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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 | cing | stage | program | type | subtype | subsubtype |
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417808 |
2dny ![]() ![]() |
cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2dny save_distance_constraint_statistics_1 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 147 _TA_constraint_stats_list.Viol_count 44 _TA_constraint_stats_list.Viol_total 589.30 _TA_constraint_stats_list.Viol_max 3.25 _TA_constraint_stats_list.Viol_rms 0.12 _TA_constraint_stats_list.Viol_average_all_restraints 0.01 _TA_constraint_stats_list.Viol_average_violations_only 0.67 _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 PHI 1 7 GLY C 1 8 LYS N 1 8 LYS CA 1 8 LYS C -140.00 -20.00 -98.29 -129.37 -133.89 . . 0 "[ . 1 . 2]" 2 PHI 1 8 LYS C 1 9 LEU N 1 9 LEU CA 1 9 LEU C -140.00 -20.00 -93.16 -133.12 -44.80 . . 0 "[ . 1 . 2]" 3 PHI 1 10 LEU C 1 11 ARG N 1 11 ARG CA 1 11 ARG C -140.00 -20.00 -95.74 -74.15 -89.08 . . 0 "[ . 1 . 2]" 4 PHI 1 9 LEU C 1 10 LEU N 1 10 LEU CA 1 10 LEU C -140.00 -20.00 -75.81 -72.04 -77.66 . . 0 "[ . 1 . 2]" 5 PHI 1 11 ARG C 1 12 LYS N 1 12 LYS CA 1 12 LYS C -140.00 -20.00 -85.99 -124.19 -37.37 . . 0 "[ . 1 . 2]" 6 PHI 1 12 LYS C 1 13 GLN N 1 13 GLN CA 1 13 GLN C -140.00 -20.00 -102.15 -95.84 -105.86 . . 0 "[ . 1 . 2]" 7 PHI 1 14 GLU C 1 15 SER N 1 15 SER CA 1 15 SER C -140.00 -20.00 -89.97 -129.60 -53.74 . . 0 "[ . 1 . 2]" 8 PHI 1 16 THR C 1 17 VAL N 1 17 VAL CA 1 17 VAL C -148.00 -88.00 -110.50 -115.75 -118.28 . . 0 "[ . 1 . 2]" 9 PSI 1 17 VAL N 1 17 VAL CA 1 17 VAL C 1 18 MET N 97.00 157.00 111.53 125.85 116.69 . . 0 "[ . 1 . 2]" 10 PHI 1 17 VAL C 1 18 MET N 1 18 MET CA 1 18 MET C -153.00 -93.00 -102.63 -121.72 -92.96 0.04 1 0 "[ . 1 . 2]" 11 PSI 1 18 MET N 1 18 MET CA 1 18 MET C 1 19 VAL N 108.00 168.00 147.66 151.77 143.06 . . 0 "[ . 1 . 2]" 12 PHI 1 18 MET C 1 19 VAL N 1 19 VAL CA 1 19 VAL C -158.00 -98.00 -123.88 -137.62 -107.48 . . 0 "[ . 1 . 2]" 13 PSI 1 19 VAL N 1 19 VAL CA 1 19 VAL C 1 20 LEU N 111.00 171.00 129.06 115.44 111.80 . . 