0.00 -5.74 -21.99 3.07 3.07 6 0 "[ . 1 . 2]"
136 . 1 149 GLY C 1 150 VAL N 1 150 VAL CA 1 150 VAL C -120.00 80.00 -89.61 -122.80 -62.11 2.80 13 0 "[ . 1 . 2]"
137 . 1 150 VAL N 1 150 VAL CA 1 150 VAL C 1 151 GLN N -120.00 90.00 90.42 -29.27 100.41 10.41 10 11 "[* **.*-* +* *. * *]"
138 . 1 151 GLN C 1 152 GLN N 1 152 GLN CA 1 152 GLN C -140.00 -100.00 -140.88 -143.52 -143.97 7.31 5 1 "[ + 1 . 2]"
139 . 1 152 GLN N 1 152 GLN CA 1 152 GLN C 1 153 ILE N 60.00 180.00 137.59 140.75 137.07 . . 0 "[ . 1 . 2]"
140 . 1 152 GLN C 1 153 ILE N 1 153 ILE CA 1 153 ILE C -140.00 -100.00 -138.35 -144.96 -129.41 4.96 20 0 "[ . 1 . 2]"
141 . 1 153 ILE N 1 153 ILE CA 1 153 ILE C 1 154 SER N 60.00 180.00 136.53 137.04 136.12 . . 0 "[ . 1 . 2]"
142 . 1 153 ILE C 1 154 SER N 1 154 SER CA 1 154 SER C -140.00 -100.00 -139.13 -138.52 -138.95 3.26 16 0 "[ . 1 . 2]"
143 . 1 154 SER N 1 154 SER CA 1 154 SER C 1 155 VAL N 60.00 180.00 135.35 104.20 155.83 . . 0 "[ . 1 . 2]"
144 . 1 154 SER C 1 155 VAL N 1 155 VAL CA 1 155 VAL C -140.00 -100.00 -136.47 -115.69 -121.86 6.77 15 3 "[- .* 1 + 2]"
145 . 1 155 VAL N 1 155 VAL CA 1 155 VAL C 1 156 SER N 60.00 180.00 142.44 133.90 149.64 . . 0 "[ . 1 . 2]"
146 . 1 155 VAL C 1 156 SER N 1 156 SER CA 1 156 SER C -140.00 -100.00 -134.67 -124.94 -133.85 5.39 9 1 "[ . +1 . 2]"
147 . 1 156 SER N 1 156 SER CA 1 156 SER C 1 157 LEU N 60.00 180.00 126.23 77.69 151.37 . . 0 "[ . 1 . 2]"
148 . 1 156 SER C 1 157 LEU N 1 157 LEU CA 1 157 LEU C -70.00 -30.00 -66.84 -66.83 -70.02 6.76 17 2 "[ . 1 - + 2]"
149 . 1 157 LEU N 1 157 LEU CA 1 157 LEU C 1 158 ALA N -60.00 0.00 -23.76 -30.99 -15.67 . . 0 "[ . 1 . 2]"
150 . 1 157 LEU C 1 158 ALA N 1 158 ALA CA 1 158 ALA C -70.00 -30.00 -51.31 -54.63 -56.06 . . 0 "[ . 1 . 2]"
151 . 1 158 ALA N 1 158 ALA CA 1 158 ALA C 1 159 GLU N -60.00 0.00 -41.82 -39.82 -41.58 . . 0 "[ . 1 . 2]"
152 . 1 160 GLY C 1 161 THR N 1 161 THR CA 1 161 THR C -140.00 -100.00 -131.50 -130.93 -132.99 1.66 14 0 "[ . 1 . 2]"
153 . 1 161 THR N 1 161 THR CA 1 161 THR C 1 162 ALA N 60.00 180.00 146.96 139.02 155.86 . . 0 "[ . 1 . 2]"
154 . 1 161 THR C 1 162 ALA N 1 162 ALA CA 1 162 ALA C -140.00 -100.00 -113.73 -105.92 -111.20 0.37 5 0 "[ . 1 . 2]"
