NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
486780 |
2kym   |
16970 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2kym
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 140
_TA_constraint_stats_list.Viol_count 604
_TA_constraint_stats_list.Viol_total 339788.19
_TA_constraint_stats_list.Viol_max 144.74
_TA_constraint_stats_list.Viol_rms 20.33
_TA_constraint_stats_list.Viol_average_all_restraints 6.07
_TA_constraint_stats_list.Viol_average_violations_only 28.13
_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 PHI 1 3 PRO C 1 4 LEU N 1 4 LEU CA 1 4 LEU C -155.00 -67.00 -104.88 -74.16 -76.70 0.02 6 0 "[ . 1 . 2]"
2 PHI 1 4 LEU C 1 5 PHE N 1 5 PHE CA 1 5 PHE C -155.00 -91.00 -126.28 -130.15 -133.22 . . 0 "[ . 1 . 2]"
3 PHI 1 5 PHE C 1 6 ALA N 1 6 ALA CA 1 6 ALA C -167.00 -99.00 -128.28 -142.91 -109.70 . . 0 "[ . 1 . 2]"
4 PHI 1 6 ALA C 1 7 VAL N 1 7 VAL CA 1 7 VAL C -158.00 -98.00 -126.72 -121.66 -123.27 . . 0 "[ . 1 . 2]"
5 PHI 1 8 THR C 1 9 LEU N 1 9 LEU CA 1 9 LEU C -118.00 -58.00 -109.29 -109.22 -112.44 0.14 7 0 "[ . 1 . 2]"
6 PHI 1 9 LEU C 1 10 TYR N 1 10 TYR CA 1 10 TYR C -164.00 -112.00 -135.89 -135.35 -136.49 . . 0 "[ . 1 . 2]"
7 PHI 1 10 TYR C 1 11 GLU N 1 11 GLU CA 1 11 GLU C -156.00 -80.00 -85.50 -92.68 -80.08 . . 0 "[ . 1 . 2]"
8 PHI 1 11 GLU C 1 12 PHE N 1 12 PHE CA 1 12 PHE C -130.00 -78.00 -93.34 -93.63 -97.17 . . 0 "[ . 1 . 2]"
9 PHI 1 12 PHE C 1 13 LYS N 1 13 LYS CA 1 13 LYS C -139.00 -79.00 -91.61 -113.01 -78.96 0.04 15 0 "[ . 1 . 2]"
10 PHI 1 13 LYS C 1 14 ALA N 1 14 ALA CA 1 14 ALA C -137.00 -41.00 -60.59 -58.23 -61.17 . . 0 "[ . 1 . 2]"
11 PHI 1 15 GLU C 1 16 ARG N 1 16 ARG CA 1 16 ARG C -172.00 -56.00 -129.13 -129.77 -132.45 . . 0 "[ . 1 . 2]"
12 PHI 1 16 ARG C 1 17 ASP N 1 17 ASP CA 1 17 ASP C -74.00 -46.00 -63.60 -65.02 -65.67 . . 0 "[ . 1 . 2]"
13 PHI 1 19 GLU C 1 20 LEU N 1 20 LEU CA 1 20 LEU C -164.00 -68.00 -123.09 -116.11 -118.12 . . 0 "[ . 1 . 2]"
14 PHI 1 20 LEU C 1 21 ASP N 1 21 ASP CA 1 21 ASP C -140.00 -48.00 -80.14 -97.78 -57.31 . . 0 "[ . 1 . 2]"
15 PHI 1 21 ASP C 1 22 VAL N 1 22 VAL CA 1 22 VAL C -153.00 -117.00 -144.39 -140.19 -142.47 0.15 3 0 "[ . 1 . 2]"
16 PHI 1 22 VAL C 1 23 SER N 1 23 SER CA 1 23 SER C -161.00 -65.00 -113.48 -114.93 -121.44 . . 0 "[ . 1 . 2]"
