NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
437240 | 2k2j | 15707 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2k2j save_distance_constraint_statistics_1 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 114 _TA_constraint_stats_list.Viol_count 396 _TA_constraint_stats_list.Viol_total 3869.10 _TA_constraint_stats_list.Viol_max 2.53 _TA_constraint_stats_list.Viol_rms 0.25 _TA_constraint_stats_list.Viol_average_all_restraints 0.08 _TA_constraint_stats_list.Viol_average_violations_only 0.49 _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 13 LYS C 1 14 GLN N 1 14 GLN CA 1 14 GLN C -144.00 -44.00 -88.88 -80.61 -87.57 . . 0 "[ . 1 . 2]" 2 . 1 14 GLN C 1 15 GLN N 1 15 GLN CA 1 15 GLN C -169.00 -85.00 -140.44 -127.69 -131.05 0.14 16 0 "[ . 1 . 2]" 3 . 1 16 GLY C 1 17 GLU N 1 17 GLU CA 1 17 GLU C -142.00 -70.00 -127.95 -139.48 -114.60 . . 0 "[ . 1 . 2]" 4 . 1 17 GLU C 1 18 LEU N 1 18 LEU CA 1 18 LEU C -164.00 -108.00 -147.32 -146.89 -148.54 . . 0 "[ . 1 . 2]" 5 . 1 18 LEU C 1 19 TYR N 1 19 TYR CA 1 19 TYR C -131.00 -91.00 -117.78 -111.07 -112.49 0.02 10 0 "[ . 1 . 2]" 6 . 1 19 TYR C 1 20 MET N 1 20 MET CA 1 20 MET C 177.00 -83.00 -131.50 -141.25 -111.06 . . 0 "[ . 1 . 2]" 7 . 1 20 MET C 1 21 TRP N 1 21 TRP CA 1 21 TRP C -134.00 -50.00 -61.68 -78.66 -55.09 . . 0 "[ . 1 . 2]" 8 . 1 21 TRP C 1 22 ASP N 1 22 ASP CA 1 22 ASP C -127.00 -67.00 -103.24 -108.45 -111.18 . . 0 "[ . 1 . 2]" 9 . 1 27 LYS C 1 28 TRP N 1 28 TRP CA 1 28 TRP C -141.00 -81.00 -105.12 -107.17 -109.45 . . 0 "[ . 1 . 2]" 10 . 1 28 TRP C 1 29 THR N 1 29 THR CA 1 29 THR C -152.00 -100.00 -117.01 -135.99 -99.90 0.10 8 0 "[ . 1 . 2]" 11 . 1 29 THR C 1 30 ARG N 1 30 ARG CA 1 30 ARG C -179.00 -83.00 -93.89 -94.67 -94.73 . . 0 "[ . 1 . 2]" 12 . 1 30 ARG C 1 31 HIS N 1 31 HIS CA 1 31 HIS C -168.00 -72.00 -125.09 -117.55 -119.30 . . 0 "[ . 1 . 2]" 13 . 1 31 HIS C 1 32 TYR N 1 32 TYR CA 1 32 TYR C -126.00 -74.00 -93.67 -114.79 -73.84 0.16 17 0 "[ . 1 . 2]" 14 . 1 32 TYR C 1 33 CYS N 1 33 CYS CA 1 33 CYS C -140.00 -84.00 -90.37 -89.01 -90.52 . . 0 "[ . 1 . 2]" 15 . 1 33 CYS C 1 34 ALA N 1 34 ALA CA 1 34 ALA C -179.00 -83.00 -167.06 -168.52 -168.77 . . 