NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
481383 | 1bvm | cing | recoord | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1bvm save_dihedral_constraint_statistics_1 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 113 _TA_constraint_stats_list.Viol_count 140 _TA_constraint_stats_list.Viol_total 2212.09 _TA_constraint_stats_list.Viol_max 3.06 _TA_constraint_stats_list.Viol_rms 0.24 _TA_constraint_stats_list.Viol_average_all_restraints 0.05 _TA_constraint_stats_list.Viol_average_violations_only 0.79 _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 4 GLN N 1 4 GLN CA 1 4 GLN CB 1 4 GLN CG -90.00 -30.00 -71.02 -89.88 -49.25 . . 0 "[ . 1 . 2]" 2 . 1 8 MET N 1 8 MET CA 1 8 MET CB 1 8 MET CG -90.00 -30.00 -72.78 -88.63 -57.13 . . 0 "[ . 1 . 2]" 3 . 1 9 ILE N 1 9 ILE CA 1 9 ILE CB 1 9 ILE CG1 -90.00 -30.00 -59.49 -70.43 -50.57 . . 0 "[ . 1 . 2]" 4 . 1 10 LYS N 1 10 LYS CA 1 10 LYS CB 1 10 LYS CG -90.00 -30.00 -83.64 -67.55 -73.27 0.20 4 0 "[ . 1 . 2]" 5 . 1 11 CYS N 1 11 CYS CA 1 11 CYS CB 1 11 CYS SG 160.00 -160.00 -171.78 175.02 -156.94 3.06 18 0 "[ . 1 . 2]" 6 . 1 12 LYS N 1 12 LYS CA 1 12 LYS CB 1 12 LYS CG -90.00 -30.00 -70.29 -54.27 -64.86 . . 0 "[ . 1 . 2]" 7 . 1 13 ILE N 1 13 ILE CA 1 13 ILE CB 1 13 ILE CG1 -90.00 -30.00 -56.33 -74.79 -43.86 . . 0 "[ . 1 . 2]" 8 . 1 15 SER N 1 15 SER CA 1 15 SER CB 1 15 SER OG 30.00 90.00 66.64 75.18 74.23 . . 0 "[ . 1 . 2]" 9 . 1 17 GLU N 1 17 GLU CA 1 17 GLU CB 1 17 GLU CG -90.00 -30.00 -69.71 -68.63 -70.54 . . 0 "[ . 1 . 2]" 10 . 1 28 TYR N 1 28 TYR CA 1 28 TYR CB 1 28 TYR CG -90.00 -30.00 -66.48 -69.95 -71.71 . . 0 "[ . 1 . 2]" 11 . 1 29 CYS N 1 29 CYS CA 1 29 CYS CB 1 29 CYS SG -90.00 -30.00 -57.51 -57.57 -58.30 . . 0 "[ . 1 . 2]" 12 . 1 36 THR N 1 36 THR CA 1 36 THR CB 1 36 THR OG1 -90.00 -30.00 -63.23 -52.44 -63.22 . . 0 "[ . 1 . 2]" 13 . 1 41 LEU N 1 41 LEU CA 1 41 LEU CB 1 41 LEU CG 160.00 -160.00 -167.21 -177.63 -159.51 0.49 18 0 "[ . 1 . 2]" 14 . 1 43 ARG N 1 43 ARG CA 1 43 ARG CB 1 43 ARG CG -90.00 -30.00 -83.51 -89.27 -38.52 . . 0 "[ . 1 . 2]" 15 . 1 44 CYS N 1 44 CYS CA 1 44 CYS CB 1 44 CYS SG -90.00 -30.00 -55.24 -53.93 -55.85 . . 