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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
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395810 |
1rzw ![]() ![]() |
6058 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1rzw save_distance_constraint_statistics_1 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 220 _TA_constraint_stats_list.Viol_count 26 _TA_constraint_stats_list.Viol_total 36.97 _TA_constraint_stats_list.Viol_max 5.43 _TA_constraint_stats_list.Viol_rms 0.62 _TA_constraint_stats_list.Viol_average_all_restraints 0.17 _TA_constraint_stats_list.Viol_average_violations_only 1.42 _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 MET C 1 2 THR N 1 2 THR CA 1 2 THR C -123.57 -63.57 -90.09 -90.09 -90.09 . . 0 "[ ]" 2 . 1 2 THR N 1 2 THR CA 1 2 THR C 1 3 LEU N 71.89 171.89 89.87 89.87 89.87 . . 0 "[ ]" 3 . 1 2 THR C 1 3 LEU N 1 3 LEU CA 1 3 LEU C -147.54 -67.94 -106.36 -106.36 -106.36 . . 0 "[ ]" 4 . 1 3 LEU N 1 3 LEU CA 1 3 LEU C 1 4 LYS N 80.75 -179.25 137.85 137.85 137.85 . . 0 "[ ]" 5 . 1 3 LEU C 1 4 LYS N 1 4 LYS CA 1 4 LYS C -158.12 -98.12 -148.51 -148.51 -148.51 . . 0 "[ ]" 6 . 1 4 LYS N 1 4 LYS CA 1 4 LYS C 1 5 GLN N 98.58 -161.42 134.22 134.22 134.22 . . 0 "[ ]" 7 . 1 4 LYS C 1 5 GLN N 1 5 GLN CA 1 5 GLN C -170.34 -110.34 -110.05 -110.05 -110.05 0.29 1 0 "[ ]" 8 . 1 5 GLN N 1 5 GLN CA 1 5 GLN C 1 6 VAL N 92.37 -167.63 121.74 121.74 121.74 . . 0 "[ ]" 9 . 1 5 GLN C 1 6 VAL N 1 6 VAL CA 1 6 VAL C -146.70 -86.70 -147.47 -147.47 -147.47 0.77 1 0 "[ ]" 10 . 1 6 VAL N 1 6 VAL CA 1 6 VAL C 1 7 ILE N 72.51 172.51 135.69 135.69 135.69 . . 0 "[ ]" 11 . 1 6 VAL C 1 7 ILE N 1 7 ILE CA 1 7 ILE C -152.07 -88.67 -105.76 -105.76 -105.76 . . 0 "[ ]" 12 . 1 7 ILE N 1 7 ILE CA 1 7 ILE C 1 8 VAL N 77.94 177.94 118.55 118.55 118.55 . . 0 "[ ]" 13 . 1 7 ILE C 1 8 VAL N 1 8 VAL CA 1 8 VAL C -140.74 -80.74 -94.55 -94.55 -94.55 . . 0 "[ ]" 14 . 1 8 VAL N 1 8 VAL CA 1 8 VAL C 1 9 VAL N 45.39 145.39 142.51 142.51 142.51 . . 0 "[ ]" 15 . 1 8 VAL C 1 9 VAL N 1 9 VAL CA 1 9 VAL C -161.76 -101.76 -124.71 -124.71 -124.71 . . 0 "[ ]" 16 . 1 9 VAL N 1 9 VAL CA 1 9 VAL C 1 10 ARG N 34.38 134.38 122.58 122.58 122.58 . . 0 "[ ]" 17 . 1 9 VAL C 1 10 ARG N 1 10 ARG CA 1 10 ARG C -166.33 -70.73 -86.96 -86.96 -86.96 . . 0 "[ ]" 18 . 1 10 ARG N 1 10 ARG CA 1 10 ARG C 1 11 ASP N 90.44 -169.56 95.76 95.76 95.76 . . 0 "[ ]" 19 . 1 10 ARG C 1 11 ASP N 1 11 ASP CA 1 11 ASP C -137.26 -40.46 -94.50 -94.50 -94.50 . . 0 "[ ]" 20 . 1 11 ASP N 1 11 ASP CA 1 11 ASP C 1 12 ASP N 60.73 160.73 162.87 162.87 162.87 2.14 1 0 "[ ]" 21 . 1 11 ASP C 1 12 ASP N 1 12 ASP CA 1 12 ASP C 24.21 84.21 86.17 86.17 86.17 1.96 1 0 "[ ]" 22 . 1 12 ASP N 1 12 ASP CA 1 12 ASP C 1 13 LEU N -25.30 74.70 60.48 60.48 60.48 . . 0 "[ ]" 23 . 