NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
516307 | 1e8l | 1093 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1e8l save_dihedral_constraint_statistics_1 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 110 _TA_constraint_stats_list.Viol_count 1002 _TA_constraint_stats_list.Viol_total 54939.49 _TA_constraint_stats_list.Viol_max 5.36 _TA_constraint_stats_list.Viol_rms 0.63 _TA_constraint_stats_list.Viol_average_all_restraints 0.20 _TA_constraint_stats_list.Viol_average_violations_only 1.10 _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 1 LYS C 1 2 VAL N 1 2 VAL CA 1 2 VAL C -160.00 -80.00 -102.11 -113.76 -84.96 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 2 . 1 4 GLY C 1 5 ARG N 1 5 ARG CA 1 5 ARG C -90.00 -30.00 -79.70 -90.47 -90.49 0.81 11 0 "[ . 1 . 2 . 3 . 4 . 5]" 3 . 1 5 ARG C 1 6 CYS N 1 6 CYS CA 1 6 CYS C -90.00 -30.00 -83.03 -86.65 -78.77 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 4 . 1 6 CYS C 1 7 GLU N 1 7 GLU CA 1 7 GLU C -90.00 -30.00 -45.87 -45.90 -45.96 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 5 . 1 7 GLU C 1 8 LEU N 1 8 LEU CA 1 8 LEU C -90.00 -30.00 -66.09 -70.09 -62.02 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 6 . 1 8 LEU C 1 9 ALA N 1 9 ALA CA 1 9 ALA C -90.00 -30.00 -59.78 -61.37 -61.55 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 7 . 1 9 ALA C 1 10 ALA N 1 10 ALA CA 1 10 ALA C -90.00 -30.00 -50.83 -52.74 -49.63 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 8 . 1 10 ALA C 1 11 ALA N 1 11 ALA CA 1 11 ALA C -90.00 -30.00 -65.05 -64.25 -64.37 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 9 . 1 11 ALA C 1 12 MET N 1 12 MET CA 1 12 MET C -90.00 -30.00 -60.45 -61.25 -61.46 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 10 . 1 12 MET C 1 13 LYS N 1 13 LYS CA 1 13 LYS C -90.00 -30.00 -51.94 -55.50 -49.46 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 11 . 1 13 LYS C 1 14 ARG N 1 14 ARG CA 1 14 ARG C -90.00 -30.00 -63.86 -62.11 -62.33 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 12 . 1 14 ARG C 1 15 HIS N 1 15 HIS CA 1 15 HIS C -160.00 -80.00 -76.76 -76.48 -76.51 3.85 50 0 "[ . 1 . 2 . 3 . 4 . 5]" 13 . 1 26 GLY C 1 27 ASN N 1 27 ASN CA 1 27 ASN C -90.00 -30.00 -68.39 -73.85 -59.61 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 14 . 1 29 VAL C 1 30 CYS N 1 30 CYS CA 1 30 CYS C -90.00 -30.00 -59.40 -57.54 -57.91 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 15 . 1 30 CYS C 1 31 ALA N 1 31 ALA CA 1 31 ALA C -90.00 -30.00 -63.06 -65.68 -61.22 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 16 . 1 31 ALA C 1 32 ALA N 1 32 ALA CA 1 32 ALA C -90.00 -30.00 -67.92 -68.56 -68.64 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 17 . 1 32 ALA C 1 33 LYS N 1 33 LYS CA 1 33 LYS C -90.00 -30.00 -48.77 -46.34 -46.57 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 18 . 1 35 GLU C 1 36 SER N 1 36 SER CA 1 36 SER C -160.00 -80.00 -132.25 -136.13 -125.70 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 19 . 1 38 PHE C 1 39 ASN N 1 39 ASN CA 1 39 ASN C -160.00 -80.00 -83.05 -89.28 -79.04 0.96 5 0 "[ . 