0 "[ . 1 . 2]" 14 PHI 1 19 VAL C 1 20 LEU N 1 20 LEU CA 1 20 LEU C -148.00 -88.00 -104.27 -115.93 -88.38 . . 0 "[ . 1 . 2]" 15 PSI 1 20 LEU N 1 20 LEU CA 1 20 LEU C 1 21 ARG N 103.00 163.00 135.02 126.12 145.35 . . 0 "[ . 1 . 2]" 16 PHI 1 20 LEU C 1 21 ARG N 1 21 ARG CA 1 21 ARG C -150.00 -90.00 -129.11 -133.74 -134.59 . . 0 "[ . 1 . 2]" 17 PSI 1 21 ARG N 1 21 ARG CA 1 21 ARG C 1 22 ASN N 120.00 180.00 152.20 134.38 175.82 . . 0 "[ . 1 . 2]" 18 PSI 1 28 ASP N 1 28 ASP CA 1 28 ASP C 1 29 ILE N -40.00 20.00 -1.08 4.07 -11.28 . . 0 "[ . 1 . 2]" 19 PHI 1 31 ASP C 1 32 ASP N 1 32 ASP CA 1 32 ASP C -113.00 -53.00 -68.09 -64.75 -69.13 . . 0 "[ . 1 . 2]" 20 PSI 1 32 ASP N 1 32 ASP CA 1 32 ASP C 1 33 LEU N -44.00 16.00 -40.30 -41.72 -42.62 . . 0 "[ . 1 . 2]" 21 PHI 1 32 ASP C 1 33 LEU N 1 33 LEU CA 1 33 LEU C -96.00 -36.00 -48.62 -43.03 -43.40 . . 0 "[ . 1 . 2]" 22 PSI 1 33 LEU N 1 33 LEU CA 1 33 LEU C 1 34 GLU N -72.00 -12.00 -58.12 -59.72 -61.01 . . 0 "[ . 1 . 2]" 23 PHI 1 33 LEU C 1 34 GLU N 1 34 GLU CA 1 34 GLU C -93.00 -33.00 -37.88 -42.50 -34.64 . . 0 "[ . 1 . 2]" 24 PSI 1 34 GLU N 1 34 GLU CA 1 34 GLU C 1 35 GLY N -70.00 -10.00 -53.40 -58.82 -43.58 . . 0 "[ . 1 . 2]" 25 PHI 1 34 GLU C 1 35 GLY N 1 35 GLY CA 1 35 GLY C -97.00 -37.00 -60.93 -54.83 -57.96 . . 0 "[ . 1 . 2]" 26 PSI 1 35 GLY N 1 35 GLY CA 1 35 GLY C 1 36 GLU N -72.00 -12.00 -45.13 -45.21 -45.34 . . 0 "[ . 1 . 2]" 27 PHI 1 35 GLY C 1 36 GLU N 1 36 GLU CA 1 36 GLU C -97.00 -37.00 -52.92 -54.55 -55.89 . . 0 "[ . 1 . 2]" 28 PSI 1 36 GLU N 1 36 GLU CA 1 36 GLU C 1 37 VAL N -68.00 -8.00 -49.39 -60.71 -37.54 . . 0 "[ . 1 . 2]" 29 PHI 1 36 GLU C 1 37 VAL N 1 37 VAL CA 1 37 VAL C -94.00 -34.00 -63.08 -55.68 -59.06 . . 0 "[ . 1 . 2]" 30 PSI 1 37 VAL N 1 37 VAL CA 1 37 VAL C 1 38 THR N -73.00 -13.00 -40.70 -45.34 -32.99 . . 0 "[ . 1 . 2]" 31 PHI 1 37 VAL C 1 38 THR N 1 38 THR CA 1 38 THR C -91.00 -31.00 -59.47 -64.56 -66.42 . . 0 "[ . 1 . 2]" 32 PSI 1 38 THR N 1 38 THR CA 1 38 THR C 1 39 GLU N -72.00 -12.00 -47.37 -59.34 -32.61 . . 0 "[ . 1 . 2]" 33 PHI 1 38 THR C 1 39 GLU N 1 39 GLU CA 1 39 GLU C -95.00 -35.00 -67.47 -80.61 -56.10 . . 