1 12 ASP C 1 13 LEU N 1 13 LEU CA 1 13 LEU C -130.18 -68.78 -95.11 -95.11 -95.11 . . 0 "[ ]" 24 . 1 13 LEU N 1 13 LEU CA 1 13 LEU C 1 14 LYS N -1.25 98.75 104.18 104.18 104.18 5.43 1 1 [+] 25 . 1 13 LEU C 1 14 LYS N 1 14 LYS CA 1 14 LYS C -103.53 -43.53 -41.26 -41.26 -41.26 2.27 1 0 "[ ]" 26 . 1 14 LYS N 1 14 LYS CA 1 14 LYS C 1 15 LEU N -61.46 38.54 -20.68 -20.68 -20.68 . . 0 "[ ]" 27 . 1 14 LYS C 1 15 LEU N 1 15 LEU CA 1 15 LEU C -147.47 -48.47 -84.34 -84.34 -84.34 . . 0 "[ ]" 28 . 1 15 LEU N 1 15 LEU CA 1 15 LEU C 1 16 SER N 60.95 160.95 161.74 161.74 161.74 0.79 1 0 "[ ]" 29 . 1 15 LEU C 1 16 SER N 1 16 SER CA 1 16 SER C -110.52 -50.52 -49.41 -49.41 -49.41 1.11 1 0 "[ ]" 30 . 1 16 SER N 1 16 SER CA 1 16 SER C 1 17 ARG N 115.39 -144.61 117.74 117.74 117.74 . . 0 "[ ]" 31 . 1 16 SER C 1 17 ARG N 1 17 ARG CA 1 17 ARG C -85.35 -25.35 -87.01 -87.01 -87.01 1.66 1 0 "[ ]" 32 . 1 17 ARG N 1 17 ARG CA 1 17 ARG C 1 18 GLY N -90.43 9.57 11.19 11.19 11.19 1.62 1 0 "[ ]" 33 . 1 17 ARG C 1 18 GLY N 1 18 GLY CA 1 18 GLY C -95.49 -35.49 -76.27 -76.27 -76.27 . . 0 "[ ]" 34 . 1 18 GLY N 1 18 GLY CA 1 18 GLY C 1 19 LYS N -88.59 11.41 -75.04 -75.04 -75.04 . . 0 "[ ]" 35 . 1 18 GLY C 1 19 LYS N 1 19 LYS CA 1 19 LYS C -94.49 -34.49 -70.23 -70.23 -70.23 . . 0 "[ ]" 36 . 1 19 LYS N 1 19 LYS CA 1 19 LYS C 1 20 LEU N -89.53 10.47 -35.19 -35.19 -35.19 . . 0 "[ ]" 37 . 1 19 LYS C 1 20 LEU N 1 20 LEU CA 1 20 LEU C -91.42 -31.42 -60.97 -60.97 -60.97 . . 0 "[ ]" 38 . 1 20 LEU N 1 20 LEU CA 1 20 LEU C 1 21 ALA N -93.25 6.75 -40.60 -40.60 -40.60 . . 0 "[ ]" 39 . 1 20 LEU C 1 21 ALA N 1 21 ALA CA 1 21 ALA C -93.32 -33.32 -66.02 -66.02 -66.02 . . 0 "[ ]" 40 . 1 21 ALA N 1 21 ALA CA 1 21 ALA C 1 22 VAL N -93.35 6.65 -34.66 -34.66 -34.66 . . 0 "[ ]" 41 . 1 21 ALA C 1 22 VAL N 1 22 VAL CA 1 22 VAL C -92.75 -32.75 -65.85 -65.85 -65.85 . . 0 "[ ]" 42 . 1 22 VAL N 1 22 VAL CA 1 22 VAL C 1 23 GLN N -52.61 -33.81 -52.98 -52.98 -52.98 0.37 1 0 "[ ]" 43 . 1 22 VAL C 1 23 GLN N 1 23 GLN CA 1 23 GLN C -91.30 -31.30 -60.52 -60.52 -60.52 . . 0 "[ ]" 44 . 1 23 GLN N 1 23 GLN CA 1 23 GLN C 1 24 VAL N -85.90 14.10 -43.86 -43.86 -43.86 . . 0 "[ ]" 45 . 1 23 GLN C 1 24 VAL N 1 24 VAL CA 1 24 VAL C -97.38 -37.38 -63.37 -63.37 -63.37 . . 0 "[ ]" 46 . 1 24 VAL N 1 24 VAL CA 1 24 VAL C 1 25 ALA N -90.26 9.74 -41.09 -41.09 -41.09 . . 0 "[ ]" 47 . 1 24 VAL C 1 25 ALA N 1 25 ALA CA 1 25 ALA C -91.36 -31.36 -58.17 -58.17 -58.17 . . 0 "[ ]" 48 . 1 25 ALA N 1 25 ALA CA 1 25 ALA C 1 26 HIS N -91.04 8.96 -43.23 -43.23 -43.23 . . 0 "[ ]" 49 . 1 25 ALA C 1 26 HIS N 1 26 HIS CA 1 26 HIS C -92.76 -32.76 -64.89 -64.89 -64.89 . . 0 "[ ]" 50 . 1 26 HIS N 1 26 HIS CA 1 26 HIS C 1 27 ALA N -93.13 6.87 -49.14 -49.14 -49.14 . . 0 "[ ]" 51 . 1 26 HIS C 1 27 ALA N 1 27 ALA CA 1 27 ALA C -91.84 -31.84 -62.51 -62.51 -62.51 . . 0 "[ ]" 52 . 