17 PHI 1 24 PRO C 1 25 GLY N 1 25 GLY CA 1 25 GLY C 77.00 109.00 107.34 109.00 108.50 0.49 15 0 "[ . 1 . 2]"
18 PHI 1 25 GLY C 1 26 GLU N 1 26 GLU CA 1 26 GLU C -92.00 -52.00 -90.58 -92.30 -83.83 0.30 10 0 "[ . 1 . 2]"
19 PHI 1 26 GLU C 1 27 ASN N 1 27 ASN CA 1 27 ASN C -135.00 -59.00 -102.77 -117.38 -86.67 . . 0 "[ . 1 . 2]"
20 PHI 1 27 ASN C 1 28 LEU N 1 28 LEU CA 1 28 LEU C -158.00 -98.00 -124.98 -144.46 -111.89 . . 0 "[ . 1 . 2]"
21 PHI 1 28 LEU C 1 29 SER N 1 29 SER CA 1 29 SER C -123.00 -75.00 -104.02 -105.94 -107.08 . . 0 "[ . 1 . 2]"
22 PHI 1 32 ALA C 1 33 HIS N 1 33 HIS CA 1 33 HIS C -172.00 -120.00 -125.66 -134.62 -119.45 0.55 11 0 "[ . 1 . 2]"
23 PHI 1 33 HIS C 1 34 TYR N 1 34 TYR CA 1 34 TYR C -163.00 -87.00 -142.65 -150.88 -135.39 . . 0 "[ . 1 . 2]"
24 PHI 1 37 GLU C 1 38 TRP N 1 38 TRP CA 1 38 TRP C -165.00 -81.00 -126.81 -152.75 -105.65 . . 0 "[ . 1 . 2]"
25 PHI 1 38 TRP C 1 39 PHE N 1 39 PHE CA 1 39 PHE C -165.00 -85.00 -124.42 -141.55 -116.45 . . 0 "[ . 1 . 2]"
26 PHI 1 39 PHE C 1 40 ILE N 1 40 ILE CA 1 40 ILE C -142.00 -70.00 -96.61 -113.94 -83.54 . . 0 "[ . 1 . 2]"
27 PHI 1 40 ILE C 1 41 ALA N 1 41 ALA CA 1 41 ALA C -150.00 -106.00 -111.25 -124.59 -105.71 0.29 14 0 "[ . 1 . 2]"
28 PHI 1 41 ALA C 1 42 LYS N 1 42 LYS CA 1 42 LYS C -154.00 -102.00 -120.24 -111.34 -111.46 . . 0 "[ . 1 . 2]"
29 PHI 1 43 PRO C 1 44 ILE N 1 44 ILE CA 1 44 ILE C -132.00 -44.00 -89.72 -101.33 -106.17 . . 0 "[ . 1 . 2]"
30 PHI 1 51 GLY C 1 52 LEU N 1 52 LEU CA 1 52 LEU C -172.00 -56.00 -137.99 -143.30 -131.11 . . 0 "[ . 1 . 2]"
31 PHI 1 52 LEU C 1 53 VAL N 1 53 VAL CA 1 53 VAL C -150.00 -126.00 -69.76 -69.76 -69.76 56.32 10 20 [*********+**-*******]
32 PHI 1 54 PRO C 1 55 VAL N 1 55 VAL CA 1 55 VAL C -91.00 -31.00 -78.18 -77.24 -77.56 . . 0 "[ . 1 . 2]"
33 PHI 1 55 VAL C 1 56 SER N 1 56 SER CA 1 56 SER C -98.00 -54.00 -125.09 -125.09 -125.82 33.94 17 20 [**********-*****+***]
34 PHI 1 57 TYR C 1 58 VAL N 1 58 VAL CA 1 58 VAL C -159.00 -107.00 -122.32 -127.62 -128.99 2.03 16 0 "[ . 1 . 2]"
35 PHI 1 58 VAL C 1 59 ARG N 1 59 ARG CA 1 59 ARG C -151.00 -83.00 -71.42 -64.69 -65.76 18.34 19 17 "[******* *****-. **+*]"
36 PHI 1 59 ARG C 1 60 ILE N 1 60 ILE CA 1 60 ILE C -110.00 -58.00 -132.06 -136.18 -141.86 35.69 3 20 [**+************-****]