1 . 2 . 3 . 4 . 5]" 20 . 1 40 THR C 1 41 GLN N 1 41 GLN CA 1 41 GLN C -160.00 -80.00 -104.90 -116.95 -89.83 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 21 . 1 42 ALA C 1 43 THR N 1 43 THR CA 1 43 THR C -160.00 -80.00 -126.93 -122.65 -122.95 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 22 . 1 43 THR C 1 44 ASN N 1 44 ASN CA 1 44 ASN C -160.00 -80.00 -130.88 -126.39 -126.58 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 23 . 1 45 ARG C 1 46 ASN N 1 46 ASN CA 1 46 ASN C -160.00 -80.00 -103.92 -108.91 -109.90 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 24 . 1 50 SER C 1 51 THR N 1 51 THR CA 1 51 THR C -160.00 -80.00 -149.58 -161.02 -138.99 1.02 31 0 "[ . 1 . 2 . 3 . 4 . 5]" 25 . 1 51 THR C 1 52 ASP N 1 52 ASP CA 1 52 ASP C -160.00 -80.00 -114.16 -115.42 -115.96 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 26 . 1 52 ASP C 1 53 TYR N 1 53 TYR CA 1 53 TYR C -160.00 -80.00 -96.15 -103.30 -85.75 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 27 . 1 55 ILE C 1 56 LEU N 1 56 LEU CA 1 56 LEU C -160.00 -80.00 -109.76 -109.40 -109.80 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 28 . 1 61 ARG C 1 62 TRP N 1 62 TRP CA 1 62 TRP C -160.00 -80.00 -132.29 -162.03 -78.20 2.03 16 0 "[ . 1 . 2 . 3 . 4 . 5]" 29 . 1 64 CYS C 1 65 ASN N 1 65 ASN CA 1 65 ASN C -160.00 -80.00 -97.81 -105.38 -89.63 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 30 . 1 65 ASN C 1 66 ASP N 1 66 ASP CA 1 66 ASP C -160.00 -80.00 -97.73 -97.06 -97.37 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 31 . 1 67 GLY C 1 68 ARG N 1 68 ARG CA 1 68 ARG C -160.00 -80.00 -91.72 -133.06 -80.03 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 32 . 1 68 ARG C 1 69 THR N 1 69 THR CA 1 69 THR C -160.00 -80.00 -132.95 -151.76 -74.64 5.36 38 2 "[ . 1 . 2 . 3 . +-4 . 5]" 33 . 1 79 PRO C 1 80 CYS N 1 80 CYS CA 1 80 CYS C -90.00 -30.00 -60.92 -69.83 -53.28 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 34 . 1 80 CYS C 1 81 SER N 1 81 SER CA 1 81 SER C -90.00 -30.00 -55.79 -66.91 -46.12 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 35 . 1 83 LEU C 1 84 LEU N 1 84 LEU CA 1 84 LEU C -160.00 -80.00 -104.85 -116.71 -88.18 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 36 . 1 88 ILE C 1 89 THR N 1 89 THR CA 1 89 THR C -90.00 -30.00 -49.83 -46.63 -46.91 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 37 . 1 89 THR C 1 90 ALA N 1 90 ALA CA 1 90 ALA C -90.00 -30.00 -63.75 -68.94 -56.85 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 38 . 1 92 VAL C 1 93 ASN N 1 93 ASN CA 1 93 ASN C -90.00 -30.00 -46.93 -42.71 -42.94 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 39 . 1 95 ALA C 1 96 LYS N 1 96 LYS CA 1 96 LYS C -90.00 -30.00 -51.13 -55.27 -47.82 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 40 . 1 97 LYS C 1 98 ILE N 1 98 ILE CA 1 98 ILE C -90.00 -30.00 -61.73 -67.47 -57.91 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 41 . 1 107 ALA C 1 108 TRP N 1 108 TRP CA 1 108 TRP C -160.00 -80.00 -83.33 -80.76 -82.45 1.60 25 0 "[ . 1 . 2 . 3 . 