1 27 ALA N 1 27 ALA CA 1 27 ALA C 1 28 ALA N -91.57 8.43 -33.72 -33.72 -33.72 . . 0 "[ ]" 53 . 1 27 ALA C 1 28 ALA N 1 28 ALA CA 1 28 ALA C -94.34 -34.34 -57.86 -57.86 -57.86 . . 0 "[ ]" 54 . 1 28 ALA N 1 28 ALA CA 1 28 ALA C 1 29 ILE N -91.24 8.76 -37.12 -37.12 -37.12 . . 0 "[ ]" 55 . 1 28 ALA C 1 29 ILE N 1 29 ILE CA 1 29 ILE C -100.53 -40.53 -71.86 -71.86 -71.86 . . 0 "[ ]" 56 . 1 29 ILE N 1 29 ILE CA 1 29 ILE C 1 30 ILE N -92.75 7.25 -47.58 -47.58 -47.58 . . 0 "[ ]" 57 . 1 29 ILE C 1 30 ILE N 1 30 ILE CA 1 30 ILE C -95.43 -35.43 -60.95 -60.95 -60.95 . . 0 "[ ]" 58 . 1 30 ILE N 1 30 ILE CA 1 30 ILE C 1 31 GLY N -95.14 4.86 -41.30 -41.30 -41.30 . . 0 "[ ]" 59 . 1 30 ILE C 1 31 GLY N 1 31 GLY CA 1 31 GLY C -95.09 -35.09 -66.77 -66.77 -66.77 . . 0 "[ ]" 60 . 1 31 GLY N 1 31 GLY CA 1 31 GLY C 1 32 TYR N -86.27 13.73 -45.61 -45.61 -45.61 . . 0 "[ ]" 61 . 1 31 GLY C 1 32 TYR N 1 32 TYR CA 1 32 TYR C -91.65 -31.65 -62.08 -62.08 -62.08 . . 0 "[ ]" 62 . 1 32 TYR N 1 32 TYR CA 1 32 TYR C 1 33 LEU N -92.93 7.07 -50.21 -50.21 -50.21 . . 0 "[ ]" 63 . 1 32 TYR C 1 33 LEU N 1 33 LEU CA 1 33 LEU C -90.20 -30.20 -61.13 -61.13 -61.13 . . 0 "[ ]" 64 . 1 33 LEU N 1 33 LEU CA 1 33 LEU C 1 34 LYS N -93.21 6.79 -33.71 -33.71 -33.71 . . 0 "[ ]" 65 . 1 33 LEU C 1 34 LYS N 1 34 LYS CA 1 34 LYS C -108.10 -48.10 -56.82 -56.82 -56.82 . . 0 "[ ]" 66 . 1 34 LYS N 1 34 LYS CA 1 34 LYS C 1 35 SER N -86.48 13.52 -47.14 -47.14 -47.14 . . 0 "[ ]" 67 . 1 34 LYS C 1 35 SER N 1 35 SER CA 1 35 SER C -120.84 -60.84 -89.23 -89.23 -89.23 . . 0 "[ ]" 68 . 1 35 SER N 1 35 SER CA 1 35 SER C 1 36 ASP N -72.11 27.89 -40.40 -40.40 -40.40 . . 0 "[ ]" 69 . 1 35 SER C 1 36 ASP N 1 36 ASP CA 1 36 ASP C -117.89 -57.89 -63.08 -63.08 -63.08 . . 0 "[ ]" 70 . 1 36 ASP N 1 36 ASP CA 1 36 ASP C 1 37 SER N -64.01 35.99 -15.98 -15.98 -15.98 . . 0 "[ ]" 71 . 1 36 ASP C 1 37 SER N 1 37 SER CA 1 37 SER C -89.44 -29.44 -47.51 -47.51 -47.51 . . 0 "[ ]" 72 . 1 37 SER N 1 37 SER CA 1 37 SER C 1 38 SER N -83.97 16.03 -85.27 -85.27 -85.27 1.30 1 0 "[ ]" 73 . 1 37 SER C 1 38 SER N 1 38 SER CA 1 38 SER C -95.90 -35.90 -98.06 -98.06 -98.06 2.16 1 0 "[ ]" 74 . 1 38 SER N 1 38 SER CA 1 38 SER C 1 39 LEU N -88.49 11.51 -18.86 -18.86 -18.86 . . 0 "[ ]" 75 . 1 38 SER C 1 39 LEU N 1 39 LEU CA 1 39 LEU C -95.08 -35.08 -71.25 -71.25 -71.25 . . 0 "[ ]" 76 . 1 39 LEU N 1 39 LEU CA 1 39 LEU C 1 40 ARG N -94.49 5.51 -44.10 -44.10 -44.10 . . 0 "[ ]" 77 . 1 39 LEU C 1 40 ARG N 1 40 ARG CA 1 40 ARG C -94.15 -34.15 -65.88 -65.88 -65.88 . . 0 "[ ]" 78 . 1 40 ARG N 1 40 ARG CA 1 40 ARG C 1 41 ARG N -88.81 11.19 -41.18 -41.18 -41.18 . . 0 "[ ]" 79 . 1 40 ARG C 1 41 ARG N 1 41 ARG CA 1 41 ARG C -96.04 -36.04 -60.68 -60.68 -60.68 . . 0 "[ ]" 80 . 1 41 ARG N 1 41 ARG CA 1 41 ARG C 1 42 LYS N -90.34 9.66 -23.55 -23.55 -23.55 . . 