37 PHI 1 60 ILE C 1 61 ILE N 1 61 ILE CA 1 61 ILE C -146.00 -98.00 -101.29 -119.42 -126.09 34.28 13 7 "[ *. * *+ * *-]"
38 PHI 1 62 ASP C 1 63 LEU N 1 63 LEU CA 1 63 LEU C -83.00 -47.00 -86.51 -92.01 -76.83 9.01 10 10 "[*** . **+* **. - 2]"
39 PHI 1 63 LEU C 1 64 MET N 1 64 MET CA 1 64 MET C -93.00 -49.00 -149.75 -145.92 -147.83 85.91 15 20 [**************+-****]
40 PHI 1 66 PRO C 1 67 ALA N 1 67 ALA CA 1 67 ALA C -113.00 -41.00 -79.10 -77.73 -80.02 . . 0 "[ . 1 . 2]"
41 PHI 1 67 ALA C 1 68 LYS N 1 68 LYS CA 1 68 LYS C -84.00 -40.00 -98.26 -96.77 -97.48 27.72 20 20 [**********-********+]
42 PHI 1 68 LYS C 1 69 TYR N 1 69 TYR CA 1 69 TYR C -121.00 -69.00 -84.04 -87.00 -87.03 7.70 11 1 "[ . 1+ . 2]"
43 PHI 1 70 ALA C 1 71 SER N 1 71 SER CA 1 71 SER C -117.00 -77.00 -55.10 -51.53 -51.55 25.92 18 18 "[********** * -***+**]"
44 PHI 1 71 SER C 1 72 VAL N 1 72 VAL CA 1 72 VAL C -138.00 -30.00 -99.98 -114.25 -77.53 . . 0 "[ . 1 . 2]"
45 PHI 1 75 TYR C 1 76 ASP N 1 76 ASP CA 1 76 ASP C -124.00 -64.00 -54.33 -57.48 -51.97 12.03 5 20 [****+*********-*****]
46 PHI 1 76 ASP C 1 77 ARG N 1 77 ARG CA 1 77 ARG C -66.00 -46.00 -66.75 -67.15 -65.78 1.15 8 0 "[ . 1 . 2]"
47 PHI 1 77 ARG C 1 78 GLU N 1 78 GLU CA 1 78 GLU C -66.00 -50.00 -59.53 -62.95 -57.61 . . 0 "[ . 1 . 2]"
48 PHI 1 78 GLU C 1 79 GLN N 1 79 GLN CA 1 79 GLN C -79.00 -51.00 -53.04 -52.81 -53.14 . . 0 "[ . 1 . 2]"
49 PHI 1 79 GLN C 1 80 VAL N 1 80 VAL CA 1 80 VAL C -84.00 -52.00 -67.85 -68.71 -67.14 . . 0 "[ . 1 . 2]"
50 PHI 1 80 VAL C 1 81 MET N 1 81 MET CA 1 81 MET C -66.00 -54.00 -55.75 -55.75 -55.83 . . 0 "[ . 1 . 2]"
51 PHI 1 81 MET C 1 82 LYS N 1 82 LYS CA 1 82 LYS C -76.00 -48.00 -65.36 -67.71 -60.98 . . 0 "[ . 1 . 2]"
52 PHI 1 82 LYS C 1 83 ILE N 1 83 ILE CA 1 83 ILE C -80.00 -52.00 -60.30 -61.03 -61.86 . . 0 "[ . 1 . 2]"
53 PHI 1 83 ILE C 1 84 ILE N 1 84 ILE CA 1 84 ILE C -75.00 -55.00 -70.88 -71.27 -69.09 . . 0 "[ . 1 . 2]"
54 PHI 1 84 ILE C 1 85 ASP N 1 85 ASP CA 1 85 ASP C -71.00 -59.00 -62.42 -60.49 -60.77 0.50 3 0 "[ . 1 . 2]"
55 PHI 1 85 ASP C 1 86 GLU N 1 86 GLU CA 1 86 GLU C -76.00 -52.00 -70.40 -81.32 -67.80 5.32 6 1 "[ .+ 1 . 2]"
56 PHI 1 86 GLU C 1 87 PHE N 1 87 PHE CA 1 87 PHE C -112.00 -68.00 59.39 50.70 63.18 131.18 13 20 [*****-******+*******]
57 PHI 1 88 LYS C 1 89 ILE N 1 89 ILE CA 1 89 ILE C -145.00 -45.00 -69.76 -69.78 -69.79 . . 0 "[ . 1 . 2]"