0 "[ . 1 . 2]" 34 PSI 1 39 GLU N 1 39 GLU CA 1 39 GLU C 1 40 GLU N -72.00 -12.00 -40.82 -17.10 -23.87 . . 0 "[ . 1 . 2]" 35 PHI 1 39 GLU C 1 40 GLU N 1 40 GLU CA 1 40 GLU C -94.00 -34.00 -60.74 -82.45 -40.10 . . 0 "[ . 1 . 2]" 36 PSI 1 40 GLU N 1 40 GLU CA 1 40 GLU C 1 41 CYS N -76.00 -16.00 -41.61 -61.55 -23.76 . . 0 "[ . 1 . 2]" 37 PHI 1 40 GLU C 1 41 CYS N 1 41 CYS CA 1 41 CYS C -99.00 -39.00 -69.54 -75.99 -76.51 . . 0 "[ . 1 . 2]" 38 PSI 1 41 CYS N 1 41 CYS CA 1 41 CYS C 1 42 GLY N -59.00 1.00 -33.00 -53.26 -2.54 . . 0 "[ . 1 . 2]" 39 PHI 1 45 GLY C 1 46 ALA N 1 46 ALA CA 1 46 ALA C -106.00 -46.00 -78.44 -78.46 -79.18 . . 0 "[ . 1 . 2]" 40 PSI 1 46 ALA N 1 46 ALA CA 1 46 ALA C 1 47 VAL N 109.00 169.00 112.26 110.00 109.96 . . 0 "[ . 1 . 2]" 41 PHI 1 46 ALA C 1 47 VAL N 1 47 VAL CA 1 47 VAL C -111.00 -51.00 -70.39 -68.20 -69.73 . . 0 "[ . 1 . 2]" 42 PSI 1 47 VAL N 1 47 VAL CA 1 47 VAL C 1 48 ASN N 100.00 160.00 126.66 129.73 126.11 . . 0 "[ . 1 . 2]" 43 PHI 1 47 VAL C 1 48 ASN N 1 48 ASN CA 1 48 ASN C -134.00 -74.00 -86.97 -108.23 -75.86 . . 0 "[ . 1 . 2]" 44 PSI 1 48 ASN N 1 48 ASN CA 1 48 ASN C 1 49 ARG N -62.00 -2.00 -55.19 -62.00 -46.98 0.00 20 0 "[ . 1 . 2]" 45 PHI 1 48 ASN C 1 49 ARG N 1 49 ARG CA 1 49 ARG C 176.00 -124.00 -159.78 -165.93 -167.29 . . 0 "[ . 1 . 2]" 46 PSI 1 49 ARG N 1 49 ARG CA 1 49 ARG C 1 50 VAL N 117.00 177.00 161.29 150.17 173.69 . . 0 "[ . 1 . 2]" 47 PHI 1 49 ARG C 1 50 VAL N 1 50 VAL CA 1 50 VAL C -153.00 -93.00 -137.90 -146.24 -126.03 . . 0 "[ . 1 . 2]" 48 PSI 1 50 VAL N 1 50 VAL CA 1 50 VAL C 1 51 ILE N 112.00 172.00 131.67 112.03 147.53 . . 0 "[ . 1 . 2]" 49 PHI 1 50 VAL C 1 51 ILE N 1 51 ILE CA 1 51 ILE C -163.00 -103.00 -130.00 -130.05 -131.74 . . 0 "[ . 1 . 2]" 50 PSI 1 51 ILE N 1 51 ILE CA 1 51 ILE C 1 52 ILE N 109.00 169.00 133.69 126.90 125.93 . . 0 "[ . 1 . 2]" 51 PHI 1 51 ILE C 1 52 ILE N 1 52 ILE CA 1 52 ILE C -127.00 -67.00 -111.23 -100.98 -104.69 . . 0 "[ . 1 . 2]" 52 PSI 1 52 ILE N 1 52 ILE CA 1 52 ILE C 1 53 TYR N 92.00 152.00 103.84 92.00 113.52 0.00 10 0 "[ . 1 . 