4 . 5]" 42 . 1 108 TRP C 1 109 VAL N 1 109 VAL CA 1 109 VAL C -90.00 -30.00 -75.07 -73.57 -73.78 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 43 . 1 111 TRP C 1 112 ARG N 1 112 ARG CA 1 112 ARG C -90.00 -30.00 -92.90 -94.01 -90.68 4.01 30 0 "[ . 1 . 2 . 3 . 4 . 5]" 44 . 1 113 ASN C 1 114 ARG N 1 114 ARG CA 1 114 ARG C -160.00 -80.00 -105.45 -116.11 -94.60 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 45 . 1 114 ARG C 1 115 CYS N 1 115 CYS CA 1 115 CYS C -160.00 -80.00 -113.39 -118.59 -94.67 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 46 . 1 117 GLY C 1 118 THR N 1 118 THR CA 1 118 THR C -160.00 -80.00 -117.94 -117.16 -117.19 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 47 . 1 119 ASP C 1 120 VAL N 1 120 VAL CA 1 120 VAL C -90.00 -30.00 -74.62 -75.46 -75.59 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 48 . 1 120 VAL C 1 121 GLN N 1 121 GLN CA 1 121 GLN C -90.00 -30.00 -59.30 -59.19 -59.23 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 49 . 1 121 GLN C 1 122 ALA N 1 122 ALA CA 1 122 ALA C -90.00 -30.00 -90.10 -90.29 -87.36 0.29 44 0 "[ . 1 . 2 . 3 . 4 . 5]" 50 . 1 123 TRP C 1 124 ILE N 1 124 ILE CA 1 124 ILE C -160.00 -80.00 -124.79 -129.13 -113.05 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 51 . 1 128 ARG C 1 129 LEU N 1 129 LEU CA 1 129 LEU C -160.00 -80.00 -138.41 -160.07 -93.95 0.07 26 0 "[ . 1 . 2 . 3 . 4 . 5]" 52 . 1 3 PHE N 1 3 PHE CA 1 3 PHE CB 1 3 PHE CG -90.00 -30.00 -73.11 -68.22 -69.87 0.24 33 0 "[ . 1 . 2 . 3 . 4 . 5]" 53 . 1 6 CYS N 1 6 CYS CA 1 6 CYS CB 1 6 CYS SG -90.00 -30.00 -37.74 -42.47 -42.80 0.04 29 0 "[ . 1 . 2 . 3 . 4 . 5]" 54 . 1 15 HIS N 1 15 HIS CA 1 15 HIS CB 1 15 HIS CG -90.00 -30.00 -84.14 -87.55 -88.20 0.23 15 0 "[ . 1 . 2 . 3 . 4 . 5]" 55 . 1 18 ASP N 1 18 ASP CA 1 18 ASP CB 1 18 ASP CG 150.00 -150.00 157.13 152.24 152.11 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 56 . 1 20 TYR N 1 20 TYR CA 1 20 TYR CB 1 20 TYR CG 150.00 -150.00 -171.14 -178.73 -161.43 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 57 . 1 23 TYR N 1 23 TYR CA 1 23 TYR CB 1 23 TYR CG -90.00 -30.00 -77.30 -90.32 -68.18 0.32 48 0 "[ . 1 . 2 . 3 . 4 . 5]" 58 . 1 27 ASN N 1 27 ASN CA 1 27 ASN CB 1 27 ASN CG -90.00 -30.00 -54.30 -57.34 -58.93 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 59 . 1 30 CYS N 1 30 CYS CA 1 30 CYS CB 1 30 CYS SG 150.00 -150.00 -164.61 -163.31 -163.80 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 60 . 1 34 PHE N 1 34 PHE CA 1 34 PHE CB 1 34 PHE CG -90.00 -30.00 -91.11 -91.23 -90.69 1.23 28 0 "[ . 1 . 2 . 3 . 4 . 5]" 61 . 1 39 ASN N 1 39 ASN CA 1 39 ASN CB 1 39 ASN CG 150.00 -150.00 -166.34 -170.64 -171.35 0.43 32 0 "[ . 1 . 2 . 3 . 4 . 5]" 62 . 1 46 ASN N 1 46 ASN CA 1 46 ASN CB 1 46 ASN CG -90.00 -30.00 -38.68 -47.31 -35.23 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 63 . 1 48 ASP N 1 48 ASP CA 1 48 ASP CB 1 48 ASP CG 30.00 90.00 54.65 64.34 53.61 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 64 . 1 52 ASP N 1 52 ASP CA 1 52 ASP CB 1 52 ASP CG -90.00 -30.00 -59.78 -66.69 -29.89 0.11 4 0 "[ . 