58 PHI 1 91 THR C 1 92 VAL N 1 92 VAL CA 1 92 VAL C -70.00 -46.00 -51.78 -59.87 -46.05 . . 0 "[ . 1 . 2]"
59 PHI 1 92 VAL C 1 93 GLU N 1 93 GLU CA 1 93 GLU C -72.00 -48.00 -58.29 -62.96 -56.12 . . 0 "[ . 1 . 2]"
60 PHI 1 93 GLU C 1 94 GLN N 1 94 GLN CA 1 94 GLN C -77.00 -57.00 -65.06 -65.37 -66.10 . . 0 "[ . 1 . 2]"
61 PHI 1 94 GLN C 1 95 TRP N 1 95 TRP CA 1 95 TRP C -77.00 -57.00 -64.90 -68.62 -58.09 . . 0 "[ . 1 . 2]"
62 PHI 1 95 TRP C 1 96 LYS N 1 96 LYS CA 1 96 LYS C -75.00 -51.00 -63.73 -61.74 -63.16 . . 0 "[ . 1 . 2]"
63 PHI 1 96 LYS C 1 97 ASP N 1 97 ASP CA 1 97 ASP C -77.00 -49.00 -61.18 -59.38 -59.88 . . 0 "[ . 1 . 2]"
64 PHI 1 97 ASP C 1 98 GLN N 1 98 GLN CA 1 98 GLN C -77.00 -45.00 -65.02 -74.85 -57.86 . . 0 "[ . 1 . 2]"
65 PHI 1 98 GLN C 1 99 THR N 1 99 THR CA 1 99 THR C -77.00 -49.00 -60.31 -69.99 -51.97 . . 0 "[ . 1 . 2]"
66 PHI 1 99 THR C 1 100 ARG N 1 100 ARG CA 1 100 ARG C -73.00 -49.00 -68.20 -67.42 -68.97 11.62 7 3 "[ . + *1 - . 2]"
67 PHI 1 100 ARG C 1 101 ARG N 1 101 ARG CA 1 101 ARG C -102.00 -38.00 -69.70 -59.44 -61.40 . . 0 "[ . 1 . 2]"
68 PHI 1 101 ARG C 1 102 TYR N 1 102 TYR CA 1 102 TYR C -128.00 -28.00 -78.73 -97.02 -57.23 . . 0 "[ . 1 . 2]"
69 PHI 1 110 GLY C 1 111 ASN N 1 111 ASN CA 1 111 ASN C -120.00 -24.00 -151.25 154.51 131.98 123.85 6 13 "[*-**.+***1** . * **]"
70 PSI 1 4 LEU N 1 4 LEU CA 1 4 LEU C 1 5 PHE N 100.00 156.00 143.66 119.47 156.28 0.28 10 0 "[ . 1 . 2]"
71 PSI 1 5 PHE N 1 5 PHE CA 1 5 PHE C 1 6 ALA N 140.00 164.00 150.78 150.65 148.17 0.57 18 0 "[ . 1 . 2]"
72 PSI 1 6 ALA N 1 6 ALA CA 1 6 ALA C 1 7 VAL N 130.00 170.00 160.13 144.86 170.11 0.11 18 0 "[ . 1 . 2]"
73 PSI 1 7 VAL N 1 7 VAL CA 1 7 VAL C 1 8 THR N 112.00 -176.00 126.63 119.26 131.27 . . 0 "[ . 1 . 2]"
74 PSI 1 9 LEU N 1 9 LEU CA 1 9 LEU C 1 10 TYR N -72.00 4.00 -15.52 -20.94 -11.22 . . 0 "[ . 1 . 2]"
75 PSI 1 10 TYR N 1 10 TYR CA 1 10 TYR C 1 11 GLU N 112.00 -156.00 161.59 156.23 154.81 . . 0 "[ . 1 . 2]"
76 PSI 1 11 GLU N 1 11 GLU CA 1 11 GLU C 1 12 PHE N 105.00 145.00 106.71 105.08 105.02 0.27 1 0 "[ . 1 . 2]"
77 PSI 1 12 PHE N 1 12 PHE CA 1 12 PHE C 1 13 LYS N 100.00 148.00 115.13 103.81 102.87 . . 0 "[ . 1 . 2]"
78 PSI 1 13 LYS N 1 13 LYS CA 1 13 LYS C 1 14 ALA N 86.00 146.00 110.90 96.88 142.24 . . 0 "[ . 1 . 2]"
