NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
480287 |
1j6t   |
cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1j6t
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 67
_TA_constraint_stats_list.Viol_count 14
_TA_constraint_stats_list.Viol_total 48.95
_TA_constraint_stats_list.Viol_max 2.27
_TA_constraint_stats_list.Viol_rms 0.32
_TA_constraint_stats_list.Viol_average_all_restraints 0.08
_TA_constraint_stats_list.Viol_average_violations_only 1.17
_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 . 2 51 GLN N 2 51 GLN CA 2 51 GLN CB 2 51 GLN CG 160.00 -160.00 -176.28 -176.20 -176.47 . . 0 "[ ]"
2 . 2 51 GLN CA 2 51 GLN CB 2 51 GLN CG 2 51 GLN CD 40.00 80.00 57.52 57.36 57.77 . . 0 "[ ]"
3 . 2 12 ASN N 2 12 ASN CA 2 12 ASN CB 2 12 ASN CG 160.00 -160.00 -166.72 -166.59 -166.97 . . 0 "[ ]"
4 . 2 15 HIS N 2 15 HIS CA 2 15 HIS CB 2 15 HIS CG 25.00 95.00 79.24 79.62 60.81 2.27 3 0 "[ ]"
5 . 2 15 HIS CA 2 15 HIS CB 2 15 HIS CG 2 15 HIS ND1 55.00 125.00 104.08 103.67 104.70 . . 0 "[ ]"
6 . 2 16 THR N 2 16 THR CA 2 16 THR CB 2 16 THR OG1 40.00 80.00 63.26 69.69 62.88 . . 0 "[ ]"
7 . 2 17 ARG N 2 17 ARG CA 2 17 ARG CB 2 17 ARG CG 145.00 -145.00 176.68 176.14 177.48 . . 0 "[ ]"
8 . 2 17 ARG CA 2 17 ARG CB 2 17 ARG CG 2 17 ARG CD 40.00 -160.00 172.09 171.74 172.57 . . 0 "[ ]"
9 . 2 17 ARG CB 2 17 ARG CG 2 17 ARG CD 2 17 ARG NE 140.00 -140.00 -158.25 -158.08 -158.31 . . 0 "[ ]"
10 . 2 21 GLN N 2 21 GLN CA 2 21 GLN CB 2 21 GLN CG 160.00 -160.00 -177.75 -177.75 -177.75 . . 0 "[ ]"
11 . 2 24 LYS N 2 24 LYS CA 2 24 LYS CB 2 24 LYS CG 160.00 -160.00 -159.09 -159.02 -159.27 1.01 2 0 "[ ]"
12 . 2 27 LYS N 2 27 LYS CA 2 27 LYS CB 2 27 LYS CG -80.00 -40.00 -69.56 -69.87 -69.06 . . 0 "[ ]"
13 . 2 46 SER N 2 46 SER CA 2 46 SER CB 2 46 SER OG 160.00 -160.00 -168.04 -168.37 -167.51 . . 0 "[ ]"
14 . 2 47 LEU N 2 47 LEU CA 2 47 LEU CB 2 47 LEU CG 160.00 -160.00 177.84 177.91 177.64 . . 0 "[ ]"
15 . 2 47 LEU CA 2 47 LEU CB 2 47 LEU CG 2 47 LEU CD1 40.00 80.00 55.30 55.09 55.66 . . 0 "[ ]"
16 . 2 48 PHE N 2 48 PHE CA 2 48 PHE CB 2 48 PHE CG 160.00 -160.00 -176.56 -176.57 -176.55 . . 0 "[ ]"
17 . 2 48 PHE CA 2 48 PHE CB 2 48 PHE CG 2 48 PHE CD1 60.00 120.00 70.70 70.38 71.30 . . 0 "[ ]"
18 . 2 49 LYS N 2 49 LYS CA 2 49 LYS CB 2 49 LYS CG 160.00 -160.00 -164.30 -164.20 -164.62 . . 0 "[ ]"