0 "[ . 1 . 2]" 16 . 1 34 ALA C 1 35 ILE N 1 35 ILE CA 1 35 ILE C -153.00 -89.00 -88.56 -88.92 -88.11 0.89 7 0 "[ . 1 . 2]" 17 . 1 35 ILE C 1 36 ALA N 1 36 ALA CA 1 36 ALA C -166.00 -62.00 -121.56 -113.99 -118.08 0.14 3 0 "[ . 1 . 2]" 18 . 1 38 ALA C 1 39 LYS N 1 39 LYS CA 1 39 LYS C -153.00 -81.00 -116.53 -119.87 -121.99 . . 0 "[ . 1 . 2]" 19 . 1 39 LYS C 1 40 LEU N 1 40 LEU CA 1 40 LEU C -148.00 -108.00 -115.64 -121.98 -123.40 0.56 3 0 "[ . 1 . 2]" 20 . 1 40 LEU C 1 41 SER N 1 41 SER CA 1 41 SER C -152.00 -100.00 -108.89 -130.94 -100.28 . . 0 "[ . 1 . 2]" 21 . 1 41 SER C 1 42 PHE N 1 42 PHE CA 1 42 PHE C -147.00 -99.00 -105.24 -105.87 -108.05 0.11 13 0 "[ . 1 . 2]" 22 . 1 42 PHE C 1 43 SER N 1 43 SER CA 1 43 SER C -176.00 -88.00 -92.54 -100.44 -87.69 0.31 10 0 "[ . 1 . 2]" 23 . 1 43 SER C 1 44 ASP N 1 44 ASP CA 1 44 ASP C -126.00 -46.00 -69.25 -66.98 -67.70 . . 0 "[ . 1 . 2]" 24 . 1 68 THR C 1 69 TYR N 1 69 TYR CA 1 69 TYR C -164.00 -100.00 -147.38 -155.80 -111.39 . . 0 "[ . 1 . 2]" 25 . 1 69 TYR C 1 70 ASN N 1 70 ASN CA 1 70 ASN C 179.00 -69.00 -136.88 -138.29 -138.90 . . 0 "[ . 1 . 2]" 26 . 1 70 ASN C 1 71 VAL N 1 71 VAL CA 1 71 VAL C -141.00 -97.00 -97.60 -96.15 -96.20 2.53 6 0 "[ . 1 . 2]" 27 . 1 71 VAL C 1 72 VAL N 1 72 VAL CA 1 72 VAL C -139.00 -107.00 -135.11 -138.46 -139.04 0.23 8 0 "[ . 1 . 2]" 28 . 1 72 VAL C 1 73 LYS N 1 73 LYS CA 1 73 LYS C -151.00 -67.00 -76.60 -95.82 -68.67 . . 0 "[ . 1 . 2]" 29 . 1 73 LYS C 1 74 ALA N 1 74 ALA CA 1 74 ALA C -118.00 -46.00 -80.52 -74.43 -76.14 . . 0 "[ . 1 . 2]" 30 . 1 82 SER C 1 83 PHE N 1 83 PHE CA 1 83 PHE C -129.00 -73.00 -112.08 -101.32 -110.28 0.04 20 0 "[ . 1 . 2]" 31 . 1 83 PHE C 1 84 VAL N 1 84 VAL CA 1 84 VAL C -164.00 -88.00 -129.86 -117.91 -125.15 . . 0 "[ . 1 . 2]" 32 . 1 84 VAL C 1 85 PHE N 1 85 PHE CA 1 85 PHE C -165.00 -85.00 -128.38 -136.17 -116.51 . . 0 "[ . 1 . 2]" 33 . 1 85 PHE C 1 86 ILE N 1 86 ILE CA 1 86 ILE C -160.00 -100.00 -110.88 -107.57 -110.79 0.65 4 0 "[ . 1 . 2]" 34 . 1 86 ILE C 1 87 LEU N 1 87 LEU CA 1 87 LEU C -146.00 -70.00 -100.62 -99.97 -100.04 . . 0 "[ . 1 . 2]" 35 . 1 87 LEU C 1 88 GLU N 1 88 GLU CA 1 88 GLU C -148.00 -60.00 -115.76 -115.38 -116.26 . . 