0 "[ ]" 81 . 1 41 ARG C 1 42 LYS N 1 42 LYS CA 1 42 LYS C -92.45 -32.45 -67.63 -67.63 -67.63 . . 0 "[ ]" 82 . 1 42 LYS N 1 42 LYS CA 1 42 LYS C 1 43 TRP N -92.43 7.57 -72.03 -72.03 -72.03 . . 0 "[ ]" 83 . 1 42 LYS C 1 43 TRP N 1 43 TRP CA 1 43 TRP C -96.90 -36.90 -99.72 -99.72 -99.72 2.82 1 0 "[ ]" 84 . 1 43 TRP N 1 43 TRP CA 1 43 TRP C 1 44 LEU N -91.30 8.70 -43.31 -43.31 -43.31 . . 0 "[ ]" 85 . 1 43 TRP C 1 44 LEU N 1 44 LEU CA 1 44 LEU C -93.97 -33.97 -57.32 -57.32 -57.32 . . 0 "[ ]" 86 . 1 44 LEU N 1 44 LEU CA 1 44 LEU C 1 45 ASP N -90.33 9.67 -11.07 -11.07 -11.07 . . 0 "[ ]" 87 . 1 44 LEU C 1 45 ASP N 1 45 ASP CA 1 45 ASP C -95.52 -35.52 -39.10 -39.10 -39.10 . . 0 "[ ]" 88 . 1 45 ASP N 1 45 ASP CA 1 45 ASP C 1 46 GLU N -88.18 11.82 -34.05 -34.05 -34.05 . . 0 "[ ]" 89 . 1 45 ASP C 1 46 GLU N 1 46 GLU CA 1 46 GLU C -115.51 -55.51 -67.48 -67.48 -67.48 . . 0 "[ ]" 90 . 1 46 GLU N 1 46 GLU CA 1 46 GLU C 1 47 GLY N -49.58 50.42 -43.86 -43.86 -43.86 . . 0 "[ ]" 91 . 1 46 GLU C 1 47 GLY N 1 47 GLY CA 1 47 GLY C 57.62 117.62 73.02 73.02 73.02 . . 0 "[ ]" 92 . 1 47 GLY N 1 47 GLY CA 1 47 GLY C 1 48 GLN N 3.05 21.25 21.39 21.39 21.39 0.14 1 0 "[ ]" 93 . 1 47 GLY C 1 48 GLN N 1 48 GLN CA 1 48 GLN C -155.20 -95.20 -103.83 -103.83 -103.83 . . 0 "[ ]" 94 . 1 48 GLN N 1 48 GLN CA 1 48 GLN C 1 49 LYS N -47.79 52.21 -7.42 -7.42 -7.42 . . 0 "[ ]" 95 . 1 48 GLN C 1 49 LYS N 1 49 LYS CA 1 49 LYS C -122.00 -51.60 -122.12 -122.12 -122.12 0.12 1 0 "[ ]" 96 . 1 49 LYS N 1 49 LYS CA 1 49 LYS C 1 50 LYS N 37.07 137.07 36.39 36.39 36.39 0.68 1 0 "[ ]" 97 . 1 49 LYS C 1 50 LYS N 1 50 LYS CA 1 50 LYS C -152.98 -92.98 -99.66 -99.66 -99.66 . . 0 "[ ]" 98 . 1 50 LYS N 1 50 LYS CA 1 50 LYS C 1 51 VAL N 86.92 -157.88 116.27 116.27 116.27 . . 0 "[ ]" 99 . 1 50 LYS C 1 51 VAL N 1 51 VAL CA 1 51 VAL C -168.11 -108.11 -145.54 -145.54 -145.54 . . 0 "[ ]" 100 . 1 51 VAL N 1 51 VAL CA 1 51 VAL C 1 52 VAL N 92.56 -167.44 159.90 159.90 159.90 . . 0 "[ ]" 101 . 1 51 VAL C 1 52 VAL N 1 52 VAL CA 1 52 VAL C -137.72 -77.72 -124.71 -124.71 -124.71 . . 0 "[ ]" 102 . 1 52 VAL N 1 52 VAL CA 1 52 VAL C 1 53 LEU N 74.06 174.06 130.91 130.91 130.91 . . 0 "[ ]" 103 . 1 52 VAL C 1 53 LEU N 1 53 LEU CA 1 53 LEU C -155.67 -95.67 -127.73 -127.73 -127.73 . . 0 "[ ]" 104 . 1 53 LEU N 1 53 LEU CA 1 53 LEU C 1 54 LYS N 96.94 -163.06 175.97 175.97 175.97 . . 0 "[ ]" 105 . 1 53 LEU C 1 54 LYS N 1 54 LYS CA 1 54 LYS C -153.92 -93.92 -98.64 -98.64 -98.64 . . 0 "[ ]" 106 . 1 54 LYS N 1 54 LYS CA 1 54 LYS C 1 55 VAL N 99.76 -160.24 160.67 160.67 160.67 . . 0 "[ ]" 107 . 1 54 LYS C 1 55 VAL N 1 55 VAL CA 1 55 VAL C -169.39 -93.19 -95.24 -95.24 -95.24 . . 0 "[ ]" 108 . 1 55 VAL N 1 55 VAL CA 1 55 VAL C 1 56 LYS N 108.18 -151.82 144.27 144.27 144.27 . . 0 "[ ]" 109 . 1 55 VAL C 1 56 LYS N 1 56 LYS CA 1 56 LYS C -117.32 -57.32 -80.14 -80.14 -80.14 . . 