19 . 2 50 LEU N 2 50 LEU CA 2 50 LEU CB 2 50 LEU CG -90.00 -30.00 -72.35 -72.17 -72.85 . . 0 "[ ]"
20 . 2 50 LEU CA 2 50 LEU CB 2 50 LEU CG 2 50 LEU CD1 150.00 -150.00 159.54 159.62 159.52 . . 0 "[ ]"
21 . 2 52 THR N 2 52 THR CA 2 52 THR CB 2 52 THR OG1 40.00 80.00 66.91 66.40 67.66 . . 0 "[ ]"
22 . 2 53 LEU N 2 53 LEU CA 2 53 LEU CB 2 53 LEU CG -80.00 -40.00 -60.17 -60.56 -59.51 . . 0 "[ ]"
23 . 2 53 LEU CA 2 53 LEU CB 2 53 LEU CG 2 53 LEU CD1 160.00 -160.00 171.89 172.09 171.29 . . 0 "[ ]"
24 . 2 55 LEU N 2 55 LEU CA 2 55 LEU CB 2 55 LEU CG -80.00 -40.00 -57.25 -57.49 -56.81 . . 0 "[ ]"
25 . 2 55 LEU CA 2 55 LEU CB 2 55 LEU CG 2 55 LEU CD1 160.00 -160.00 158.49 158.35 158.66 1.65 2 0 "[ ]"
26 . 2 56 THR N 2 56 THR CA 2 56 THR CB 2 56 THR OG1 40.00 80.00 65.79 65.56 66.17 . . 0 "[ ]"
27 . 2 57 GLN N 2 57 GLN CA 2 57 GLN CB 2 57 GLN CG 160.00 -160.00 -170.01 -169.93 -170.27 . . 0 "[ ]"
28 . 1 49 ARG N 1 49 ARG CA 1 49 ARG CB 1 49 ARG CG 155.00 -155.00 -173.18 -171.25 -177.85 . . 0 "[ ]"
29 . 1 49 ARG CA 1 49 ARG CB 1 49 ARG CG 1 49 ARG CD 25.00 95.00 62.25 58.62 68.99 . . 0 "[ ]"
30 . 1 49 ARG CB 1 49 ARG CG 1 49 ARG CD 1 49 ARG NE 140.00 -140.00 160.51 152.60 165.56 . . 0 "[ ]"
31 . 1 52 LEU N 1 52 LEU CA 1 52 LEU CB 1 52 LEU CG 160.00 -160.00 177.36 177.38 177.30 . . 0 "[ ]"
32 . 1 52 LEU CA 1 52 LEU CB 1 52 LEU CG 1 52 LEU CD1 40.00 80.00 73.51 72.95 74.41 . . 0 "[ ]"
33 . 1 53 THR N 1 53 THR CA 1 53 THR CB 1 53 THR OG1 -80.00 -40.00 -39.07 -39.06 -39.23 1.07 2 0 "[ ]"
34 . 1 55 THR N 1 55 THR CA 1 55 THR CB 1 55 THR OG1 40.00 80.00 65.55 65.07 66.23 . . 0 "[ ]"
35 . 1 56 TYR N 1 56 TYR CA 1 56 TYR CB 1 56 TYR CG 160.00 -160.00 -170.96 -170.94 -171.02 . . 0 "[ ]"
36 . 1 56 TYR CA 1 56 TYR CB 1 56 TYR CG 1 56 TYR CD1 60.00 120.00 58.79 58.60 59.08 1.40 2 0 "[ ]"
37 . 1 57 LEU N 1 57 LEU CA 1 57 LEU CB 1 57 LEU CG -80.00 -40.00 -69.16 -69.22 -69.04 . . 0 "[ ]"
38 . 1 57 LEU CA 1 57 LEU CB 1 57 LEU CG 1 57 LEU CD1 160.00 -160.00 -167.05 -167.19 -166.79 . . 0 "[ ]"
39 . 1 59 GLU N 1 59 GLU CA 1 59 GLU CB 1 59 GLU CG -80.00 -40.00 -57.52 -58.05 -56.69 . . 0 "[ ]"
40 . 1 59 GLU CA 1 59 GLU CB 1 59 GLU CG 1 59 GLU CD -80.00 80.00 -64.09 -64.20 -64.01 . . 0 "[ ]"
41 . 1 59 GLU CB 1 59 GLU CG 1 59 GLU CD 1 59 GLU OE1 -90.00 90.00 -19.45 -19.12 -19.62 . . 0 "[ ]"
