NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
379538 | 1hue | 4047 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1hue save_distance_constraint_statistics_1 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 160 _TA_constraint_stats_list.Viol_count 249 _TA_constraint_stats_list.Viol_total 67189.74 _TA_constraint_stats_list.Viol_max 55.21 _TA_constraint_stats_list.Viol_rms 3.27 _TA_constraint_stats_list.Viol_average_all_restraints 0.67 _TA_constraint_stats_list.Viol_average_violations_only 10.79 _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 THR C 1 5 GLU N 1 5 GLU CA 1 5 GLU C -120.00 0.00 -59.69 -62.68 -57.37 . . 0 "[ . 1 . 2 .]" 2 . 1 8 ASN C 1 9 ALA N 1 9 ALA CA 1 9 ALA C -120.00 0.00 -67.49 -65.59 -65.60 . . 0 "[ . 1 . 2 .]" 3 . 1 9 ALA C 1 10 VAL N 1 10 VAL CA 1 10 VAL C -120.00 0.00 -68.84 -67.34 -67.72 . . 0 "[ . 1 . 2 .]" 4 . 1 10 VAL C 1 11 ALA N 1 11 ALA CA 1 11 ALA C -120.00 0.00 -64.70 -65.35 -65.53 . . 0 "[ . 1 . 2 .]" 5 . 1 11 ALA C 1 12 GLU N 1 12 GLU CA 1 12 GLU C -120.00 0.00 -77.35 -77.34 -77.47 . . 0 "[ . 1 . 2 .]" 6 . 1 12 GLU C 1 13 THR N 1 13 THR CA 1 13 THR C -120.00 0.00 -78.68 -68.09 -68.33 . . 0 "[ . 1 . 2 .]" 7 . 1 20 ASP C 1 21 ALA N 1 21 ALA CA 1 21 ALA C -120.00 0.00 -70.92 -75.42 -67.44 . . 0 "[ . 1 . 2 .]" 8 . 1 22 THR C 1 23 LYS N 1 23 LYS CA 1 23 LYS C -120.00 0.00 -56.58 -51.64 -56.11 . . 0 "[ . 1 . 2 .]" 9 . 1 23 LYS C 1 24 ALA N 1 24 ALA CA 1 24 ALA C -120.00 0.00 -58.14 -69.19 -53.25 . . 0 "[ . 1 . 2 .]" 10 . 1 26 ASP C 1 27 ALA N 1 27 ALA CA 1 27 ALA C -120.00 0.00 -114.13 -122.82 -56.35 2.82 24 0 "[ . 1 . 2 .]" 11 . 1 34 GLU C 1 35 ALA N 1 35 ALA CA 1 35 ALA C -120.00 0.00 -62.82 -72.06 -56.56 . . 0 "[ . 1 . 2 .]" 12 . 1 39 GLY C 1 40 ASP N 1 40 ASP CA 1 40 ASP C 180.00 -60.00 -125.38 -139.97 -72.60 . . 0 "[ . 1 . 2 .]" 13 . 1 40 ASP C 1 41 LYS N 1 41 LYS CA 1 41 LYS C 180.00 -60.00 -90.68 -100.85 -102.41 . . 0 "[ . 1 . 2 .]" 14 . 1 41 LYS C 1 42 VAL N 1 42 VAL CA 1 42 VAL C 180.00 -60.00 -92.86 -119.10 -77.91 . . 0 "[ . 1 . 2 .]" 15 . 1 42 VAL C 1 43 GLN N 1 43 GLN CA 1 43 GLN C 180.00 -60.00 -156.57 -138.02 171.18 16.14 4 11 "[* *+* - ***. * ** .]" 16 . 1 46 GLY C 1 47 PHE N 1 47 PHE CA 1 47 PHE C 180.00 -60.00 -154.41 -151.15 -152.30 . . 0 "[ . 1 . 2 .]" 17 . 1 48 GLY C 1 49 ASN N 1 49 ASN CA 1 49 ASN C 180.00 -60.00 -140.11 -128.74 -139.70 . . 0 "[ . 1 . 2 .]" 