0 "[ ]" 110 . 1 56 LYS N 1 56 LYS CA 1 56 LYS C 1 57 SER N -77.87 22.13 -45.87 -45.87 -45.87 . . 0 "[ ]" 111 . 1 56 LYS C 1 57 SER N 1 57 SER CA 1 57 SER C -170.29 -110.29 -158.27 -158.27 -158.27 . . 0 "[ ]" 112 . 1 57 SER N 1 57 SER CA 1 57 SER C 1 58 LEU N 105.11 -154.89 143.78 143.78 143.78 . . 0 "[ ]" 113 . 1 57 SER C 1 58 LEU N 1 58 LEU CA 1 58 LEU C -102.27 -42.27 -56.14 -56.14 -56.14 . . 0 "[ ]" 114 . 1 58 LEU N 1 58 LEU CA 1 58 LEU C 1 59 GLU N -84.70 27.90 -41.91 -41.91 -41.91 . . 0 "[ ]" 115 . 1 58 LEU C 1 59 GLU N 1 59 GLU CA 1 59 GLU C -96.07 -36.07 -63.26 -63.26 -63.26 . . 0 "[ ]" 116 . 1 59 GLU N 1 59 GLU CA 1 59 GLU C 1 60 GLU N -89.30 10.70 -43.68 -43.68 -43.68 . . 0 "[ ]" 117 . 1 59 GLU C 1 60 GLU N 1 60 GLU CA 1 60 GLU C -95.73 -35.73 -65.52 -65.52 -65.52 . . 0 "[ ]" 118 . 1 60 GLU N 1 60 GLU CA 1 60 GLU C 1 61 LEU N -89.67 10.33 -38.54 -38.54 -38.54 . . 0 "[ ]" 119 . 1 60 GLU C 1 61 LEU N 1 61 LEU CA 1 61 LEU C -92.26 -32.26 -67.84 -67.84 -67.84 . . 0 "[ ]" 120 . 1 61 LEU N 1 61 LEU CA 1 61 LEU C 1 62 LEU N -95.29 4.71 -51.63 -51.63 -51.63 . . 0 "[ ]" 121 . 1 61 LEU C 1 62 LEU N 1 62 LEU CA 1 62 LEU C -90.50 -30.50 -58.02 -58.02 -58.02 . . 0 "[ ]" 122 . 1 62 LEU N 1 62 LEU CA 1 62 LEU C 1 63 GLY N -87.08 12.92 -33.29 -33.29 -33.29 . . 0 "[ ]" 123 . 1 62 LEU C 1 63 GLY N 1 63 GLY CA 1 63 GLY C -95.34 -35.34 -74.82 -74.82 -74.82 . . 0 "[ ]" 124 . 1 63 GLY N 1 63 GLY CA 1 63 GLY C 1 64 ILE N -93.79 6.21 -50.22 -50.22 -50.22 . . 0 "[ ]" 125 . 1 63 GLY C 1 64 ILE N 1 64 ILE CA 1 64 ILE C -94.28 -34.28 -71.97 -71.97 -71.97 . . 0 "[ ]" 126 . 1 64 ILE N 1 64 ILE CA 1 64 ILE C 1 65 LYS N -88.30 11.70 -37.80 -37.80 -37.80 . . 0 "[ ]" 127 . 1 64 ILE C 1 65 LYS N 1 65 LYS CA 1 65 LYS C -91.32 -31.32 -57.89 -57.89 -57.89 . . 0 "[ ]" 128 . 1 65 LYS N 1 65 LYS CA 1 65 LYS C 1 66 HIS N -92.14 7.86 -37.79 -37.79 -37.79 . . 0 "[ ]" 129 . 1 65 LYS C 1 66 HIS N 1 66 HIS CA 1 66 HIS C -96.84 -36.84 -65.91 -65.91 -65.91 . . 0 "[ ]" 130 . 1 66 HIS N 1 66 HIS CA 1 66 HIS C 1 67 LYS N -88.76 11.24 -40.76 -40.76 -40.76 . . 0 "[ ]" 131 . 1 66 HIS C 1 67 LYS N 1 67 LYS CA 1 67 LYS C -92.42 -32.42 -61.19 -61.19 -61.19 . . 0 "[ ]" 132 . 1 67 LYS N 1 67 LYS CA 1 67 LYS C 1 68 ALA N -88.83 11.17 -42.90 -42.90 -42.90 . . 0 "[ ]" 133 . 1 67 LYS C 1 68 ALA N 1 68 ALA CA 1 68 ALA C -94.42 -34.42 -64.64 -64.64 -64.64 . . 0 "[ ]" 134 . 1 68 ALA N 1 68 ALA CA 1 68 ALA C 1 69 GLU N -87.11 12.89 -46.76 -46.76 -46.76 . . 0 "[ ]" 135 . 1 68 ALA C 1 69 GLU N 1 69 GLU CA 1 69 GLU C -96.30 -36.30 -60.30 -60.30 -60.30 . . 0 "[ ]" 136 . 1 69 GLU N 1 69 GLU CA 1 69 GLU C 1 70 SER N -91.05 8.95 -23.35 -23.35 -23.35 . . 0 "[ ]" 137 . 1 69 GLU C 1 70 SER N 1 70 SER CA 1 70 SER C -92.63 -32.63 -58.82 -58.82 -58.82 . . 0 "[ ]" 138 . 