42 . 1 61 ILE N 1 61 ILE CA 1 61 ILE CB 1 61 ILE CG1 -80.00 -40.00 -62.69 -62.69 -62.69 . . 0 "[ ]"
43 . 1 61 ILE CA 1 61 ILE CB 1 61 ILE CG1 1 61 ILE CD1 160.00 -160.00 167.50 167.50 167.50 . . 0 "[ ]"
44 . 1 65 HIS N 1 65 HIS CA 1 65 HIS CB 1 65 HIS CG 25.00 95.00 58.61 57.27 56.15 . . 0 "[ ]"
45 . 1 65 HIS CA 1 65 HIS CB 1 65 HIS CG 1 65 HIS ND1 -140.00 -40.00 -50.23 -40.15 -71.27 0.37 3 0 "[ ]"
46 . 1 68 VAL N 1 68 VAL CA 1 68 VAL CB 1 68 VAL CG1 -80.00 -40.00 -49.18 -49.42 -48.70 . . 0 "[ ]"
47 . 1 92 GLU N 1 92 GLU CA 1 92 GLU CB 1 92 GLU CG -80.00 -40.00 -63.46 -64.47 -61.73 . . 0 "[ ]"
48 . 1 92 GLU CA 1 92 GLU CB 1 92 GLU CG 1 92 GLU CD 160.00 -160.00 176.66 176.50 176.86 . . 0 "[ ]"
49 . 1 92 GLU CB 1 92 GLU CG 1 92 GLU CD 1 92 GLU OE1 -90.00 90.00 4.64 4.20 5.43 . . 0 "[ ]"
50 . 1 93 GLU N 1 93 GLU CA 1 93 GLU CB 1 93 GLU CG -80.00 -40.00 -66.35 -66.88 -65.42 . . 0 "[ ]"
51 . 1 93 GLU CB 1 93 GLU CG 1 93 GLU CD 1 93 GLU OE1 -90.00 90.00 1.72 1.91 1.21 . . 0 "[ ]"
52 . 1 109 ASN N 1 109 ASN CA 1 109 ASN CB 1 109 ASN CG 160.00 -160.00 -170.26 -170.23 -170.38 . . 0 "[ ]"
53 . 1 112 ILE N 1 112 ILE CA 1 112 ILE CB 1 112 ILE CG1 160.00 -160.00 -170.62 -170.76 -170.41 . . 0 "[ ]"
54 . 1 112 ILE CA 1 112 ILE CB 1 112 ILE CG1 1 112 ILE CD1 160.00 -160.00 166.95 166.95 166.92 . . 0 "[ ]"
55 . 1 113 GLN N 1 113 GLN CA 1 113 GLN CB 1 113 GLN CG -80.00 -40.00 -63.89 -63.89 -63.91 . . 0 "[ ]"
56 . 1 113 GLN CA 1 113 GLN CB 1 113 GLN CG 1 113 GLN CD -80.00 -40.00 -65.09 -65.08 -65.14 . . 0 "[ ]"
57 . 1 115 ILE N 1 115 ILE CA 1 115 ILE CB 1 115 ILE CG1 -80.00 -40.00 -66.37 -66.41 -66.34 . . 0 "[ ]"
58 . 1 115 ILE CA 1 115 ILE CB 1 115 ILE CG1 1 115 ILE CD1 160.00 -160.00 169.27 169.46 168.51 . . 0 "[ ]"
59 . 1 116 THR N 1 116 THR CA 1 116 THR CB 1 116 THR OG1 -80.00 -40.00 -61.77 -61.86 -61.67 . . 0 "[ ]"
60 . 1 119 THR N 1 119 THR CA 1 119 THR CB 1 119 THR OG1 40.00 80.00 53.63 53.55 53.77 . . 0 "[ ]"
61 . 1 120 ASN N 1 120 ASN CA 1 120 ASN CB 1 120 ASN CG -80.20 -39.80 -71.06 -71.08 -71.04 . . 0 "[ ]"
62 . 1 122 LEU N 1 122 LEU CA 1 122 LEU CB 1 122 LEU CG -80.00 -40.00 -57.60 -57.60 -57.60 . . 0 "[ ]"
63 . 1 122 LEU CA 1 122 LEU CB 1 122 LEU CG 1 122 LEU CD1 160.00 -160.00 175.70 175.70 175.70 . . 0 "[ ]"
64 . 1 123 ASP N 1 123 ASP CA 1 123 ASP CB 1 123 ASP CG 160.00 -160.00 -168.38 -168.35 -168.45 . . 0 "[ ]"