0 "[ . 1 . 2]" 16 . 1 45 CYS N 1 45 CYS CA 1 45 CYS CB 1 45 CYS SG -90.00 -30.00 -64.32 -76.39 -52.28 . . 0 "[ . 1 . 2]" 17 . 1 46 GLN N 1 46 GLN CA 1 46 GLN CB 1 46 GLN CG 160.00 -160.00 177.74 164.79 -169.70 . . 0 "[ . 1 . 2]" 18 . 1 47 THR N 1 47 THR CA 1 47 THR CB 1 47 THR OG1 -90.00 -30.00 -53.93 -69.09 -37.96 . . 0 "[ . 1 . 2]" 19 . 1 48 HIS N 1 48 HIS CA 1 48 HIS CB 1 48 HIS CG 160.00 -160.00 -173.39 176.43 -160.37 . . 0 "[ . 1 . 2]" 20 . 1 49 ASP N 1 49 ASP CA 1 49 ASP CB 1 49 ASP CG -90.00 -30.00 -84.24 -66.94 -79.55 . . 0 "[ . 1 . 2]" 21 . 1 50 ASN N 1 50 ASN CA 1 50 ASN CB 1 50 ASN CG -90.00 -30.00 -86.16 -90.55 -75.25 0.55 2 0 "[ . 1 . 2]" 22 . 1 51 CYS N 1 51 CYS CA 1 51 CYS CB 1 51 CYS SG 160.00 -160.00 -159.90 -162.89 -158.81 1.19 3 0 "[ . 1 . 2]" 23 . 1 52 TYR N 1 52 TYR CA 1 52 TYR CB 1 52 TYR CG -90.00 -30.00 -88.56 -87.96 -88.65 0.56 19 0 "[ . 1 . 2]" 24 . 1 53 LYS N 1 53 LYS CA 1 53 LYS CB 1 53 LYS CG -90.00 -30.00 -36.69 -36.19 -36.61 . . 0 "[ . 1 . 2]" 25 . 1 54 GLN N 1 54 GLN CA 1 54 GLN CB 1 54 GLN CG -90.00 -30.00 -77.15 -80.86 -83.04 . . 0 "[ . 1 . 2]" 26 . 1 56 LYS N 1 56 LYS CA 1 56 LYS CB 1 56 LYS CG -90.00 -30.00 -80.25 -90.29 -64.03 0.29 8 0 "[ . 1 . 2]" 27 . 1 61 CYS N 1 61 CYS CA 1 61 CYS CB 1 61 CYS SG -90.00 -30.00 -66.59 -84.79 -51.18 . . 0 "[ . 1 . 2]" 28 . 1 64 LEU N 1 64 LEU CA 1 64 LEU CB 1 64 LEU CG -90.00 -30.00 -83.01 -89.13 -89.75 0.95 11 0 "[ . 1 . 2]" 29 . 1 71 ASN N 1 71 ASN CA 1 71 ASN CB 1 71 ASN CG 160.00 -160.00 -175.23 -164.31 -168.81 0.31 10 0 "[ . 1 . 2]" 30 . 1 77 CYS N 1 77 CYS CA 1 77 CYS CB 1 77 CYS SG 160.00 -160.00 171.67 172.23 171.68 1.89 6 0 "[ . 1 . 2]" 31 . 1 80 ASN N 1 80 ASN CA 1 80 ASN CB 1 80 ASN CG -90.00 -30.00 -43.41 -43.63 -43.80 . . 0 "[ . 1 . 2]" 32 . 1 81 GLU N 1 81 GLU CA 1 81 GLU CB 1 81 GLU CG -90.00 -30.00 -72.66 -77.11 -43.72 . . 0 "[ . 1 . 2]" 33 . 1 82 ILE N 1 82 ILE CA 1 82 ILE CB 1 82 ILE CG1 -90.00 -30.00 -72.07 -75.09 -78.44 . . 0 "[ . 1 . 2]" 34 . 1 83 THR N 1 83 THR CA 1 83 THR CB 1 83 THR OG1 -90.00 -30.00 -86.41 -90.33 -81.41 0.33 15 0 "[ . 1 . 2]" 35 . 