18 . 1 50 PHE C 1 51 GLU N 1 51 GLU CA 1 51 GLU C 180.00 -60.00 -162.47 -169.16 -154.12 . . 0 "[ . 1 . 2 .]" 19 . 1 51 GLU C 1 52 VAL N 1 52 VAL CA 1 52 VAL C 180.00 -60.00 -90.29 -85.14 -87.59 . . 0 "[ . 1 . 2 .]" 20 . 1 52 VAL C 1 53 ARG N 1 53 ARG CA 1 53 ARG C 180.00 -60.00 -123.50 -136.33 -89.89 . . 0 "[ . 1 . 2 .]" 21 . 1 53 ARG C 1 54 GLU N 1 54 GLU CA 1 54 GLU C 180.00 -60.00 -75.78 -69.56 -70.86 16.42 23 1 "[ . 1 . 2 + .]" 22 . 1 54 GLU C 1 55 ARG N 1 55 ARG CA 1 55 ARG C 180.00 -60.00 -80.49 146.16 -52.94 33.84 13 2 "[ . 1 + .- 2 .]" 23 . 1 57 ALA C 1 58 ARG N 1 58 ARG CA 1 58 ARG C 180.00 -60.00 -101.86 -126.20 -143.59 39.55 19 1 "[ . 1 . +2 .]" 24 . 1 58 ARG C 1 59 LYS N 1 59 LYS CA 1 59 LYS C 180.00 -60.00 -149.30 -128.85 -132.75 29.32 19 1 "[ . 1 . +2 .]" 25 . 1 60 GLY C 1 61 ARG N 1 61 ARG CA 1 61 ARG C 180.00 -60.00 -119.84 -148.33 -149.72 . . 0 "[ . 1 . 2 .]" 26 . 1 61 ARG C 1 62 ASN N 1 62 ASN CA 1 62 ASN C 60.00 -60.00 -85.86 -161.94 60.91 7.14 4 1 "[ +. 1 . 2 .]" 27 . 1 63 PRO C 1 64 GLN N 1 64 GLN CA 1 64 GLN C 180.00 -60.00 -85.61 -77.06 -80.24 1.74 9 0 "[ . 1 . 2 .]" 28 . 1 64 GLN C 1 65 THR N 1 65 THR CA 1 65 THR C 180.00 -60.00 -92.36 -82.16 -94.30 24.70 24 1 "[ . 1 . 2 +.]" 29 . 1 66 GLY C 1 67 GLU N 1 67 GLU CA 1 67 GLU C 180.00 -60.00 -120.11 -128.66 -137.55 39.33 20 1 "[ . 1 . + .]" 30 . 1 68 GLU C 1 69 MET N 1 69 MET CA 1 69 MET C 180.00 -60.00 -135.44 -136.94 -142.99 11.44 13 1 "[ . 1 + . 2 .]" 31 . 1 69 MET C 1 70 GLU N 1 70 GLU CA 1 70 GLU C 180.00 -60.00 -80.56 -111.44 -69.28 . . 0 "[ . 1 . 2 .]" 32 . 1 70 GLU C 1 71 ILE N 1 71 ILE CA 1 71 ILE C 180.00 -60.00 -88.03 -108.56 -65.57 . . 0 "[ . 1 . 2 .]" 33 . 1 73 ALA C 1 74 SER N 1 74 SER CA 1 74 SER C 180.00 -60.00 -157.05 -158.45 -161.08 . . 0 "[ . 1 . 2 .]" 34 . 1 75 LYS C 1 76 VAL N 1 76 VAL CA 1 76 VAL C 180.00 -60.00 -113.16 -104.03 -107.49 . . 0 "[ . 1 . 2 .]" 35 . 1 77 PRO C 1 78 ALA N 1 78 ALA CA 1 78 ALA C 180.00 -60.00 -130.98 -135.64 -139.14 . . 0 "[ . 1 . 2 .]" 36 . 1 78 ALA C 1 79 PHE N 1 79 PHE CA 1 79 PHE C 180.00 -60.00 -145.06 -153.05 -127.11 . . 0 "[ . 1 . 2 .]" 37 . 1 79 PHE C 1 80 LYS N 1 80 LYS CA 1 80 LYS C 180.00 -60.00 -82.26 -90.02 -70.00 . . 0 "[ . 1 . 2 .]" 38 . 1 83 LYS C 1 84 ALA N 1 84 ALA CA 1 84 ALA C -120.00 0.00 -54.94 -57.75 -50.26 . . 0 "[ . 1 . 2 .]" 39 . 1 84 ALA C 1 85 LEU N 1 85 LEU CA 1 85 LEU C -120.00 0.00 -61.94 -59.80 -60.68 . . 