65 . 1 123 ASP CA 1 123 ASP CB 1 123 ASP CG 1 123 ASP OD1 -90.00 90.00 13.26 13.24 13.22 . . 0 "[ ]"
66 . 1 128 ILE N 1 128 ILE CA 1 128 ILE CB 1 128 ILE CG1 -80.00 -40.00 -67.25 -67.13 -67.57 . . 0 "[ ]"
67 . 1 128 ILE CA 1 128 ILE CB 1 128 ILE CG1 1 128 ILE CD1 160.00 -160.00 170.75 171.12 169.91 . . 0 "[ ]"
stop_
save_
save_distance_constraint_statistics_2
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 62
_TA_constraint_stats_list.Viol_count 34
_TA_constraint_stats_list.Viol_total 295.23
_TA_constraint_stats_list.Viol_max 11.10
_TA_constraint_stats_list.Viol_rms 1.41
_TA_constraint_stats_list.Viol_average_all_restraints 0.53
_TA_constraint_stats_list.Viol_average_violations_only 2.89
_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 50 GLU C 1 51 LYS N 1 51 LYS CA 1 51 LYS C -87.00 -53.00 -62.81 -62.87 -62.75 . . 0 "[ ]"
2 . 1 51 LYS N 1 51 LYS CA 1 51 LYS C 1 52 LEU N -37.00 -3.00 -38.25 -38.22 -38.38 1.38 1 0 "[ ]"
3 . 1 51 LYS C 1 52 LEU N 1 52 LEU CA 1 52 LEU C -109.00 -61.00 -64.67 -64.76 -64.54 . . 0 "[ ]"
4 . 1 52 LEU N 1 52 LEU CA 1 52 LEU C 1 53 THR N -65.00 -25.00 -43.56 -43.56 -43.56 . . 0 "[ ]"
5 . 1 52 LEU C 1 53 THR N 1 53 THR CA 1 53 THR C -175.00 -145.00 -166.11 -166.11 -166.11 . . 0 "[ ]"
6 . 1 53 THR N 1 53 THR CA 1 53 THR C 1 54 PRO N 95.00 145.00 139.11 139.11 139.11 . . 0 "[ ]"
7 . 1 53 THR C 1 54 PRO N 1 54 PRO CA 1 54 PRO C -65.00 -45.00 -50.34 -50.34 -50.34 . . 0 "[ ]"
8 . 1 54 PRO N 1 54 PRO CA 1 54 PRO C 1 55 THR N 140.00 160.00 144.91 144.91 144.91 . . 0 "[ ]"
9 . 1 63 VAL C 1 64 PRO N 1 64 PRO CA 1 64 PRO C -68.00 -52.00 -54.30 -54.57 -58.08 1.76 3 0 "[ ]"
10 . 1 64 PRO N 1 64 PRO CA 1 64 PRO C 1 65 HIS N 130.00 146.00 146.71 144.29 148.94 2.94 1 0 "[ ]"
11 . 1 64 PRO C 1 65 HIS N 1 65 HIS CA 1 65 HIS C -156.00 -140.00 -149.72 -150.37 -157.19 1.19 1 0 "[ ]"
12 . 1 65 HIS N 1 65 HIS CA 1 65 HIS C 1 66 GLY N 165.00 -179.00 158.61 153.90 162.91 11.10 3 2 "[ -+]"
13 . 1 65 HIS C 1 66 GLY N 1 66 GLY CA 1 66 GLY C -97.00 -73.00 -77.09 -76.65 -79.10 . . 0 "[ ]"
14 . 1 66 GLY N 1 66 GLY CA 1 66 GLY C 1 67 THR N 155.00 -155.00 174.98 173.96 176.17 . . 0 "[ ]"
15 . 1 66 GLY C 1 67 THR N 1 67 THR CA 1 67 THR C -118.00 -62.00 -80.57 -80.46 -81.07 . . 0 "[ ]"
16 . 1 67 THR N 1 67 THR CA 1 67 THR C 1 68 VAL N 155.00 175.00 167.93 167.93 167.93 . . 0 "[ ]"