0 "[ . 1 . 2]" 36 . 1 93 GLY C 1 94 ASP N 1 94 ASP CA 1 94 ASP C -129.00 -45.00 -61.19 -56.93 -61.47 . . 0 "[ . 1 . 2]" 37 . 1 94 ASP C 1 95 PRO N 1 95 PRO CA 1 95 PRO C -87.00 -43.00 -79.18 -86.85 -60.68 . . 0 "[ . 1 . 2]" 38 . 1 95 PRO C 1 96 PRO N 1 96 PRO CA 1 96 PRO C -87.00 -43.00 -83.11 -83.04 -83.51 0.74 11 0 "[ . 1 . 2]" 39 . 1 96 PRO C 1 97 VAL N 1 97 VAL CA 1 97 VAL C -152.00 -72.00 -135.58 -139.74 -128.91 . . 0 "[ . 1 . 2]" 40 . 1 97 VAL C 1 98 GLU N 1 98 GLU CA 1 98 GLU C -142.00 -62.00 -97.02 -97.66 -98.96 . . 0 "[ . 1 . 2]" 41 . 1 98 GLU C 1 99 PHE N 1 99 PHE CA 1 99 PHE C -157.00 -113.00 -130.82 -134.49 -128.57 . . 0 "[ . 1 . 2]" 42 . 1 99 PHE C 1 100 ALA N 1 100 ALA CA 1 100 ALA C -159.00 -107.00 -156.88 -159.13 -159.18 0.39 5 0 "[ . 1 . 2]" 43 . 1 100 ALA C 1 101 THR N 1 101 THR CA 1 101 THR C -171.00 -59.00 -128.54 -119.77 -121.31 . . 0 "[ . 1 . 2]" 44 . 1 103 ARG C 1 104 VAL N 1 104 VAL CA 1 104 VAL C -78.00 -46.00 -77.05 -73.71 -77.90 0.43 9 0 "[ . 1 . 2]" 45 . 1 104 VAL C 1 105 GLU N 1 105 GLU CA 1 105 GLU C -71.00 -55.00 -69.11 -70.25 -70.75 0.30 19 0 "[ . 1 . 2]" 46 . 1 105 GLU C 1 106 GLU N 1 106 GLU CA 1 106 GLU C -69.00 -57.00 -60.35 -63.54 -58.16 . . 0 "[ . 1 . 2]" 47 . 1 106 GLU C 1 107 LEU N 1 107 LEU CA 1 107 LEU C -77.00 -49.00 -66.17 -70.23 -57.16 . . 0 "[ . 1 . 2]" 48 . 1 107 LEU C 1 108 PHE N 1 108 PHE CA 1 108 PHE C -77.00 -49.00 -66.66 -72.46 -63.88 . . 0 "[ . 1 . 2]" 49 . 1 108 PHE C 1 109 GLU N 1 109 GLU CA 1 109 GLU C -82.00 -58.00 -70.50 -74.85 -75.19 0.26 20 0 "[ . 1 . 2]" 50 . 1 109 GLU C 1 110 TRP N 1 110 TRP CA 1 110 TRP C -72.00 -56.00 -68.21 -70.49 -60.60 . . 0 "[ . 1 . 2]" 51 . 1 110 TRP C 1 111 PHE N 1 111 PHE CA 1 111 PHE C -75.00 -47.00 -69.28 -70.81 -75.02 0.30 7 0 "[ . 1 . 2]" 52 . 1 111 PHE C 1 112 GLN N 1 112 GLN CA 1 112 GLN C -70.00 -54.00 -66.32 -61.52 -65.47 0.35 18 0 "[ . 1 . 2]" 53 . 1 112 GLN C 1 113 SER N 1 113 SER CA 1 113 SER C -74.00 -54.00 -68.21 -68.66 -68.70 0.00 12 0 "[ . 1 . 2]" 54 . 1 113 SER C 1 114 ILE N 1 114 ILE CA 1 114 ILE C -73.00 -53.00 -56.80 -55.90 -56.86 0.16 13 0 "[ . 1 . 2]" 55 . 