1 86 SER N 1 86 SER CA 1 86 SER CB 1 86 SER OG 30.00 90.00 63.03 38.10 30.99 . . 0 "[ . 1 . 2]" 36 . 1 87 GLU N 1 87 GLU CA 1 87 GLU CB 1 87 GLU CG -90.00 -30.00 -87.11 -87.23 -87.67 0.33 12 0 "[ . 1 . 2]" 37 . 1 88 ASN N 1 88 ASN CA 1 88 ASN CB 1 88 ASN CG -90.00 -30.00 -64.24 -56.59 -59.31 . . 0 "[ . 1 . 2]" 38 . 1 94 PHE N 1 94 PHE CA 1 94 PHE CB 1 94 PHE CG 160.00 -160.00 -166.85 -173.50 -160.26 . . 0 "[ . 1 . 2]" 39 . 1 95 ILE N 1 95 ILE CA 1 95 ILE CB 1 95 ILE CG1 -90.00 -30.00 -63.01 -66.80 -67.42 . . 0 "[ . 1 . 2]" 40 . 1 97 ASN N 1 97 ASN CA 1 97 ASN CB 1 97 ASN CG -90.00 -30.00 -79.74 -85.94 -87.91 . . 0 "[ . 1 . 2]" 41 . 1 98 CYS N 1 98 CYS CA 1 98 CYS CB 1 98 CYS SG -90.00 -30.00 -57.86 -55.24 -57.92 . . 0 "[ . 1 . 2]" 42 . 1 99 ASP N 1 99 ASP CA 1 99 ASP CB 1 99 ASP CG -90.00 -30.00 -72.26 -65.45 -69.91 . . 0 "[ . 1 . 2]" 43 . 1 100 ARG N 1 100 ARG CA 1 100 ARG CB 1 100 ARG CG 160.00 -160.00 -170.04 -161.14 -161.70 . . 0 "[ . 1 . 2]" 44 . 1 101 ASN N 1 101 ASN CA 1 101 ASN CB 1 101 ASN CG -90.00 -30.00 -86.52 -84.16 -87.33 0.82 4 0 "[ . 1 . 2]" 45 . 1 104 ILE N 1 104 ILE CA 1 104 ILE CB 1 104 ILE CG1 -90.00 -30.00 -67.52 -76.77 -56.45 . . 0 "[ . 1 . 2]" 46 . 1 105 CYS N 1 105 CYS CA 1 105 CYS CB 1 105 CYS SG 160.00 -160.00 -159.01 -158.52 -158.82 2.24 6 0 "[ . 1 . 2]" 47 . 1 106 PHE N 1 106 PHE CA 1 106 PHE CB 1 106 PHE CG -90.00 -30.00 -59.00 -58.04 -58.35 . . 0 "[ . 1 . 2]" 48 . 1 108 LYS N 1 108 LYS CA 1 108 LYS CB 1 108 LYS CG -90.00 -30.00 -79.54 -90.45 -59.80 0.45 16 0 "[ . 1 . 2]" 49 . 1 109 VAL N 1 109 VAL CA 1 109 VAL CB 1 109 VAL CG1 -90.00 -30.00 -53.96 -70.64 -45.98 . . 0 "[ . 1 . 2]" 50 . 1 111 TYR N 1 111 TYR CA 1 111 TYR CB 1 111 TYR CG 160.00 -160.00 166.69 168.23 166.06 . . 0 "[ . 1 . 2]" 51 . 1 112 ASN N 1 112 ASN CA 1 112 ASN CB 1 112 ASN CG -90.00 -30.00 -76.66 -89.49 -55.08 . . 0 "[ . 1 . 2]" 52 . 1 115 HIS N 1 115 HIS CA 1 115 HIS CB 1 115 HIS CG -90.00 -30.00 -80.87 -67.34 -73.37 0.30 7 0 "[ . 1 . 2]" 53 . 1 117 ASN N 1 117 ASN CA 1 117 ASN CB 1 117 ASN CG -90.00 -30.00 -67.56 -82.33 -85.59 . . 0 "[ . 1 . 2]" 54 . 1 119 ASP N 1 119 ASP CA 1 119 ASP CB 1 119 ASP CG 160.00 -160.00 -165.65 -176.84 -159.63 0.37 14 0 "[ . 