2]" 53 PHI 1 52 ILE C 1 53 TYR N 1 53 TYR CA 1 53 TYR C -148.00 -88.00 -108.38 -111.53 -115.74 . . 0 "[ . 1 . 2]" 54 PSI 1 53 TYR N 1 53 TYR CA 1 53 TYR C 1 54 GLN N 101.00 161.00 137.08 122.58 153.37 . . 0 "[ . 1 . 2]" 55 PHI 1 53 TYR C 1 54 GLN N 1 54 GLN CA 1 54 GLN C -147.00 -87.00 -141.93 -131.35 -136.99 . . 0 "[ . 1 . 2]" 56 PSI 1 54 GLN N 1 54 GLN CA 1 54 GLN C 1 55 GLU N 106.00 166.00 137.80 106.89 162.27 . . 0 "[ . 1 . 2]" 57 PSI 1 58 GLY N 1 58 GLY CA 1 58 GLY C 1 59 GLU N 90.00 180.00 131.38 109.39 151.82 . . 0 "[ . 1 . 2]" 58 PHI 1 58 GLY C 1 59 GLU N 1 59 GLU CA 1 59 GLU C -140.00 -20.00 -56.25 -57.66 -64.67 . . 0 "[ . 1 . 2]" 59 PHI 1 63 ALA C 1 64 GLU N 1 64 GLU CA 1 64 GLU C -130.00 -70.00 -79.19 -101.34 -70.94 . . 0 "[ . 1 . 2]" 60 PSI 1 64 GLU N 1 64 GLU CA 1 64 GLU C 1 65 ILE N 98.00 158.00 148.96 142.02 157.69 . . 0 "[ . 1 . 2]" 61 PHI 1 67 VAL C 1 68 LYS N 1 68 LYS CA 1 68 LYS C -151.00 -91.00 -104.40 -99.91 -101.06 . . 0 "[ . 1 . 2]" 62 PSI 1 68 LYS N 1 68 LYS CA 1 68 LYS C 1 69 ILE N 104.00 164.00 114.17 110.60 110.08 . . 0 "[ . 1 . 2]" 63 PHI 1 68 LYS C 1 69 ILE N 1 69 ILE CA 1 69 ILE C -150.00 -90.00 -100.90 -100.28 -102.11 . . 0 "[ . 1 . 2]" 64 PSI 1 69 ILE N 1 69 ILE CA 1 69 ILE C 1 70 PHE N 101.00 161.00 118.10 127.30 123.42 . . 0 "[ . 1 . 2]" 65 PHI 1 69 ILE C 1 70 PHE N 1 70 PHE CA 1 70 PHE C -148.00 -88.00 -97.11 -115.39 -88.22 . . 0 "[ . 1 . 2]" 66 PSI 1 70 PHE N 1 70 PHE CA 1 70 PHE C 1 71 VAL N 111.00 171.00 128.28 111.04 142.94 . . 0 "[ . 1 . 2]" 67 PHI 1 70 PHE C 1 71 VAL N 1 71 VAL CA 1 71 VAL C -155.00 -95.00 -127.86 -142.34 -106.91 . . 0 "[ . 1 . 2]" 68 PSI 1 71 VAL N 1 71 VAL CA 1 71 VAL C 1 72 GLU N 100.00 160.00 105.38 108.22 107.16 . . 0 "[ . 1 . 2]" 69 PHI 1 71 VAL C 1 72 GLU N 1 72 GLU CA 1 72 GLU C -141.00 -81.00 -98.43 -106.56 -89.13 . . 0 "[ . 1 . 2]" 70 PSI 1 72 GLU N 1 72 GLU CA 1 72 GLU C 1 73 PHE N 100.00 160.00 135.35 132.95 129.35 . . 0 "[ . 1 . 2]" 71 PHI 1 76 ALA C 1 77 SER N 1 77 SER CA 1 77 SER C -95.00 -35.00 -48.24 -59.33 -42.45 . . 0 "[ . 1 . 2]" 72 PSI 1 77 SER N 1 77 SER CA 1 77 SER C 1 78 GLU N -67.00 -7.00 -62.82 -66.98 -54.53 . . 