1 114 ILE C 1 115 ARG N 1 115 ARG CA 1 115 ARG C -76.00 -52.00 -76.00 -76.18 -76.36 1.01 5 0 "[ . 1 . 2]" 56 . 1 115 ARG C 1 116 GLU N 1 116 GLU CA 1 116 GLU C -78.00 -58.00 -59.93 -59.64 -60.21 1.37 9 0 "[ . 1 . 2]" 57 . 1 116 GLU C 1 117 ILE N 1 117 ILE CA 1 117 ILE C -108.00 -44.00 -104.90 -106.01 -107.74 1.05 10 0 "[ . 1 . 2]" 58 . 1 14 GLN N 1 14 GLN CA 1 14 GLN C 1 15 GLN N 94.00 166.00 114.85 100.68 142.47 . . 0 "[ . 1 . 2]" 59 . 1 15 GLN N 1 15 GLN CA 1 15 GLN C 1 16 GLY N 127.00 179.00 140.51 131.81 152.69 . . 0 "[ . 1 . 2]" 60 . 1 17 GLU N 1 17 GLU CA 1 17 GLU C 1 18 LEU N 107.00 163.00 147.07 132.74 163.02 0.02 5 0 "[ . 1 . 2]" 61 . 1 18 LEU N 1 18 LEU CA 1 18 LEU C 1 19 TYR N 130.00 -178.00 167.92 155.58 178.83 . . 0 "[ . 1 . 2]" 62 . 1 19 TYR N 1 19 TYR CA 1 19 TYR C 1 20 MET N 114.00 166.00 136.92 142.08 140.83 . . 0 "[ . 1 . 2]" 63 . 1 20 MET N 1 20 MET CA 1 20 MET C 1 21 TRP N 107.00 163.00 142.22 139.24 138.26 . . 0 "[ . 1 . 2]" 64 . 1 21 TRP N 1 21 TRP CA 1 21 TRP C 1 22 ASP N 107.00 151.00 121.58 106.92 132.12 0.08 10 0 "[ . 1 . 2]" 65 . 1 22 ASP N 1 22 ASP CA 1 22 ASP C 1 23 SER N 80.00 140.00 102.42 103.62 102.10 . . 0 "[ . 1 . 2]" 66 . 1 28 TRP N 1 28 TRP CA 1 28 TRP C 1 29 THR N 109.00 149.00 125.04 125.59 120.04 0.41 4 0 "[ . 1 . 2]" 67 . 1 29 THR N 1 29 THR CA 1 29 THR C 1 30 ARG N 97.00 169.00 163.00 139.92 169.25 0.25 16 0 "[ . 1 . 2]" 68 . 1 30 ARG N 1 30 ARG CA 1 30 ARG C 1 31 HIS N 122.00 178.00 125.10 120.96 135.25 1.04 9 0 "[ . 1 . 2]" 69 . 1 31 HIS N 1 31 HIS CA 1 31 HIS C 1 32 TYR N 103.00 163.00 147.65 154.20 151.40 0.09 2 0 "[ . 1 . 2]" 70 . 1 32 TYR N 1 32 TYR CA 1 32 TYR C 1 33 CYS N 96.00 152.00 98.69 96.75 96.27 0.54 11 0 "[ . 1 . 2]" 71 . 1 33 CYS N 1 33 CYS CA 1 33 CYS C 1 34 ALA N 123.00 167.00 161.61 162.42 161.20 0.10 14 0 "[ . 1 . 2]" 72 . 1 34 ALA N 1 34 ALA CA 1 34 ALA C 1 35 ILE N 107.00 175.00 118.48 113.82 131.44 . . 0 "[ . 1 . 2]" 73 . 1 35 ILE N 1 35 ILE CA 1 35 ILE C 1 36 ALA N 105.00 157.00 119.21 106.65 139.67 . . 0 "[ . 1 . 2]" 74 . 1 36 ALA N 1 36 ALA CA 1 36 ALA C 1 37 ASP N 86.00 170.00 124.83 122.03 121.40 . . 0 "[ . 1 . 2]" 75 . 1 39 LYS N 1 39 LYS CA 1 39 LYS C 1 40 LEU N 102.00 174.00 156.11 135.68 173.87 . . 