1 . 2 . 3 . 4 . 5]" 65 . 1 53 TYR N 1 53 TYR CA 1 53 TYR CB 1 53 TYR CG -90.00 -30.00 -58.02 -55.27 -55.74 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 66 . 1 59 ASN N 1 59 ASN CA 1 59 ASN CB 1 59 ASN CG 150.00 -150.00 -178.00 -175.62 -175.80 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 67 . 1 61 ARG N 1 61 ARG CA 1 61 ARG CB 1 61 ARG CG 150.00 -150.00 -156.62 -174.32 -149.59 0.41 4 0 "[ . 1 . 2 . 3 . 4 . 5]" 68 . 1 64 CYS N 1 64 CYS CA 1 64 CYS CB 1 64 CYS SG 30.00 90.00 86.21 72.89 92.10 2.10 18 0 "[ . 1 . 2 . 3 . 4 . 5]" 69 . 1 66 ASP N 1 66 ASP CA 1 66 ASP CB 1 66 ASP CG 30.00 90.00 68.34 51.95 73.74 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 70 . 1 75 LEU N 1 75 LEU CA 1 75 LEU CB 1 75 LEU CG -90.00 -30.00 -93.24 -93.12 -93.31 4.60 27 0 "[ . 1 . 2 . 3 . 4 . 5]" 71 . 1 87 ASP N 1 87 ASP CA 1 87 ASP CB 1 87 ASP CG 150.00 -150.00 -169.77 178.65 -165.05 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 72 . 1 94 CYS N 1 94 CYS CA 1 94 CYS CB 1 94 CYS SG 150.00 -150.00 -151.37 -161.81 -148.05 1.95 11 0 "[ . 1 . 2 . 3 . 4 . 5]" 73 . 1 119 ASP N 1 119 ASP CA 1 119 ASP CB 1 119 ASP CG 150.00 -150.00 -149.74 -149.94 -149.59 0.41 9 0 "[ . 1 . 2 . 3 . 4 . 5]" 74 . 1 123 TRP N 1 123 TRP CA 1 123 TRP CB 1 123 TRP CG -90.00 -30.00 -89.90 -90.25 -90.26 0.54 33 0 "[ . 1 . 2 . 3 . 4 . 5]" 75 . 1 127 CYS N 1 127 CYS CA 1 127 CYS CB 1 127 CYS SG -90.00 -30.00 -87.63 -91.06 -28.85 1.15 29 0 "[ . 1 . 2 . 3 . 4 . 5]" 76 . 1 2 VAL N 1 2 VAL CA 1 2 VAL CB 1 2 VAL CG1 150.00 -150.00 171.33 171.43 171.20 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 77 . 1 8 LEU N 1 8 LEU CA 1 8 LEU CB 1 8 LEU CG 150.00 -150.00 170.75 -176.50 -177.27 0.40 43 0 "[ . 1 . 2 . 3 . 4 . 5]" 78 . 1 12 MET N 1 12 MET CA 1 12 MET CB 1 12 MET CG -90.00 -30.00 -44.66 -67.06 -39.43 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 79 . 1 17 LEU N 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG -90.00 -30.00 -39.39 -43.26 -35.90 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 80 . 1 24 SER N 1 24 SER CA 1 24 SER CB 1 24 SER OG 30.00 90.00 69.22 70.39 70.22 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 81 . 1 28 TRP N 1 28 TRP CA 1 28 TRP CB 1 28 TRP CG -90.00 -30.00 -60.93 -65.07 -54.88 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 82 . 1 29 VAL N 1 29 VAL CA 1 29 VAL CB 1 29 VAL CG1 150.00 -150.00 178.09 178.64 177.82 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 83 . 1 33 LYS N 1 33 LYS CA 1 33 LYS CB 1 33 LYS CG 150.00 -150.00 -175.81 158.84 -160.01 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 84 . 1 36 SER N 1 36 SER CA 1 36 SER CB 1 36 SER OG 30.00 90.00 50.30 47.82 47.63 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 85 . 1 38 PHE N 1 38 PHE CA 1 38 PHE CB 1 38 PHE CG -90.00 -30.00 -67.34 -77.54 -50.98 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 86 . 1 40 THR N 1 40 THR CA 1 40 THR CB 1 40 THR OG1 30.00 90.00 91.61 90.97 92.66 2.66 45 0 "[ . 1 . 2 . 3 . 4 . 5]" 87 . 1 41 GLN N 1 41 GLN CA 1 41 GLN CB 1 41 GLN CG -90.00 -30.00 -91.93 -91.83 -91.87 2.85 42 0 "[ . 