155 . 1 162 ALA N 1 162 ALA CA 1 162 ALA C 1 163 THR N 60.00 180.00 139.63 119.69 161.20 . . 0 "[ . 1 . 2]"
156 . 1 162 ALA C 1 163 THR N 1 163 THR CA 1 163 THR C -140.00 -100.00 -117.44 -118.52 -120.98 1.46 15 0 "[ . 1 . 2]"
157 . 1 163 THR N 1 163 THR CA 1 163 THR C 1 164 VAL N 60.00 180.00 126.33 112.26 139.21 . . 0 "[ . 1 . 2]"
158 . 1 163 THR C 1 164 VAL N 1 164 VAL CA 1 164 VAL C -140.00 -100.00 -141.18 -140.92 -141.47 2.76 3 0 "[ . 1 . 2]"
159 . 1 164 VAL N 1 164 VAL CA 1 164 VAL C 1 165 LEU N 60.00 180.00 139.77 138.21 137.50 . . 0 "[ . 1 . 2]"
160 . 1 164 VAL C 1 165 LEU N 1 165 LEU CA 1 165 LEU C -140.00 -100.00 -95.91 -98.34 -91.31 8.69 16 5 "[ * *1 *+ -2]"
161 . 1 165 LEU N 1 165 LEU CA 1 165 LEU C 1 166 TYR N 60.00 180.00 108.11 93.52 118.73 . . 0 "[ . 1 . 2]"
162 . 1 165 LEU C 1 166 TYR N 1 166 TYR CA 1 166 TYR C -140.00 -100.00 -111.12 -136.70 -94.62 5.38 9 1 "[ . +1 . 2]"
163 . 1 166 TYR N 1 166 TYR CA 1 166 TYR C 1 167 ASN N 60.00 180.00 158.61 154.52 164.20 . . 0 "[ . 1 . 2]"
164 . 1 166 TYR C 1 167 ASN N 1 167 ASN CA 1 167 ASN C -140.00 -100.00 -97.64 -107.02 -93.46 6.54 1 2 "[+ . 1 - . 2]"
165 . 1 167 ASN N 1 167 ASN CA 1 167 ASN C 1 168 PRO N 60.00 180.00 108.45 93.34 116.62 . . 0 "[ . 1 . 2]"
166 . 1 169 ALA C 1 170 VAL N 1 170 VAL CA 1 170 VAL C -120.00 -80.00 -106.52 -124.36 -79.50 4.36 16 0 "[ . 1 . 2]"
167 . 1 171 ILE C 1 172 SER N 1 172 SER CA 1 172 SER C -140.00 -100.00 -106.71 -106.42 -112.71 3.01 12 0 "[ . 1 . 2]"
168 . 1 172 SER N 1 172 SER CA 1 172 SER C 1 173 PRO N 60.00 180.00 148.62 141.09 159.32 . . 0 "[ . 1 . 2]"
169 . 1 173 PRO C 1 174 GLU N 1 174 GLU CA 1 174 GLU C -70.00 -30.00 -66.70 -73.82 -57.82 3.82 17 0 "[ . 1 . 2]"
170 . 1 174 GLU N 1 174 GLU CA 1 174 GLU C 1 175 GLU N -60.00 0.00 -28.69 -41.73 -15.94 . . 0 "[ . 1 . 2]"
171 . 1 174 GLU C 1 175 GLU N 1 175 GLU CA 1 175 GLU C -70.00 -30.00 -74.45 -78.23 -71.46 8.23 13 9 "[** . *1- + *** *2]"
172 . 1 175 GLU N 1 175 GLU CA 1 175 GLU C 1 176 LEU N -60.00 0.00 -31.82 -29.14 -30.72 . . 0 "[ . 1 . 2]"
173 . 1 175 GLU C 1 176 LEU N 1 176 LEU CA 1 176 LEU C -70.00 -30.00 -59.76 -58.29 -59.04 . . 0 "[ . 1 . 2]"
174 . 1 176 LEU N 1 176 LEU CA 1 176 LEU C 1 177 ARG N -60.00 0.00 -53.59 -58.82 -48.50 . . 0 "[ . 1 . 2]"