1 70 SER N 1 70 SER CA 1 70 SER C 1 71 LEU N -85.36 14.64 -33.31 -33.31 -33.31 . . 0 "[ ]" 139 . 1 70 SER C 1 71 LEU N 1 71 LEU CA 1 71 LEU C -118.07 -58.07 -90.35 -90.35 -90.35 . . 0 "[ ]" 140 . 1 71 LEU N 1 71 LEU CA 1 71 LEU C 1 72 GLY N -44.07 56.33 10.72 10.72 10.72 . . 0 "[ ]" 141 . 1 71 LEU C 1 72 GLY N 1 72 GLY CA 1 72 GLY C 56.05 116.05 88.79 88.79 88.79 . . 0 "[ ]" 142 . 1 72 GLY N 1 72 GLY CA 1 72 GLY C 1 73 LEU N -38.24 70.96 23.39 23.39 23.39 . . 0 "[ ]" 143 . 1 72 GLY C 1 73 LEU N 1 73 LEU CA 1 73 LEU C -119.61 -59.61 -88.21 -88.21 -88.21 . . 0 "[ ]" 144 . 1 73 LEU N 1 73 LEU CA 1 73 LEU C 1 74 VAL N 43.71 -142.09 139.67 139.67 139.67 . . 0 "[ ]" 145 . 1 73 LEU C 1 74 VAL N 1 74 VAL CA 1 74 VAL C -109.75 -49.75 -76.33 -76.33 -76.33 . . 0 "[ ]" 146 . 1 74 VAL N 1 74 VAL CA 1 74 VAL C 1 75 THR N 67.87 176.67 105.34 105.34 105.34 . . 0 "[ ]" 147 . 1 74 VAL C 1 75 THR N 1 75 THR CA 1 75 THR C -160.01 -99.01 -138.15 -138.15 -138.15 . . 0 "[ ]" 148 . 1 75 THR N 1 75 THR CA 1 75 THR C 1 76 GLY N 108.69 -151.31 150.65 150.65 150.65 . . 0 "[ ]" 149 . 1 75 THR C 1 76 GLY N 1 76 GLY CA 1 76 GLY C -169.72 -109.72 -170.70 -170.70 -170.70 0.98 1 0 "[ ]" 150 . 1 76 GLY N 1 76 GLY CA 1 76 GLY C 1 77 LEU N 86.82 -145.58 147.13 147.13 147.13 . . 0 "[ ]" 151 . 1 76 GLY C 1 77 LEU N 1 77 LEU CA 1 77 LEU C -143.35 -83.35 -83.79 -83.79 -83.79 . . 0 "[ ]" 152 . 1 77 LEU N 1 77 LEU CA 1 77 LEU C 1 78 VAL N 90.01 -148.19 115.99 115.99 115.99 . . 0 "[ ]" 153 . 1 77 LEU C 1 78 VAL N 1 78 VAL CA 1 78 VAL C -131.13 -71.13 -88.32 -88.32 -88.32 . . 0 "[ ]" 154 . 1 78 VAL N 1 78 VAL CA 1 78 VAL C 1 79 GLN N 76.55 176.55 125.66 125.66 125.66 . . 0 "[ ]" 155 . 1 78 VAL C 1 79 GLN N 1 79 GLN CA 1 79 GLN C -140.96 -80.96 -141.51 -141.51 -141.51 0.55 1 0 "[ ]" 156 . 1 79 GLN N 1 79 GLN CA 1 79 GLN C 1 80 ASP N 91.71 -168.29 -167.78 -167.78 -167.78 0.51 1 0 "[ ]" 157 . 1 79 GLN C 1 80 ASP N 1 80 ASP CA 1 80 ASP C -149.53 -54.53 -54.20 -54.20 -54.20 0.33 1 0 "[ ]" 158 . 1 80 ASP N 1 80 ASP CA 1 80 ASP C 1 81 ALA N 75.09 175.09 90.80 90.80 90.80 . . 0 "[ ]" 159 . 1 80 ASP C 1 81 ALA N 1 81 ALA CA 1 81 ALA C -92.59 -32.59 -64.24 -64.24 -64.24 . . 0 "[ ]" 160 . 1 81 ALA N 1 81 ALA CA 1 81 ALA C 1 82 GLY N -79.74 20.26 -35.53 -35.53 -35.53 . . 0 "[ ]" 161 . 1 81 ALA C 1 82 GLY N 1 82 GLY CA 1 82 GLY C -110.20 -50.20 -53.37 -53.37 -53.37 . . 0 "[ ]" 162 . 1 82 GLY N 1 82 GLY CA 1 82 GLY C 1 83 LEU N -76.74 51.46 -34.67 -34.67 -34.67 . . 0 "[ ]" 163 . 1 82 GLY C 1 83 LEU N 1 83 LEU CA 1 83 LEU C -110.08 -47.68 -96.35 -96.35 -96.35 . . 0 "[ ]" 164 . 1 83 LEU N 1 83 LEU CA 1 83 LEU C 1 84 THR N 89.08 -170.92 171.97 171.97 171.97 . . 0 "[ ]" 165 . 1 88 PRO C 1 89 GLY N 1 89 GLY CA 1 89 GLY C 53.36 113.36 103.07 103.07 103.07 . . 0 "[ ]" 166 . 