79 PSI 1 14 ALA N 1 14 ALA CA 1 14 ALA C 1 15 GLU N 113.00 165.00 154.18 136.10 164.90 . . 0 "[ . 1 . 2]"
80 PSI 1 16 ARG N 1 16 ARG CA 1 16 ARG C 1 17 ASP N 126.00 -174.00 -179.27 167.16 -174.52 . . 0 "[ . 1 . 2]"
81 PSI 1 17 ASP N 1 17 ASP CA 1 17 ASP C 1 18 ASP N -60.00 0.00 -36.91 -46.08 -15.12 . . 0 "[ . 1 . 2]"
82 PSI 1 20 LEU N 1 20 LEU CA 1 20 LEU C 1 21 ASP N 105.00 169.00 135.22 127.20 126.45 . . 0 "[ . 1 . 2]"
83 PSI 1 21 ASP N 1 21 ASP CA 1 21 ASP C 1 22 VAL N 111.00 163.00 137.05 123.26 150.26 . . 0 "[ . 1 . 2]"
84 PSI 1 22 VAL N 1 22 VAL CA 1 22 VAL C 1 23 SER N 135.00 159.00 153.11 143.30 159.29 0.29 11 0 "[ . 1 . 2]"
85 PSI 1 23 SER N 1 23 SER CA 1 23 SER C 1 24 PRO N 86.00 -178.00 159.11 154.51 160.52 . . 0 "[ . 1 . 2]"
86 PSI 1 25 GLY N 1 25 GLY CA 1 25 GLY C 1 26 GLU N -37.00 7.00 1.27 -6.84 7.12 0.12 16 0 "[ . 1 . 2]"
87 PSI 1 26 GLU N 1 26 GLU CA 1 26 GLU C 1 27 ASN N 116.00 172.00 157.22 163.85 162.49 . . 0 "[ . 1 . 2]"
88 PSI 1 27 ASN N 1 27 ASN CA 1 27 ASN C 1 28 LEU N 101.00 153.00 126.86 127.03 123.70 . . 0 "[ . 1 . 2]"
89 PSI 1 28 LEU N 1 28 LEU CA 1 28 LEU C 1 29 SER N 142.00 178.00 150.87 142.01 168.22 . . 0 "[ . 1 . 2]"
90 PSI 1 29 SER N 1 29 SER CA 1 29 SER C 1 30 ILE N 113.00 157.00 115.31 123.26 116.78 0.52 11 0 "[ . 1 . 2]"
91 PSI 1 33 HIS N 1 33 HIS CA 1 33 HIS C 1 34 TYR N 130.00 178.00 177.03 176.18 175.45 0.84 13 0 "[ . 1 . 2]"
92 PSI 1 34 TYR N 1 34 TYR CA 1 34 TYR C 1 35 ASP N 101.00 153.00 101.16 102.17 101.17 1.91 3 0 "[ . 1 . 2]"
93 PSI 1 38 TRP N 1 38 TRP CA 1 38 TRP C 1 39 PHE N 136.00 164.00 146.42 135.46 164.64 0.64 13 0 "[ . 1 . 2]"
94 PSI 1 39 PHE N 1 39 PHE CA 1 39 PHE C 1 40 ILE N 120.00 180.00 139.71 144.91 143.66 . . 0 "[ . 1 . 2]"
95 PSI 1 40 ILE N 1 40 ILE CA 1 40 ILE C 1 41 ALA N 96.00 168.00 95.13 94.03 98.49 1.97 11 0 "[ . 1 . 2]"
96 PSI 1 41 ALA N 1 41 ALA CA 1 41 ALA C 1 42 LYS N 135.00 175.00 147.39 134.87 164.49 0.13 20 0 "[ . 1 . 2]"
97 PSI 1 42 LYS N 1 42 LYS CA 1 42 LYS C 1 43 PRO N 115.00 167.00 156.81 153.63 159.49 . . 0 "[ . 1 . 2]"
98 PSI 1 44 ILE N 1 44 ILE CA 1 44 ILE C 1 45 ASN N -60.00 -8.00 -34.98 -36.70 -38.18 . . 0 "[ . 1 . 2]"
99 PSI 1 52 LEU N 1 52 LEU CA 1 52 LEU C 1 53 VAL N 125.00 161.00 133.13 129.85 138.88 . . 0 "[ . 1 . 2]"