0 "[ . 1 . 2]" 76 . 1 40 LEU N 1 40 LEU CA 1 40 LEU C 1 41 SER N 118.00 146.00 118.65 116.30 146.33 1.70 6 0 "[ . 1 . 2]" 77 . 1 41 SER N 1 41 SER CA 1 41 SER C 1 42 PHE N 103.00 163.00 119.90 108.97 129.02 . . 0 "[ . 1 . 2]" 78 . 1 42 PHE N 1 42 PHE CA 1 42 PHE C 1 43 SER N 119.00 175.00 135.32 126.02 143.80 . . 0 "[ . 1 . 2]" 79 . 1 43 SER N 1 43 SER CA 1 43 SER C 1 44 ASP N 125.00 177.00 169.49 171.60 166.99 0.18 6 0 "[ . 1 . 2]" 80 . 1 44 ASP N 1 44 ASP CA 1 44 ASP C 1 45 ASP N 113.00 165.00 165.43 163.36 166.03 1.03 1 0 "[ . 1 . 2]" 81 . 1 69 TYR N 1 69 TYR CA 1 69 TYR C 1 70 ASN N 135.00 171.00 170.98 168.08 171.64 0.64 16 0 "[ . 1 . 2]" 82 . 1 70 ASN N 1 70 ASN CA 1 70 ASN C 1 71 VAL N 102.00 174.00 131.09 117.14 168.99 . . 0 "[ . 1 . 2]" 83 . 1 71 VAL N 1 71 VAL CA 1 71 VAL C 1 72 VAL N 119.00 159.00 131.72 125.85 143.68 . . 0 "[ . 1 . 2]" 84 . 1 72 VAL N 1 72 VAL CA 1 72 VAL C 1 73 LYS N 121.00 161.00 124.59 120.78 120.65 0.39 14 0 "[ . 1 . 2]" 85 . 1 73 LYS N 1 73 LYS CA 1 73 LYS C 1 74 ALA N 105.00 145.00 105.22 104.48 104.34 0.66 1 0 "[ . 1 . 2]" 86 . 1 74 ALA N 1 74 ALA CA 1 74 ALA C 1 75 PRO N 122.00 174.00 120.78 120.77 120.70 2.12 16 0 "[ . 1 . 2]" 87 . 1 83 PHE N 1 83 PHE CA 1 83 PHE C 1 84 VAL N 86.00 162.00 102.48 92.43 109.70 . . 0 "[ . 1 . 2]" 88 . 1 84 VAL N 1 84 VAL CA 1 84 VAL C 1 85 PHE N 125.00 -179.00 149.20 153.97 152.60 . . 0 "[ . 1 . 2]" 89 . 1 85 PHE N 1 85 PHE CA 1 85 PHE C 1 86 ILE N 106.00 166.00 133.18 119.44 161.38 . . 0 "[ . 1 . 2]" 90 . 1 86 ILE N 1 86 ILE CA 1 86 ILE C 1 87 LEU N 109.00 -179.00 138.37 133.48 144.75 . . 0 "[ . 1 . 2]" 91 . 1 87 LEU N 1 87 LEU CA 1 87 LEU C 1 88 GLU N 100.00 148.00 129.41 125.70 135.31 . . 0 "[ . 1 . 2]" 92 . 1 88 GLU N 1 88 GLU CA 1 88 GLU C 1 89 PRO N 102.00 166.00 108.54 103.89 112.40 . . 0 "[ . 1 . 2]" 93 . 1 94 ASP N 1 94 ASP CA 1 94 ASP C 1 95 PRO N 105.00 -179.00 159.92 159.50 159.17 . . 0 "[ . 1 . 2]" 94 . 1 95 PRO N 1 95 PRO CA 1 95 PRO C 1 96 PRO N 128.00 168.00 150.47 154.88 154.10 . . 0 "[ . 1 . 2]" 95 . 1 96 PRO N 1 96 PRO CA 1 96 PRO C 1 97 VAL N 124.00 168.00 168.12 167.37 168.39 0.39 11 0 "[ . 1 . 2]" 96 . 