1 89 GLY N 1 89 GLY CA 1 89 GLY C 1 90 THR N -48.28 51.72 -36.90 -36.90 -36.90 . . 0 "[ ]" 167 . 1 89 GLY C 1 90 THR N 1 90 THR CA 1 90 THR C -108.91 -48.91 -109.20 -109.20 -109.20 0.29 1 0 "[ ]" 168 . 1 90 THR N 1 90 THR CA 1 90 THR C 1 91 ILE N 79.02 179.02 174.84 174.84 174.84 . . 0 "[ ]" 169 . 1 90 THR C 1 91 ILE N 1 91 ILE CA 1 91 ILE C -151.60 -80.00 -77.39 -77.39 -77.39 2.61 1 0 "[ ]" 170 . 1 91 ILE N 1 91 ILE CA 1 91 ILE C 1 92 THR N 40.71 -150.89 178.34 178.34 178.34 . . 0 "[ ]" 171 . 1 91 ILE C 1 92 THR N 1 92 THR CA 1 92 THR C -161.11 -85.51 -111.90 -111.90 -111.90 . . 0 "[ ]" 172 . 1 92 THR N 1 92 THR CA 1 92 THR C 1 93 ALA N -11.25 88.75 92.01 92.01 92.01 3.26 1 0 "[ ]" 173 . 1 92 THR C 1 93 ALA N 1 93 ALA CA 1 93 ALA C -156.64 -83.84 -89.43 -89.43 -89.43 . . 0 "[ ]" 174 . 1 93 ALA N 1 93 ALA CA 1 93 ALA C 1 94 VAL N 81.14 -151.66 146.64 146.64 146.64 . . 0 "[ ]" 175 . 1 93 ALA C 1 94 VAL N 1 94 VAL CA 1 94 VAL C -158.31 -98.31 -144.23 -144.23 -144.23 . . 0 "[ ]" 176 . 1 94 VAL N 1 94 VAL CA 1 94 VAL C 1 95 VAL N 96.07 -163.93 145.27 145.27 145.27 . . 0 "[ ]" 177 . 1 94 VAL C 1 95 VAL N 1 95 VAL CA 1 95 VAL C -159.05 -92.45 -114.03 -114.03 -114.03 . . 0 "[ ]" 178 . 1 95 VAL N 1 95 VAL CA 1 95 VAL C 1 96 ILE N 86.74 -173.26 127.66 127.66 127.66 . . 0 "[ ]" 179 . 1 95 VAL C 1 96 ILE N 1 96 ILE CA 1 96 ILE C -147.58 -87.58 -121.73 -121.73 -121.73 . . 0 "[ ]" 180 . 1 96 ILE N 1 96 ILE CA 1 96 ILE C 1 97 GLY N 83.70 -176.30 128.72 128.72 128.72 . . 0 "[ ]" 181 . 1 98 PRO C 1 99 ASP N 1 99 ASP CA 1 99 ASP C -150.03 -67.83 -65.50 -65.50 -65.50 2.33 1 0 "[ ]" 182 . 1 99 ASP N 1 99 ASP CA 1 99 ASP C 1 100 GLU N 92.17 -164.43 177.05 177.05 177.05 . . 0 "[ ]" 183 . 1 99 ASP C 1 100 GLU N 1 100 GLU CA 1 100 GLU C -103.67 -43.67 -96.44 -96.44 -96.44 . . 0 "[ ]" 184 . 1 100 GLU N 1 100 GLU CA 1 100 GLU C 1 101 GLU N 48.80 -149.80 106.22 106.22 106.22 . . 0 "[ ]" 185 . 1 100 GLU C 1 101 GLU N 1 101 GLU CA 1 101 GLU C -87.02 -27.02 -45.20 -45.20 -45.20 . . 0 "[ ]" 186 . 1 101 GLU N 1 101 GLU CA 1 101 GLU C 1 102 ARG N -93.94 6.06 -25.61 -25.61 -25.61 . . 0 "[ ]" 187 . 1 101 GLU C 1 102 ARG N 1 102 ARG CA 1 102 ARG C -91.22 -31.22 -63.35 -63.35 -63.35 . . 0 "[ ]" 188 . 1 102 ARG N 1 102 ARG CA 1 102 ARG C 1 103 LYS N -90.95 9.05 -44.43 -44.43 -44.43 . . 0 "[ ]" 189 . 1 102 ARG C 1 103 LYS N 1 103 LYS CA 1 103 LYS C -94.14 -34.14 -84.20 -84.20 -84.20 . . 0 "[ ]" 190 . 1 103 LYS N 1 103 LYS CA 1 103 LYS C 1 104 ILE N -94.56 5.44 -37.55 -37.55 -37.55 . . 0 "[ ]" 191 . 1 103 LYS C 1 104 ILE N 1 104 ILE CA 1 104 ILE C -93.95 -33.95 -60.62 -60.62 -60.62 . . 0 "[ ]" 192 . 1 104 ILE N 1 104 ILE CA 1 104 ILE C 1 105 ASP N -90.84 9.16 -29.13 -29.13 -29.13 . . 0 "[ ]" 193 . 1 104 ILE C 1 105 ASP N 1 105 ASP CA 1 105 ASP C -90.16 -30.16 -59.30 -59.30 -59.30 . . 0 "[ ]" 194 . 