100 PSI 1 53 VAL N 1 53 VAL CA 1 53 VAL C 1 54 PRO N 131.00 175.00 153.67 155.63 153.87 0.99 3 0 "[ . 1 . 2]"
101 PSI 1 55 VAL N 1 55 VAL CA 1 55 VAL C 1 56 SER N -47.00 -23.00 -1.92 -6.26 3.82 26.82 17 20 [**-*************+***]
102 PSI 1 56 SER N 1 56 SER CA 1 56 SER C 1 57 TYR N -42.00 18.00 12.80 -27.13 22.93 4.93 14 0 "[ . 1 . 2]"
103 PSI 1 58 VAL N 1 58 VAL CA 1 58 VAL C 1 59 ARG N 120.00 -168.00 119.85 110.60 131.75 9.40 10 6 "[-* * +* . *2]"
104 PSI 1 59 ARG N 1 59 ARG CA 1 59 ARG C 1 60 ILE N 111.00 139.00 114.11 108.80 128.88 2.20 20 0 "[ . 1 . 2]"
105 PSI 1 60 ILE N 1 60 ILE CA 1 60 ILE C 1 61 ILE N 109.00 157.00 160.68 128.19 -177.78 25.22 14 12 "[*** -****1* +. ** 2]"
106 PSI 1 61 ILE N 1 61 ILE CA 1 61 ILE C 1 62 ASP N 101.00 -163.00 129.76 119.72 147.17 . . 0 "[ . 1 . 2]"
107 PSI 1 63 LEU N 1 63 LEU CA 1 63 LEU C 1 64 MET N -56.00 4.00 -25.43 -29.38 -29.92 . . 0 "[ . 1 . 2]"
108 PSI 1 64 MET N 1 64 MET CA 1 64 MET C 1 65 ASP N -39.00 5.00 76.77 73.60 82.93 77.93 15 20 [********-*****+*****]
109 PSI 1 67 ALA N 1 67 ALA CA 1 67 ALA C 1 68 LYS N -63.00 33.00 -50.82 -52.55 -41.49 . . 0 "[ . 1 . 2]"
110 PSI 1 68 LYS N 1 68 LYS CA 1 68 LYS C 1 69 TYR N -52.00 -12.00 22.00 -0.08 23.88 35.88 10 20 [*********+-*********]
111 PSI 1 69 TYR N 1 69 TYR CA 1 69 TYR C 1 70 ALA N -17.00 23.00 -16.21 -19.96 -20.82 6.81 7 2 "[ . + 1 .- 2]"
112 PSI 1 71 SER N 1 71 SER CA 1 71 SER C 1 72 VAL N -24.00 24.00 145.28 121.76 157.84 133.84 5 20 [****+*****-*********]
113 PSI 1 72 VAL N 1 72 VAL CA 1 72 VAL C 1 73 ASP N 103.00 159.00 89.31 11.68 110.24 91.32 11 14 "[***** * *-+** .* **2]"
114 PSI 1 76 ASP N 1 76 ASP CA 1 76 ASP C 1 77 ARG N 57.00 173.00 -26.40 -27.08 -27.61 86.30 5 20 [****+*********-*****]
115 PSI 1 77 ARG N 1 77 ARG CA 1 77 ARG C 1 78 GLU N -67.00 -7.00 -54.76 -54.01 -54.36 . . 0 "[ . 1 . 2]"
116 PSI 1 78 GLU N 1 78 GLU CA 1 78 GLU C 1 79 GLN N -58.00 -26.00 -56.72 -58.45 -54.90 0.45 12 0 "[ . 1 . 2]"
117 PSI 1 79 GLN N 1 79 GLN CA 1 79 GLN C 1 80 VAL N -59.00 -31.00 -32.06 -32.27 -32.34 0.17 18 0 "[ . 1 . 2]"
118 PSI 1 80 VAL N 1 80 VAL CA 1 80 VAL C 1 81 MET N -59.00 -31.00 -54.09 -53.50 -53.83 . . 0 "[ . 1 . 2]"
119 PSI 1 81 MET N 1 81 MET CA 1 81 MET C 1 82 LYS N -57.00 -33.00 -39.51 -47.07 -35.79 . . 0 "[ . 1 . 2]"
120 PSI 1 82 LYS N 1 82 LYS CA 1 82 LYS C 1 83 ILE N -61.00 -21.00 -54.13 -58.22 -50.47 . . 0 "[ . 1 . 2]"