1 . 2]" 55 . 1 120 LYS N 1 120 LYS CA 1 120 LYS CB 1 120 LYS CG -90.00 -30.00 -75.19 -90.14 -56.03 0.14 20 0 "[ . 1 . 2]" 56 . 1 122 ASN N 1 122 ASN CA 1 122 ASN CB 1 122 ASN CG -90.00 -30.00 -91.32 -92.08 -90.65 2.08 8 0 "[ . 1 . 2]" 57 . 1 123 CYS N 1 123 CYS CA 1 123 CYS CB 1 123 CYS SG -90.00 -30.00 -91.18 -91.57 -91.64 1.91 8 0 "[ . 1 . 2]" 58 . 1 5 PHE C 1 6 ASN N 1 6 ASN CA 1 6 ASN C -90.00 -30.00 -54.05 -68.13 -43.92 . . 0 "[ . 1 . 2]" 59 . 1 7 GLY C 1 8 MET N 1 8 MET CA 1 8 MET C -90.00 -30.00 -60.62 -71.21 -51.79 . . 0 "[ . 1 . 2]" 60 . 1 8 MET C 1 9 ILE N 1 9 ILE CA 1 9 ILE C -90.00 -30.00 -63.38 -69.15 -72.70 . . 0 "[ . 1 . 2]" 61 . 1 9 ILE C 1 10 LYS N 1 10 LYS CA 1 10 LYS C -90.00 -30.00 -73.91 -87.21 -53.88 . . 0 "[ . 1 . 2]" 62 . 1 10 LYS C 1 11 CYS N 1 11 CYS CA 1 11 CYS C -90.00 -30.00 -64.15 -63.53 -65.30 . . 0 "[ . 1 . 2]" 63 . 1 12 LYS C 1 13 ILE N 1 13 ILE CA 1 13 ILE C -175.00 -95.00 -128.60 -123.45 -125.87 . . 0 "[ . 1 . 2]" 64 . 1 39 ASP C 1 40 ASP N 1 40 ASP CA 1 40 ASP C -90.00 -30.00 -60.21 -70.59 -43.60 . . 0 "[ . 1 . 2]" 65 . 1 40 ASP C 1 41 LEU N 1 41 LEU CA 1 41 LEU C -90.00 -30.00 -59.30 -57.11 -59.73 . . 0 "[ . 1 . 2]" 66 . 1 41 LEU C 1 42 ASP N 1 42 ASP CA 1 42 ASP C -90.00 -30.00 -58.68 -66.77 -53.45 . . 0 "[ . 1 . 2]" 67 . 1 42 ASP C 1 43 ARG N 1 43 ARG CA 1 43 ARG C -90.00 -30.00 -55.56 -50.92 -52.31 . . 0 "[ . 1 . 2]" 68 . 1 43 ARG C 1 44 CYS N 1 44 CYS CA 1 44 CYS C -90.00 -30.00 -60.89 -66.90 -51.36 . . 0 "[ . 1 . 2]" 69 . 1 44 CYS C 1 45 CYS N 1 45 CYS CA 1 45 CYS C -95.00 -35.00 -64.40 -73.90 -59.50 . . 0 "[ . 1 . 2]" 70 . 1 45 CYS C 1 46 GLN N 1 46 GLN CA 1 46 GLN C -90.00 -30.00 -54.22 -59.11 -50.20 . . 0 "[ . 1 . 2]" 71 . 1 46 GLN C 1 47 THR N 1 47 THR CA 1 47 THR C -90.00 -30.00 -67.72 -67.56 -69.17 . . 0 "[ . 1 . 2]" 72 . 1 47 THR C 1 48 HIS N 1 48 HIS CA 1 48 HIS C -90.00 -30.00 -62.53 -68.94 -55.46 . . 0 "[ . 1 . 2]" 73 . 1 48 HIS C 1 49 ASP N 1 49 ASP CA 1 49 ASP C -90.00 -30.00 -60.39 -61.87 -62.70 . . 0 "[ . 1 . 2]" 74 . 1 49 ASP C 1 50 ASN N 1 50 ASN CA 1 50 ASN C -95.00 -35.00 -59.25 -63.44 -55.70 . . 0 "[ . 1 . 2]" 75 . 