1 105 ASP N 1 105 ASP CA 1 105 ASP C 1 106 LYS N -95.62 4.38 -53.91 -53.91 -53.91 . . 0 "[ ]" 195 . 1 105 ASP C 1 106 LYS N 1 106 LYS CA 1 106 LYS C -94.01 -34.01 -74.89 -74.89 -74.89 . . 0 "[ ]" 196 . 1 106 LYS N 1 106 LYS CA 1 106 LYS C 1 107 VAL N -82.04 17.96 -41.23 -41.23 -41.23 . . 0 "[ ]" 197 . 1 106 LYS C 1 107 VAL N 1 107 VAL CA 1 107 VAL C -105.85 -45.85 -68.31 -68.31 -68.31 . . 0 "[ ]" 198 . 1 107 VAL N 1 107 VAL CA 1 107 VAL C 1 108 THR N -78.34 21.66 -49.69 -49.69 -49.69 . . 0 "[ ]" 199 . 1 107 VAL C 1 108 THR N 1 108 THR CA 1 108 THR C -125.46 -65.46 -95.57 -95.57 -95.57 . . 0 "[ ]" 200 . 1 108 THR N 1 108 THR CA 1 108 THR C 1 109 GLY N -52.59 47.41 -5.64 -5.64 -5.64 . . 0 "[ ]" 201 . 1 108 THR C 1 109 GLY N 1 109 GLY CA 1 109 GLY C 31.96 93.96 62.71 62.71 62.71 . . 0 "[ ]" 202 . 1 109 GLY N 1 109 GLY CA 1 109 GLY C 1 110 ASN N -40.43 89.17 88.35 88.35 88.35 . . 0 "[ ]" 203 . 1 109 GLY C 1 110 ASN N 1 110 ASN CA 1 110 ASN C -123.32 -63.32 -88.54 -88.54 -88.54 . . 0 "[ ]" 204 . 1 110 ASN N 1 110 ASN CA 1 110 ASN C 1 111 LEU N -61.38 38.62 11.15 11.15 11.15 . . 0 "[ ]" 205 . 1 110 ASN C 1 111 LEU N 1 111 LEU CA 1 111 LEU C -124.10 -62.90 -72.69 -72.69 -72.69 . . 0 "[ ]" 206 . 1 111 LEU N 1 111 LEU CA 1 111 LEU C 1 112 PRO N 60.52 -157.28 144.65 144.65 144.65 . . 0 "[ ]" 207 . 1 112 PRO C 1 113 LEU N 1 113 LEU CA 1 113 LEU C -119.45 -59.45 -70.23 -70.23 -70.23 . . 0 "[ ]" 208 . 1 113 LEU N 1 113 LEU CA 1 113 LEU C 1 114 LEU N 69.68 -165.32 137.28 137.28 137.28 . . 0 "[ ]" 209 . 1 113 LEU C 1 114 LEU N 1 114 LEU CA 1 114 LEU C -129.51 -50.91 -75.05 -75.05 -75.05 . . 0 "[ ]" 210 . 1 114 LEU N 1 114 LEU CA 1 114 LEU C 1 115 LYS N 81.75 -178.25 146.00 146.00 146.00 . . 0 "[ ]" 211 . 1 114 LEU C 1 115 LYS N 1 115 LYS CA 1 115 LYS C -124.16 -62.36 -74.10 -74.10 -74.10 . . 0 "[ ]" 212 . 1 115 LYS N 1 115 LYS CA 1 115 LYS C 1 116 LEU N 96.90 -163.10 111.96 111.96 111.96 . . 0 "[ ]" 213 . 1 115 LYS C 1 116 LEU N 1 116 LEU CA 1 116 LEU C -121.79 -29.19 -81.92 -81.92 -81.92 . . 0 "[ ]" 214 . 1 116 LEU N 1 116 LEU CA 1 116 LEU C 1 117 GLU N -102.72 50.08 -10.31 -10.31 -10.31 . . 0 "[ ]" 215 . 1 116 LEU C 1 117 GLU N 1 117 GLU CA 1 117 GLU C -106.51 -46.51 -77.82 -77.82 -77.82 . . 0 "[ ]" 216 . 1 117 GLU N 1 117 GLU CA 1 117 GLU C 1 118 HIS N 94.20 -165.80 -172.92 -172.92 -172.92 . . 0 "[ ]" 217 . 1 117 GLU C 1 118 HIS N 1 118 HIS CA 1 118 HIS C -95.01 -35.01 -81.97 -81.97 -81.97 . . 0 "[ ]" 218 . 1 118 HIS N 1 118 HIS CA 1 118 HIS C 1 119 HIS N 70.05 175.85 108.63 108.63 108.63 . . 0 "[ ]" 219 . 1 118 HIS C 1 119 HIS N 1 119 HIS CA 1 119 HIS C -100.11 -40.11 -80.25 -80.25 -80.25 . . 0 "[ ]" 220 . 1 119 HIS N 1 119 HIS CA 1 119 HIS C 1 120 HIS N -81.52 18.48 -82.03 -82.03 -82.03 0.51 1 0 "[ ]" stop_ save_
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