121 PSI 1 83 ILE N 1 83 ILE CA 1 83 ILE C 1 84 ILE N -58.00 -34.00 -35.64 -37.53 -29.65 4.35 6 0 "[ . 1 . 2]"
122 PSI 1 84 ILE N 1 84 ILE CA 1 84 ILE C 1 85 ASP N -50.00 -30.00 -49.78 -52.70 -44.77 2.70 6 0 "[ . 1 . 2]"
123 PSI 1 85 ASP N 1 85 ASP CA 1 85 ASP C 1 86 GLU N -52.00 -28.00 -48.49 -51.35 -52.36 1.89 1 0 "[ . 1 . 2]"
124 PSI 1 86 GLU N 1 86 GLU CA 1 86 GLU C 1 87 PHE N -55.00 -11.00 -13.91 -11.50 -11.96 4.52 6 0 "[ . 1 . 2]"
125 PSI 1 87 PHE N 1 87 PHE CA 1 87 PHE C 1 88 LYS N -28.00 24.00 52.26 42.81 62.07 38.07 17 20 [*****-**********+***]
126 PSI 1 89 ILE N 1 89 ILE CA 1 89 ILE C 1 90 PRO N 78.00 174.00 161.10 151.33 169.93 . . 0 "[ . 1 . 2]"
127 PSI 1 92 VAL N 1 92 VAL CA 1 92 VAL C 1 93 GLU N -58.00 -22.00 -49.90 -53.16 -44.27 . . 0 "[ . 1 . 2]"
128 PSI 1 93 GLU N 1 93 GLU CA 1 93 GLU C 1 94 GLN N -52.00 -24.00 -40.62 -46.47 -27.84 . . 0 "[ . 1 . 2]"
129 PSI 1 94 GLN N 1 94 GLN CA 1 94 GLN C 1 95 TRP N -55.00 -27.00 -40.25 -41.55 -42.61 . . 0 "[ . 1 . 2]"
130 PSI 1 95 TRP N 1 95 TRP CA 1 95 TRP C 1 96 LYS N -62.00 -26.00 -46.74 -53.37 -35.03 . . 0 "[ . 1 . 2]"
131 PSI 1 96 LYS N 1 96 LYS CA 1 96 LYS C 1 97 ASP N -55.00 -27.00 -43.58 -51.68 -36.07 . . 0 "[ . 1 . 2]"
132 PSI 1 97 ASP N 1 97 ASP CA 1 97 ASP C 1 98 GLN N -61.00 -25.00 -47.92 -48.84 -49.24 . . 0 "[ . 1 . 2]"
133 PSI 1 98 GLN N 1 98 GLN CA 1 98 GLN C 1 99 THR N -64.00 -12.00 -41.99 -39.05 -40.92 . . 0 "[ . 1 . 2]"
134 PSI 1 99 THR N 1 99 THR CA 1 99 THR C 1 100 ARG N -57.00 -25.00 -50.74 -63.95 -34.46 6.95 11 1 "[ . 1+ . 2]"
135 PSI 1 100 ARG N 1 100 ARG CA 1 100 ARG C 1 101 ARG N -65.00 -17.00 -32.72 -45.22 -19.48 . . 0 "[ . 1 . 2]"
136 PSI 1 101 ARG N 1 101 ARG CA 1 101 ARG C 1 102 TYR N -64.00 -4.00 -36.29 -52.87 -22.54 . . 0 "[ . 1 . 2]"
137 PSI 1 102 TYR N 1 102 TYR CA 1 102 TYR C 1 103 LYS N -66.00 2.00 -23.21 -25.57 -25.65 . . 0 "[ . 1 . 2]"
138 PSI 1 111 ASN N 1 111 ASN CA 1 111 ASN C 1 112 GLY N 114.00 150.00 143.88 -156.09 178.94 144.74 19 15 "[ * **** 1*******-+*]"
139 PSI 2 11 LYS N 2 11 LYS CA 2 11 LYS C 2 12 PRO N 110.00 180.00 158.85 137.49 161.18 . . 0 "[ . 1 . 2]"
140 PSI 2 12 PRO N 2 12 PRO CA 2 12 PRO C 2 13 PRO N 110.00 180.00 166.84 163.84 168.25 . . 0 "[ . 1 . 2]"
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