1 50 ASN C 1 51 CYS N 1 51 CYS CA 1 51 CYS C -95.00 -35.00 -71.37 -69.89 -71.29 . . 0 "[ . 1 . 2]" 76 . 1 51 CYS C 1 52 TYR N 1 52 TYR CA 1 52 TYR C -90.00 -30.00 -64.52 -74.90 -59.34 . . 0 "[ . 1 . 2]" 77 . 1 52 TYR C 1 53 LYS N 1 53 LYS CA 1 53 LYS C -90.00 -30.00 -75.07 -79.53 -70.26 . . 0 "[ . 1 . 2]" 78 . 1 53 LYS C 1 54 GLN N 1 54 GLN CA 1 54 GLN C -95.00 -35.00 -53.48 -58.12 -48.59 . . 0 "[ . 1 . 2]" 79 . 1 54 GLN C 1 55 ALA N 1 55 ALA CA 1 55 ALA C -90.00 -30.00 -64.22 -70.75 -58.39 . . 0 "[ . 1 . 2]" 80 . 1 56 LYS C 1 57 LYS N 1 57 LYS CA 1 57 LYS C -90.00 -30.00 -60.15 -61.17 -61.51 . . 0 "[ . 1 . 2]" 81 . 1 70 THR C 1 71 ASN N 1 71 ASN CA 1 71 ASN C -100.00 -40.00 -72.57 -53.79 -60.43 . . 0 "[ . 1 . 2]" 82 . 1 76 SER C 1 77 CYS N 1 77 CYS CA 1 77 CYS C -175.00 -95.00 -132.55 -162.76 -118.98 . . 0 "[ . 1 . 2]" 83 . 1 80 ASN C 1 81 GLU N 1 81 GLU CA 1 81 GLU C -175.00 -95.00 -137.67 -148.53 -130.66 . . 0 "[ . 1 . 2]" 84 . 1 82 ILE C 1 83 THR N 1 83 THR CA 1 83 THR C -175.00 -95.00 -117.33 -131.12 -109.34 . . 0 "[ . 1 . 2]" 85 . 1 86 SER C 1 87 GLU N 1 87 GLU CA 1 87 GLU C -100.00 -40.00 -56.84 -56.19 -56.49 . . 0 "[ . 1 . 2]" 86 . 1 87 GLU C 1 88 ASN N 1 88 ASN CA 1 88 ASN C -100.00 -40.00 -48.68 -55.98 -41.44 . . 0 "[ . 1 . 2]" 87 . 1 92 GLU C 1 93 ALA N 1 93 ALA CA 1 93 ALA C -90.00 -30.00 -74.72 -74.31 -74.40 . . 0 "[ . 1 . 2]" 88 . 1 93 ALA C 1 94 PHE N 1 94 PHE CA 1 94 PHE C -95.00 -35.00 -65.24 -63.89 -64.53 . . 0 "[ . 1 . 2]" 89 . 1 94 PHE C 1 95 ILE N 1 95 ILE CA 1 95 ILE C -95.00 -35.00 -65.71 -76.43 -59.93 . . 0 "[ . 1 . 2]" 90 . 1 95 ILE C 1 96 CYS N 1 96 CYS CA 1 96 CYS C -95.00 -35.00 -63.68 -58.86 -60.59 . . 0 "[ . 1 . 2]" 91 . 1 97 ASN C 1 98 CYS N 1 98 CYS CA 1 98 CYS C -90.00 -30.00 -66.69 -67.18 -67.72 . . 0 "[ . 1 . 2]" 92 . 1 98 CYS C 1 99 ASP N 1 99 ASP CA 1 99 ASP C -90.00 -30.00 -69.67 -80.05 -62.83 . . 0 "[ . 1 . 2]" 93 . 1 99 ASP C 1 100 ARG N 1 100 ARG CA 1 100 ARG C -90.00 -30.00 -67.83 -73.56 -62.36 . . 0 "[ . 1 . 2]" 94 . 1 100 ARG C 1 101 ASN N 1 101 ASN CA 1 101 ASN C -90.00 -30.00 -57.84 -63.57 -63.80 . . 0 "[ . 1 . 2]" 95 . 