17 . 1 76 LYS C 1 77 THR N 1 77 THR CA 1 77 THR C -75.00 -55.00 -76.29 -76.29 -76.29 1.29 1 0 "[ ]"
18 . 1 77 THR N 1 77 THR CA 1 77 THR C 1 78 GLY N 125.00 145.00 138.14 138.14 138.14 . . 0 "[ ]"
19 . 1 77 THR C 1 78 GLY N 1 78 GLY CA 1 78 GLY C 172.50 -157.50 -160.69 -160.69 -160.69 . . 0 "[ ]"
20 . 1 78 GLY N 1 78 GLY CA 1 78 GLY C 1 79 VAL N 157.00 -173.00 161.05 161.05 161.05 . . 0 "[ ]"
21 . 1 89 ARG C 1 90 PHE N 1 90 PHE CA 1 90 PHE C -129.00 -109.00 -119.77 -119.77 -119.77 . . 0 "[ ]"
22 . 1 90 PHE N 1 90 PHE CA 1 90 PHE C 1 91 GLY N -35.00 -15.00 -11.51 -11.51 -11.51 3.49 1 0 "[ ]"
23 . 1 90 PHE C 1 91 GLY N 1 91 GLY CA 1 91 GLY C -115.00 -75.00 -118.54 -118.54 -118.54 3.54 1 0 "[ ]"
24 . 1 91 GLY N 1 91 GLY CA 1 91 GLY C 1 92 GLU N -180.00 -150.00 -158.21 -158.21 -158.21 . . 0 "[ ]"
25 . 1 91 GLY C 1 92 GLU N 1 92 GLU CA 1 92 GLU C -87.00 -57.00 -92.54 -92.54 -92.54 5.54 1 3 [+**]
26 . 1 92 GLU N 1 92 GLU CA 1 92 GLU C 1 93 GLU N -56.00 -16.00 -22.80 -22.80 -22.80 . . 0 "[ ]"
27 . 1 92 GLU C 1 93 GLU N 1 93 GLU CA 1 93 GLU C -112.00 -88.00 -96.40 -96.40 -96.40 . . 0 "[ ]"
28 . 1 93 GLU N 1 93 GLU CA 1 93 GLU C 1 94 GLU N 141.00 171.00 154.45 154.45 154.45 . . 0 "[ ]"
29 . 1 93 GLU C 1 94 GLU N 1 94 GLU CA 1 94 GLU C -70.00 -50.00 -60.29 -60.29 -60.29 . . 0 "[ ]"
30 . 1 94 GLU N 1 94 GLU CA 1 94 GLU C 1 95 ASP N -48.00 -18.00 -23.89 -23.89 -23.89 . . 0 "[ ]"
31 . 1 94 GLU C 1 95 ASP N 1 95 ASP CA 1 95 ASP C -90.00 -70.00 -86.52 -86.52 -86.52 . . 0 "[ ]"
32 . 1 95 ASP N 1 95 ASP CA 1 95 ASP C 1 96 ASP N -23.00 9.00 1.87 1.87 1.87 . . 0 "[ ]"
33 . 1 95 ASP C 1 96 ASP N 1 96 ASP CA 1 96 ASP C -92.00 -72.00 -83.20 -83.20 -83.20 . . 0 "[ ]"
34 . 1 96 ASP N 1 96 ASP CA 1 96 ASP C 1 97 ILE N 60.00 84.00 60.17 60.17 60.17 . . 0 "[ ]"
35 . 1 103 GLY C 1 104 ILE N 1 104 ILE CA 1 104 ILE C -131.00 -111.00 -133.45 -133.45 -133.45 2.45 1 0 "[ ]"
36 . 1 104 ILE N 1 104 ILE CA 1 104 ILE C 1 105 ALA N 125.00 155.00 153.50 153.50 153.50 . . 0 "[ ]"
37 . 1 104 ILE C 1 105 ALA N 1 105 ALA CA 1 105 ALA C -141.00 -99.00 -137.38 -137.38 -137.38 . . 0 "[ ]"
38 . 1 105 ALA N 1 105 ALA CA 1 105 ALA C 1 106 ALA N 99.00 131.00 133.71 133.71 133.71 2.71 1 0 "[ ]"
39 . 1 105 ALA C 1 106 ALA N 1 106 ALA CA 1 106 ALA C -150.00 -100.00 -147.59 -147.59 -147.59 . . 0 "[ ]"
40 . 1 106 ALA N 1 106 ALA CA 1 106 ALA C 1 107 ARG N 119.00 151.00 140.97 140.97 140.97 . . 0 "[ ]"