0 "[ . 1 . 2]" 73 PHI 1 77 SER C 1 78 GLU N 1 78 GLU CA 1 78 GLU C -101.00 -41.00 -46.41 -48.65 -50.11 . . 0 "[ . 1 . 2]" 74 PSI 1 78 GLU N 1 78 GLU CA 1 78 GLU C 1 79 THR N -72.00 -12.00 -45.63 -49.29 -50.51 . . 0 "[ . 1 . 2]" 75 PHI 1 78 GLU C 1 79 THR N 1 79 THR CA 1 79 THR C -93.00 -33.00 -57.90 -66.22 -53.37 . . 0 "[ . 1 . 2]" 76 PSI 1 79 THR N 1 79 THR CA 1 79 THR C 1 80 HIS N -72.00 -12.00 -58.14 -68.04 -45.97 . . 0 "[ . 1 . 2]" 77 PHI 1 79 THR C 1 80 HIS N 1 80 HIS CA 1 80 HIS C -92.00 -32.00 -44.72 -51.11 -56.53 . . 0 "[ . 1 . 2]" 78 PSI 1 80 HIS N 1 80 HIS CA 1 80 HIS C 1 81 LYS N -66.00 -6.00 -43.03 -47.88 -38.80 . . 0 "[ . 1 . 2]" 79 PHI 1 80 HIS C 1 81 LYS N 1 81 LYS CA 1 81 LYS C -98.00 -38.00 -61.34 -67.16 -54.17 . . 0 "[ . 1 . 2]" 80 PSI 1 81 LYS N 1 81 LYS CA 1 81 LYS C 1 82 ALA N -68.00 -8.00 -59.21 -66.64 -46.57 . . 0 "[ . 1 . 2]" 81 PHI 1 81 LYS C 1 82 ALA N 1 82 ALA CA 1 82 ALA C -93.00 -33.00 -46.01 -47.81 -49.58 . . 0 "[ . 1 . 2]" 82 PSI 1 82 ALA N 1 82 ALA CA 1 82 ALA C 1 83 ILE N -70.00 -10.00 -38.83 -46.36 -30.33 . . 0 "[ . 1 . 2]" 83 PHI 1 82 ALA C 1 83 ILE N 1 83 ILE CA 1 83 ILE C -97.00 -37.00 -69.88 -80.93 -58.20 . . 0 "[ . 1 . 2]" 84 PSI 1 83 ILE N 1 83 ILE CA 1 83 ILE C 1 84 GLN N -74.00 -14.00 -56.11 -66.65 -43.62 . . 0 "[ . 1 . 2]" 85 PHI 1 83 ILE C 1 84 GLN N 1 84 GLN CA 1 84 GLN C -91.00 -31.00 -47.93 -51.14 -55.49 . . 0 "[ . 1 . 2]" 86 PSI 1 84 GLN N 1 84 GLN CA 1 84 GLN C 1 85 ALA N -67.00 -7.00 -28.65 -24.45 -24.70 . . 0 "[ . 1 . 2]" 87 PHI 1 84 GLN C 1 85 ALA N 1 85 ALA CA 1 85 ALA C -104.00 -44.00 -88.73 -99.74 -77.92 . . 0 "[ . 1 . 2]" 88 PSI 1 85 ALA N 1 85 ALA CA 1 85 ALA C 1 86 LEU N -66.00 -6.00 -54.21 -59.73 -61.84 . . 0 "[ . 1 . 2]" 89 PHI 1 86 LEU C 1 87 ASN N 1 87 ASN CA 1 87 ASN C -90.00 -30.00 -73.71 -89.83 -47.61 . . 0 "[ . 1 . 2]" 90 PSI 1 87 ASN N 1 87 ASN CA 1 87 ASN C 1 88 GLY N -60.00 0.00 -6.95 -19.92 0.13 0.13 13 0 "[ . 1 . 2]" 91 PHI 1 89 ARG C 1 90 TRP N 1 90 TRP CA 1 90 TRP C -137.00 -77.00 -109.23 -119.31 -100.64 . . 0 "[ . 1 . 