1 101 ASN C 1 102 ALA N 1 102 ALA CA 1 102 ALA C -100.00 -40.00 -74.57 -72.67 -73.86 . . 0 "[ . 1 . 2]" 96 . 1 102 ALA C 1 103 ALA N 1 103 ALA CA 1 103 ALA C -90.00 -30.00 -64.89 -62.14 -62.90 . . 0 "[ . 1 . 2]" 97 . 1 103 ALA C 1 104 ILE N 1 104 ILE CA 1 104 ILE C -90.00 -30.00 -65.26 -68.81 -69.43 . . 0 "[ . 1 . 2]" 98 . 1 104 ILE C 1 105 CYS N 1 105 CYS CA 1 105 CYS C -90.00 -30.00 -64.96 -68.14 -60.83 . . 0 "[ . 1 . 2]" 99 . 1 105 CYS C 1 106 PHE N 1 106 PHE CA 1 106 PHE C -90.00 -30.00 -54.39 -54.82 -55.33 . . 0 "[ . 1 . 2]" 100 . 1 106 PHE C 1 107 SER N 1 107 SER CA 1 107 SER C -90.00 -30.00 -80.68 -78.34 -79.02 . . 0 "[ . 1 . 2]" 101 . 1 107 SER C 1 108 LYS N 1 108 LYS CA 1 108 LYS C -175.00 -95.00 -100.56 -98.38 -98.81 . . 0 "[ . 1 . 2]" 102 . 1 108 LYS C 1 109 VAL N 1 109 VAL CA 1 109 VAL C -175.00 -95.00 -126.73 -146.06 -103.72 . . 0 "[ . 1 . 2]" 103 . 1 112 ASN C 1 113 LYS N 1 113 LYS CA 1 113 LYS C -90.00 -30.00 -61.32 -88.40 -42.90 . . 0 "[ . 1 . 2]" 104 . 1 113 LYS C 1 114 GLU N 1 114 GLU CA 1 114 GLU C -95.00 -35.00 -67.57 -77.06 -56.17 . . 0 "[ . 1 . 2]" 105 . 1 115 HIS C 1 116 LYS N 1 116 LYS CA 1 116 LYS C -100.00 -40.00 -66.05 -75.18 -57.50 . . 0 "[ . 1 . 2]" 106 . 1 118 LEU C 1 119 ASP N 1 119 ASP CA 1 119 ASP C -95.00 -35.00 -91.90 -90.12 -93.53 1.57 10 0 "[ . 1 . 2]" 107 . 1 119 ASP C 1 120 LYS N 1 120 LYS CA 1 120 LYS C -95.00 -35.00 -51.23 -45.88 -48.47 . . 0 "[ . 1 . 2]" 108 . 1 120 LYS C 1 121 LYS N 1 121 LYS CA 1 121 LYS C -95.00 -35.00 -63.81 -66.32 -67.44 . . 0 "[ . 1 . 2]" 109 . 1 121 LYS C 1 122 ASN N 1 122 ASN CA 1 122 ASN C -175.00 -95.00 -96.23 -99.16 -94.43 0.57 17 0 "[ . 1 . 2]" 110 . 1 122 ASN C 1 123 CYS N 1 123 CYS CA 1 123 CYS C -175.00 -95.00 -100.10 -98.62 -101.21 0.55 3 0 "[ . 1 . 2]" 111 . 1 9 ILE CA 1 9 ILE CB 1 9 ILE CG1 1 9 ILE CD1 160.00 -160.00 176.88 162.67 -166.58 . . 0 "[ . 1 . 2]" 112 . 1 94 PHE CA 1 94 PHE CB 1 94 PHE CG 1 94 PHE CD1 -125.00 -55.00 -84.57 -119.63 -63.61 . . 0 "[ . 1 . 2]" 113 . 1 111 TYR CA 1 111 TYR CB 1 111 TYR CG 1 111 TYR CD1 -125.00 -55.00 -114.39 -120.09 -123.79 0.31 5 0 "[ . 1 . 2]" stop_ save_
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