41 . 1 106 ALA C 1 107 ARG N 1 107 ARG CA 1 107 ARG C -95.00 -55.00 -70.74 -70.74 -70.74 . . 0 "[ ]"
42 . 1 107 ARG N 1 107 ARG CA 1 107 ARG C 1 108 ASN N 145.00 155.00 156.29 156.29 156.29 1.29 1 0 "[ ]"
43 . 1 107 ARG C 1 108 ASN N 1 108 ASN CA 1 108 ASN C 50.00 70.00 57.81 57.81 57.81 . . 0 "[ ]"
44 . 1 109 ASN N 1 109 ASN CA 1 109 ASN C 1 110 GLU N 25.00 35.00 37.58 37.58 37.58 2.58 1 0 "[ ]"
45 . 1 109 ASN C 1 110 GLU N 1 110 GLU CA 1 110 GLU C -91.00 -65.00 -84.05 -84.05 -84.05 . . 0 "[ ]"
46 . 1 110 GLU N 1 110 GLU CA 1 110 GLU C 1 111 HIS N -16.00 36.00 28.89 28.89 28.89 . . 0 "[ ]"
47 . 1 77 THR N 1 77 THR CA 1 77 THR CB 1 77 THR OG1 -80.00 -40.00 -49.00 -49.00 -49.00 . . 0 "[ ]"
48 . 1 90 PHE N 1 90 PHE CA 1 90 PHE CB 1 90 PHE CG -140.00 -80.00 -106.25 -106.25 -106.25 . . 0 "[ ]"
49 . 1 90 PHE CA 1 90 PHE CB 1 90 PHE CG 1 90 PHE CD1 -120.00 -60.00 -89.97 -89.97 -89.97 . . 0 "[ ]"
50 . 1 94 GLU N 1 94 GLU CA 1 94 GLU CB 1 94 GLU CG 160.00 -40.00 -87.96 -87.96 -87.96 . . 0 "[ ]"
51 . 1 94 GLU CB 1 94 GLU CG 1 94 GLU CD 1 94 GLU OE1 -90.00 90.00 -2.37 -2.37 -2.37 . . 0 "[ ]"
52 . 1 95 ASP N 1 95 ASP CA 1 95 ASP CB 1 95 ASP CG 160.00 -40.00 -81.25 -81.25 -81.25 . . 0 "[ ]"
53 . 1 95 ASP CA 1 95 ASP CB 1 95 ASP CG 1 95 ASP OD1 -90.00 90.00 -6.07 -6.07 -6.07 . . 0 "[ ]"
54 . 1 96 ASP N 1 96 ASP CA 1 96 ASP CB 1 96 ASP CG -80.00 -40.00 -72.30 -72.30 -72.30 . . 0 "[ ]"
55 . 1 96 ASP CA 1 96 ASP CB 1 96 ASP CG 1 96 ASP OD1 -90.00 90.00 -11.38 -11.38 -11.38 . . 0 "[ ]"
56 . 1 104 ILE N 1 104 ILE CA 1 104 ILE CB 1 104 ILE CG1 40.00 80.00 68.19 68.19 68.19 . . 0 "[ ]"
57 . 1 104 ILE CA 1 104 ILE CB 1 104 ILE CG1 1 104 ILE CD1 150.00 -150.00 -178.31 -178.31 -178.31 . . 0 "[ ]"
58 . 1 107 ARG N 1 107 ARG CA 1 107 ARG CB 1 107 ARG CG 160.00 -40.00 -75.02 -75.02 -75.02 . . 0 "[ ]"
59 . 1 108 ASN N 1 108 ASN CA 1 108 ASN CB 1 108 ASN CG 160.00 -40.00 -99.05 -99.05 -99.05 . . 0 "[ ]"
60 . 1 110 GLU N 1 110 GLU CA 1 110 GLU CB 1 110 GLU CG -80.00 -40.00 -69.24 -69.24 -69.24 . . 0 "[ ]"
61 . 1 110 GLU CA 1 110 GLU CB 1 110 GLU CG 1 110 GLU CD 160.00 -160.00 173.74 173.74 173.74 . . 0 "[ ]"
62 . 1 110 GLU CB 1 110 GLU CG 1 110 GLU CD 1 110 GLU OE1 -90.00 90.00 0.55 0.55 0.55 . . 0 "[ ]"
stop_
save_
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