1 . 2 . 3 . 4 . 5]" 88 . 1 43 THR N 1 43 THR CA 1 43 THR CB 1 43 THR OG1 30.00 90.00 84.61 88.67 88.29 0.36 12 0 "[ . 1 . 2 . 3 . 4 . 5]" 89 . 1 47 THR N 1 47 THR CA 1 47 THR CB 1 47 THR OG1 30.00 90.00 56.47 53.42 64.49 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 90 . 1 50 SER N 1 50 SER CA 1 50 SER CB 1 50 SER OG 30.00 90.00 30.02 29.26 36.43 0.74 17 0 "[ . 1 . 2 . 3 . 4 . 5]" 91 . 1 51 THR N 1 51 THR CA 1 51 THR CB 1 51 THR OG1 -90.00 -30.00 -41.51 -65.39 -29.79 0.21 46 0 "[ . 1 . 2 . 3 . 4 . 5]" 92 . 1 57 GLN N 1 57 GLN CA 1 57 GLN CB 1 57 GLN CG -90.00 -30.00 -57.59 -57.97 -58.45 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 93 . 1 60 SER N 1 60 SER CA 1 60 SER CB 1 60 SER OG 30.00 90.00 86.01 82.08 81.77 0.17 28 0 "[ . 1 . 2 . 3 . 4 . 5]" 94 . 1 65 ASN N 1 65 ASN CA 1 65 ASN CB 1 65 ASN CG 150.00 -150.00 -170.44 -165.35 -167.48 0.13 39 0 "[ . 1 . 2 . 3 . 4 . 5]" 95 . 1 69 THR N 1 69 THR CA 1 69 THR CB 1 69 THR OG1 -90.00 -30.00 -36.69 -29.89 -29.91 0.21 20 0 "[ . 1 . 2 . 3 . 4 . 5]" 96 . 1 74 ASN N 1 74 ASN CA 1 74 ASN CB 1 74 ASN CG 150.00 -150.00 -156.63 -149.86 -149.89 0.19 10 0 "[ . 1 . 2 . 3 . 4 . 5]" 97 . 1 80 CYS N 1 80 CYS CA 1 80 CYS CB 1 80 CYS SG -90.00 -30.00 -47.66 -35.60 -36.24 1.33 17 0 "[ . 1 . 2 . 3 . 4 . 5]" 98 . 1 81 SER N 1 81 SER CA 1 81 SER CB 1 81 SER OG 30.00 90.00 59.35 69.80 67.70 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 99 . 1 84 LEU N 1 84 LEU CA 1 84 LEU CB 1 84 LEU CG -90.00 -30.00 -38.77 -67.18 -29.81 0.19 21 0 "[ . 1 . 2 . 3 . 4 . 5]" 100 . 1 88 ILE N 1 88 ILE CA 1 88 ILE CB 1 88 ILE CG1 30.00 90.00 30.23 29.42 29.36 1.09 6 0 "[ . 1 . 2 . 3 . 4 . 5]" 101 . 1 89 THR N 1 89 THR CA 1 89 THR CB 1 89 THR OG1 -90.00 -30.00 -47.07 -63.10 -31.88 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 102 . 1 92 VAL N 1 92 VAL CA 1 92 VAL CB 1 92 VAL CG1 150.00 -150.00 169.61 171.02 170.80 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 103 . 1 105 MET N 1 105 MET CA 1 105 MET CB 1 105 MET CG -90.00 -30.00 -36.12 -59.44 -28.72 1.28 45 0 "[ . 1 . 2 . 3 . 4 . 5]" 104 . 1 106 ASN N 1 106 ASN CA 1 106 ASN CB 1 106 ASN CG -90.00 -30.00 -57.50 -91.69 -91.75 1.76 14 0 "[ . 1 . 2 . 3 . 4 . 5]" 105 . 1 111 TRP N 1 111 TRP CA 1 111 TRP CB 1 111 TRP CG 150.00 -150.00 -179.87 179.81 179.74 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 106 . 1 114 ARG N 1 114 ARG CA 1 114 ARG CB 1 114 ARG CG -90.00 -30.00 -90.78 -91.89 -90.50 1.89 32 0 "[ . 1 . 2 . 3 . 4 . 5]" 107 . 1 116 LYS N 1 116 LYS CA 1 116 LYS CB 1 116 LYS CG 150.00 -150.00 -163.08 -179.97 -149.91 0.09 32 0 "[ . 1 . 2 . 3 . 4 . 5]" 108 . 1 118 THR N 1 118 THR CA 1 118 THR CB 1 118 THR OG1 30.00 90.00 59.20 60.20 60.00 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 109 . 1 120 VAL N 1 120 VAL CA 1 120 VAL CB 1 120 VAL CG1 -90.00 -30.00 -64.99 -63.67 -64.75 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" 110 . 1 124 ILE N 1 124 ILE CA 1 124 ILE CB 1 124 ILE CG1 30.00 90.00 48.52 36.10 53.26 . . 0 "[ . 1 . 2 . 3 . 4 . 5]" stop_ save_
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