2]" 92 PSI 1 90 TRP N 1 90 TRP CA 1 90 TRP C 1 91 PHE N 100.00 160.00 112.54 119.25 117.63 . . 0 "[ . 1 . 2]" 93 PHI 1 90 TRP C 1 91 PHE N 1 91 PHE CA 1 91 PHE C -137.00 -77.00 -84.72 -92.18 -76.90 0.10 20 0 "[ . 1 . 2]" 94 PSI 1 91 PHE N 1 91 PHE CA 1 91 PHE C 1 92 ALA N 97.00 157.00 158.25 157.96 157.89 3.25 15 0 "[ . 1 . 2]" 95 PHI 1 91 PHE C 1 92 ALA N 1 92 ALA CA 1 92 ALA C -140.00 -20.00 -50.99 -51.85 -51.89 . . 0 "[ . 1 . 2]" 96 PHI 1 92 ALA C 1 93 GLY N 1 93 GLY CA 1 93 GLY C 48.00 108.00 76.71 80.73 80.44 . . 0 "[ . 1 . 2]" 97 PHI 1 93 GLY C 1 94 ARG N 1 94 ARG CA 1 94 ARG C -163.00 -103.00 -152.84 -147.71 -149.56 0.30 18 0 "[ . 1 . 2]" 98 PSI 1 94 ARG N 1 94 ARG CA 1 94 ARG C 1 95 LYS N 111.00 171.00 163.06 171.20 171.19 0.46 14 0 "[ . 1 . 2]" 99 PHI 1 94 ARG C 1 95 LYS N 1 95 LYS CA 1 95 LYS C -124.00 -64.00 -106.94 -107.57 -108.45 . . 0 "[ . 1 . 2]" 100 PSI 1 95 LYS N 1 95 LYS CA 1 95 LYS C 1 96 VAL N 90.00 150.00 138.61 143.11 141.62 0.08 16 0 "[ . 1 . 2]" 101 PHI 1 95 LYS C 1 96 VAL N 1 96 VAL CA 1 96 VAL C -116.00 -56.00 -104.64 -115.49 -79.65 . . 0 "[ . 1 . 2]" 102 PSI 1 96 VAL N 1 96 VAL CA 1 96 VAL C 1 97 VAL N 106.00 166.00 148.57 147.74 146.48 . . 0 "[ . 1 . 2]" 103 PHI 1 96 VAL C 1 97 VAL N 1 97 VAL CA 1 97 VAL C -149.00 -89.00 -139.24 -134.83 -135.77 0.01 20 0 "[ . 1 . 2]" 104 PSI 1 97 VAL N 1 97 VAL CA 1 97 VAL C 1 98 ALA N 99.00 159.00 114.13 117.84 116.12 . . 0 "[ . 1 . 2]" 105 PHI 1 97 VAL C 1 98 ALA N 1 98 ALA CA 1 98 ALA C -155.00 -95.00 -103.40 -124.86 -95.18 . . 0 "[ . 1 . 2]" 106 PSI 1 98 ALA N 1 98 ALA CA 1 98 ALA C 1 99 GLU N 110.00 170.00 136.90 125.26 120.92 . . 0 "[ . 1 . 2]" 107 PHI 1 98 ALA C 1 99 GLU N 1 99 GLU CA 1 99 GLU C -167.00 -107.00 -140.27 -164.49 -108.47 . . 0 "[ . 1 . 2]" 108 PSI 1 99 GLU N 1 99 GLU CA 1 99 GLU C 1 100 VAL N 118.00 178.00 166.34 155.09 177.26 . . 0 "[ . 1 . 2]" 109 PHI 1 99 GLU C 1 100 VAL N 1 100 VAL CA 1 100 VAL C -114.00 -54.00 -94.54 -94.31 -94.46 . . 0 "[ . 1 . 2]" 110 PSI 1 100 VAL N 1 100 VAL CA 1 100 VAL C 1 101 TYR N 100.00 160.00 122.74 107.39 151.57 . . 0 "[ . 1 . 