175 . 1 176 LEU C 1 177 ARG N 1 177 ARG CA 1 177 ARG C -70.00 -30.00 -56.76 -65.20 -49.73 . . 0 "[ . 1 . 2]"
176 . 1 177 ARG N 1 177 ARG CA 1 177 ARG C 1 178 ALA N -60.00 0.00 -43.90 -41.82 -46.63 . . 0 "[ . 1 . 2]"
177 . 1 177 ARG C 1 178 ALA N 1 178 ALA CA 1 178 ALA C -70.00 -30.00 -61.63 -68.85 -57.20 . . 0 "[ . 1 . 2]"
178 . 1 178 ALA N 1 178 ALA CA 1 178 ALA C 1 179 ALA N -60.00 0.00 -27.46 -18.84 -21.35 . . 0 "[ . 1 . 2]"
179 . 1 178 ALA C 1 179 ALA N 1 179 ALA CA 1 179 ALA C -70.00 -30.00 -71.57 -74.94 -67.44 4.94 2 0 "[ . 1 . 2]"
180 . 1 179 ALA N 1 179 ALA CA 1 179 ALA C 1 180 ILE N -60.00 0.00 -34.33 -36.44 -38.83 . . 0 "[ . 1 . 2]"
181 . 1 179 ALA C 1 180 ILE N 1 180 ILE CA 1 180 ILE C -70.00 -30.00 -72.36 -74.55 -70.10 4.55 20 0 "[ . 1 . 2]"
182 . 1 180 ILE N 1 180 ILE CA 1 180 ILE C 1 181 GLU N -60.00 0.00 -37.60 -34.52 -35.53 . . 0 "[ . 1 . 2]"
183 . 1 180 ILE C 1 181 GLU N 1 181 GLU CA 1 181 GLU C -70.00 -30.00 -65.69 -70.38 -59.97 0.38 14 0 "[ . 1 . 2]"
184 . 1 181 GLU N 1 181 GLU CA 1 181 GLU C 1 182 ASP N -60.00 0.00 -32.65 -34.13 -35.37 . . 0 "[ . 1 . 2]"
185 . 1 181 GLU C 1 182 ASP N 1 182 ASP CA 1 182 ASP C -70.00 -30.00 -70.46 -71.24 -71.66 4.19 10 0 "[ . 1 . 2]"
186 . 1 182 ASP N 1 182 ASP CA 1 182 ASP C 1 183 MET N -60.00 0.00 -28.28 -44.51 -5.11 . . 0 "[ . 1 . 2]"
187 . 1 185 PHE C 1 186 GLU N 1 186 GLU CA 1 186 GLU C -140.00 -100.00 -128.41 -101.37 -124.92 4.83 2 0 "[ . 1 . 2]"
188 . 1 186 GLU N 1 186 GLU CA 1 186 GLU C 1 187 ALA N 60.00 180.00 138.06 101.01 149.60 . . 0 "[ . 1 . 2]"
189 . 1 186 GLU C 1 187 ALA N 1 187 ALA CA 1 187 ALA C -140.00 -100.00 -133.27 -99.98 -116.26 2.93 16 0 "[ . 1 . 2]"
190 . 1 187 ALA N 1 187 ALA CA 1 187 ALA C 1 188 SER N 60.00 180.00 149.06 136.35 160.18 . . 0 "[ . 1 . 2]"
191 . 1 187 ALA C 1 188 SER N 1 188 SER CA 1 188 SER C -140.00 -100.00 -136.46 -141.36 -141.80 2.74 12 0 "[ . 1 . 2]"
192 . 1 188 SER N 1 188 SER CA 1 188 SER C 1 189 VAL N 60.00 180.00 136.47 122.92 146.95 . . 0 "[ . 1 . 2]"
193 . 1 188 SER C 1 189 VAL N 1 189 VAL CA 1 189 VAL C -120.00 80.00 -85.75 -88.11 -90.39 . . 0 "[ . 1 . 2]"
194 . 1 189 VAL N 1 189 VAL CA 1 189 VAL C 1 190 VAL N 60.00 180.00 107.26 59.78 136.39 0.22 20 0 "[ . 1 . 2]"
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