1 97 VAL N 1 97 VAL CA 1 97 VAL C 1 98 GLU N 107.00 159.00 128.23 120.89 133.79 . . 0 "[ . 1 . 2]" 97 . 1 98 GLU N 1 98 GLU CA 1 98 GLU C 1 99 PHE N 102.00 154.00 143.00 139.76 147.82 . . 0 "[ . 1 . 2]" 98 . 1 99 PHE N 1 99 PHE CA 1 99 PHE C 1 100 ALA N 138.00 -178.00 157.77 147.14 162.76 . . 0 "[ . 1 . 2]" 99 . 1 100 ALA N 1 100 ALA CA 1 100 ALA C 1 101 THR N 136.00 180.00 157.49 142.42 166.78 . . 0 "[ . 1 . 2]" 100 . 1 101 THR N 1 101 THR CA 1 101 THR C 1 102 ASP N 120.00 -168.00 -172.17 -172.54 -173.59 0.05 20 0 "[ . 1 . 2]" 101 . 1 104 VAL N 1 104 VAL CA 1 104 VAL C 1 105 GLU N -49.00 -25.00 -33.17 -32.94 -33.82 . . 0 "[ . 1 . 2]" 102 . 1 105 GLU N 1 105 GLU CA 1 105 GLU C 1 106 GLU N -56.00 -20.00 -51.12 -54.12 -45.10 . . 0 "[ . 1 . 2]" 103 . 1 106 GLU N 1 106 GLU CA 1 106 GLU C 1 107 LEU N -64.00 -20.00 -29.44 -30.64 -31.33 . . 0 "[ . 1 . 2]" 104 . 1 107 LEU N 1 107 LEU CA 1 107 LEU C 1 108 PHE N -56.00 -28.00 -56.59 -57.52 -56.01 1.52 4 0 "[ . 1 . 2]" 105 . 1 108 PHE N 1 108 PHE CA 1 108 PHE C 1 109 GLU N -48.00 -28.00 -29.96 -42.86 -27.05 0.95 7 0 "[ . 1 . 2]" 106 . 1 109 GLU N 1 109 GLU CA 1 109 GLU C 1 110 TRP N -57.00 -25.00 -58.08 -58.53 -57.77 1.53 9 0 "[ . 1 . 2]" 107 . 1 110 TRP N 1 110 TRP CA 1 110 TRP C 1 111 PHE N -49.00 -37.00 -46.97 -49.54 -39.15 0.54 14 0 "[ . 1 . 2]" 108 . 1 111 PHE N 1 111 PHE CA 1 111 PHE C 1 112 GLN N -59.00 -31.00 -34.30 -45.88 -30.03 0.97 20 0 "[ . 1 . 2]" 109 . 1 112 GLN N 1 112 GLN CA 1 112 GLN C 1 113 SER N -55.00 -19.00 -35.49 -40.48 -29.11 . . 0 "[ . 1 . 2]" 110 . 1 113 SER N 1 113 SER CA 1 113 SER C 1 114 ILE N -51.00 -31.00 -46.24 -46.33 -46.81 0.19 12 0 "[ . 1 . 2]" 111 . 1 114 ILE N 1 114 ILE CA 1 114 ILE C 1 115 ARG N -53.00 -33.00 -34.80 -33.96 -34.23 0.30 17 0 "[ . 1 . 2]" 112 . 1 115 ARG N 1 115 ARG CA 1 115 ARG C 1 116 GLU N -56.00 -28.00 -31.71 -40.95 -27.90 0.10 19 0 "[ . 1 . 2]" 113 . 1 116 GLU N 1 116 GLU CA 1 116 GLU C 1 117 ILE N -55.00 -19.00 -19.41 -18.29 -18.61 1.20 12 0 "[ . 1 . 2]" 114 . 1 117 ILE N 1 117 ILE CA 1 117 ILE C 1 118 THR N -51.00 -23.00 -30.37 -24.24 -29.80 1.64 12 0 "[ . 1 . 2]" stop_ save_
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