2]" 111 PHI 1 102 ASP C 1 103 GLN N 1 103 GLN CA 1 103 GLN C -140.00 -20.00 -72.85 -63.03 -63.98 . . 0 "[ . 1 . 2]" 112 PHI 1 103 GLN C 1 104 GLU N 1 104 GLU CA 1 104 GLU C -140.00 -20.00 -45.99 -111.76 -31.90 . . 0 "[ . 1 . 2]" 113 PHI 1 110 ASP C 1 111 LEU N 1 111 LEU CA 1 111 LEU C -140.00 -20.00 -81.13 -63.93 -75.56 . . 0 "[ . 1 . 2]" 114 PHI 1 111 LEU C 1 112 SER N 1 112 SER CA 1 112 SER C -140.00 -20.00 -81.00 -134.00 -38.70 . . 0 "[ . 1 . 2]" 115 PHI 1 112 SER C 1 113 ALA N 1 113 ALA CA 1 113 ALA C -140.00 -20.00 -85.50 -91.09 -106.62 . . 0 "[ . 1 . 2]" 116 CHI1 1 17 VAL N 1 17 VAL CA 1 17 VAL CB 1 17 VAL CG1 160.00 -160.00 -178.09 -176.44 -178.55 . . 0 "[ . 1 . 2]" 117 CHI1 1 18 MET N 1 18 MET CA 1 18 MET CB 1 18 MET CG 160.00 -160.00 163.39 159.98 176.43 0.02 16 0 "[ . 1 . 2]" 118 CHI1 1 19 VAL N 1 19 VAL CA 1 19 VAL CB 1 19 VAL CG1 40.00 80.00 59.29 42.97 71.04 . . 0 "[ . 1 . 2]" 119 CHI1 1 20 LEU N 1 20 LEU CA 1 20 LEU CB 1 20 LEU CG -80.00 -40.00 -54.69 -68.34 -45.81 . . 0 "[ . 1 . 2]" 120 CHI2 1 20 LEU CA 1 20 LEU CB 1 20 LEU CG 1 20 LEU CD1 160.00 -160.00 -177.76 167.19 -165.10 . . 0 "[ . 1 . 2]" 121 CHI1 1 23 MET N 1 23 MET CA 1 23 MET CB 1 23 MET CG 160.00 -160.00 -173.43 169.13 -160.48 . . 0 "[ . 1 . 2]" 122 CHI2 1 23 MET CA 1 23 MET CB 1 23 MET CG 1 23 MET SD 160.00 -160.00 -177.90 -169.51 -174.05 0.00 19 0 "[ . 1 . 2]" 123 CHI1 1 24 VAL N 1 24 VAL CA 1 24 VAL CB 1 24 VAL CG1 -80.00 -40.00 -72.56 -80.07 -64.01 0.07 11 0 "[ . 1 . 2]" 124 CHI1 1 29 ILE N 1 29 ILE CA 1 29 ILE CB 1 29 ILE CG1 -80.00 -40.00 -56.80 -61.91 -53.00 . . 0 "[ . 1 . 2]" 125 CHI21 1 29 ILE CA 1 29 ILE CB 1 29 ILE CG1 1 29 ILE CD1 -80.00 -40.00 -62.26 -73.90 -44.97 . . 0 "[ . 1 . 2]" 126 CHI1 1 33 LEU N 1 33 LEU CA 1 33 LEU CB 1 33 LEU CG 160.00 -160.00 -171.29 -179.10 -162.51 . . 0 "[ . 1 . 2]" 127 CHI2 1 33 LEU CA 1 33 LEU CB 1 33 LEU CG 1 33 LEU CD1 40.00 80.00 67.34 64.71 63.40 . . 0 "[ . 1 . 2]" 128 CHI1 1 37 VAL N 1 37 VAL CA 1 37 VAL CB 1 37 VAL CG1 160.00 -160.00 179.64 175.95 -175.97 . . 0 "[ . 1 . 2]" 129 CHI1 1 44 PHE N 1 44 PHE CA 1 44 PHE CB 1 44 PHE CG -80.00 -40.00 -47.11 -53.68 -41.66 . . 0 "[ . 1 . 2]" 130 CHI1 1 47 VAL N 1 47 VAL CA 1 47 VAL CB 1 47 VAL CG1 160.00 -160.00 178.29 178.04 176.99 . . 0 "[ . 1 . 2]" 131 CHI1 1 50 VAL N 1 50 VAL CA 1 50 VAL CB 1 50 VAL CG1 160.00 -160.00 178.50 -178.15 -179.55 . . 0 "[ . 1 . 2]" 132 CHI1 1 52 ILE N 1 52 ILE CA 1 52 ILE CB 1 52 ILE CG1 -80.00 -40.00 -58.81 -56.38 -57.29 . . 0 "[ . 1 . 2]" 133 CHI21 1 52 ILE CA 1 52 ILE CB 1 52 ILE CG1 1 52 ILE CD1 160.00 -160.00 165.86 166.24 166.14 . . 0 "[ . 1 . 2]" 134 CHI1 1 55 GLU N 1 55 GLU CA 1 55 GLU CB 1 55 GLU CG 160.00 -160.00 -172.65 169.90 -162.00 . . 0 "[ . 1 . 2]" 135 CHI1 1 64 GLU N 1 64 GLU CA 1 64 GLU CB 1 64 GLU CG 160.00 -160.00 -173.10 173.15 -162.17 . . 0 "[ . 1 . 2]" 136 CHI1 1 65 ILE N 1 65 ILE CA 1 65 ILE CB 1 65 ILE CG1 -80.00 -40.00 -53.15 -61.95 -40.44 . . 0 "[ . 1 . 2]" 137 CHI21 1 65 ILE CA 1 65 ILE CB 1 65 ILE CG1 1 65 ILE CD1 -80.00 -40.00 -66.08 -74.78 -53.05 . . 0 "[ . 1 . 2]" 138 CHI1 1 66 ILE N 1 66 ILE CA 1 66 ILE CB 1 66 ILE CG1 40.00 80.00 65.32 67.52 66.69 . . 0 "[ . 1 . 2]" 139 CHI21 1 66 ILE CA 1 66 ILE CB 1 66 ILE CG1 1 66 ILE CD1 40.00 80.00 76.89 79.29 79.01 0.99 7 0 "[ . 1 . 2]" 140 CHI1 1 67 VAL N 1 67 VAL CA 1 67 VAL CB 1 67 VAL CG1 160.00 -160.00 175.74 175.02 173.15 . . 0 "[ . 1 . 2]" 141 CHI1 1 69 ILE N 1 69 ILE CA 1 69 ILE CB 1 69 ILE CG1 -80.00 -40.00 -58.80 -63.60 -55.30 . . 0 "[ . 1 . 2]" 142 CHI21 1 69 ILE CA 1 69 ILE CB 1 69 ILE CG1 1 69 ILE CD1 160.00 -160.00 163.86 160.55 173.93 . . 0 "[ . 1 . 2]" 143 CHI1 1 71 VAL N 1 71 VAL CA 1 71 VAL CB 1 71 VAL CG1 160.00 -160.00 176.63 172.12 167.59 . . 0 "[ . 1 . 2]" 144 CHI1 1 91 PHE N 1 91 PHE CA 1 91 PHE CB 1 91 PHE CG 160.00 -160.00 -164.46 -168.37 -159.83 0.17 20 0 "[ . 1 . 2]" 145 CHI1 1 94 ARG N 1 94 ARG CA 1 94 ARG CB 1 94 ARG CG -80.00 -40.00 -74.03 -79.94 -64.72 . . 0 "[ . 1 . 2]" 146 CHI1 1 96 VAL N 1 96 VAL CA 1 96 VAL CB 1 96 VAL CG1 160.00 -160.00 178.84 170.64 167.48 . . 0 "[ . 1 . 2]" 147 CHI1 1 97 VAL N 1 97 VAL CA 1 97 VAL CB 1 97 VAL CG1 160.00 -160.00 170.69 162.37 -178.55 . . 0 "[ . 1 . 2]" stop_ save_
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