0 "[ . 1 . 2 .]" 40 . 1 86 LYS C 1 87 ASP N 1 87 ASP CA 1 87 ASP C -120.00 0.00 -80.12 -80.01 -81.18 . . 0 "[ . 1 . 2 .]" 41 . 1 87 ASP C 1 88 ALA N 1 88 ALA CA 1 88 ALA C -120.00 0.00 -50.79 -55.18 -47.91 . . 0 "[ . 1 . 2 .]" 42 . 2 4 THR C 2 5 GLU N 2 5 GLU CA 2 5 GLU C -120.00 0.00 -59.70 -62.73 -57.50 . . 0 "[ . 1 . 2 .]" 43 . 2 8 ASN C 2 9 ALA N 2 9 ALA CA 2 9 ALA C -120.00 0.00 -68.14 -71.68 -65.22 . . 0 "[ . 1 . 2 .]" 44 . 2 9 ALA C 2 10 VAL N 2 10 VAL CA 2 10 VAL C -120.00 0.00 -68.83 -71.56 -66.64 . . 0 "[ . 1 . 2 .]" 45 . 2 10 VAL C 2 11 ALA N 2 11 ALA CA 2 11 ALA C -120.00 0.00 -63.99 -65.01 -65.38 . . 0 "[ . 1 . 2 .]" 46 . 2 11 ALA C 2 12 GLU N 2 12 GLU CA 2 12 GLU C -120.00 0.00 -77.84 -77.31 -77.54 . . 0 "[ . 1 . 2 .]" 47 . 2 12 GLU C 2 13 THR N 2 13 THR CA 2 13 THR C -120.00 0.00 -83.78 -93.02 -65.12 . . 0 "[ . 1 . 2 .]" 48 . 2 20 ASP C 2 21 ALA N 2 21 ALA CA 2 21 ALA C -120.00 0.00 -70.76 -69.47 -70.16 . . 0 "[ . 1 . 2 .]" 49 . 2 22 THR C 2 23 LYS N 2 23 LYS CA 2 23 LYS C -120.00 0.00 -56.96 -59.89 -49.87 . . 0 "[ . 1 . 2 .]" 50 . 2 23 LYS C 2 24 ALA N 2 24 ALA CA 2 24 ALA C -120.00 0.00 -59.11 -77.48 -53.45 . . 0 "[ . 1 . 2 .]" 51 . 2 26 ASP C 2 27 ALA N 2 27 ALA CA 2 27 ALA C -120.00 0.00 -115.20 -119.43 -119.90 2.30 10 0 "[ . 1 . 2 .]" 52 . 2 34 GLU C 2 35 ALA N 2 35 ALA CA 2 35 ALA C -120.00 0.00 -63.28 -62.77 -64.31 . . 0 "[ . 1 . 2 .]" 53 . 2 39 GLY C 2 40 ASP N 2 40 ASP CA 2 40 ASP C 180.00 -60.00 -130.76 170.97 -114.30 9.03 7 1 "[ . + 1 . 2 .]" 54 . 2 40 ASP C 2 41 LYS N 2 41 LYS CA 2 41 LYS C 180.00 -60.00 -92.40 -174.09 -77.71 . . 0 "[ . 1 . 2 .]" 55 . 2 41 LYS C 2 42 VAL N 2 42 VAL CA 2 42 VAL C 180.00 -60.00 -93.93 -105.34 -83.47 . . 0 "[ . 1 . 2 .]" 56 . 2 42 VAL C 2 43 GLN N 2 43 GLN CA 2 43 GLN C 180.00 -60.00 -162.72 167.63 166.33 22.21 18 13 "[****** *** * +*2 -]" 57 . 2 46 GLY C 2 47 PHE N 2 47 PHE CA 2 47 PHE C 180.00 -60.00 -154.51 -162.24 -133.34 . . 0 "[ . 1 . 2 .]" 58 . 2 48 GLY C 2 49 ASN N 2 49 ASN CA 2 49 ASN C 180.00 -60.00 -136.24 -166.77 -90.12 . . 0 "[ . 1 . 2 .]" 59 . 2 50 PHE C 2 51 GLU N 2 51 GLU CA 2 51 GLU C 180.00 -60.00 -164.61 -162.44 -162.55 51.87 11 1 "[ . 1+ . 2 .]" 60 . 2 51 GLU C 2 52 VAL N 2 52 VAL CA 2 52 VAL C 180.00 -60.00 -93.04 -97.66 -99.07 36.04 11 1 "[ . 1+ . 2 .]" 61 . 2 52 VAL C 2 53 ARG N 2 53 ARG CA 2 53 ARG C 180.00 -60.00 -124.90 -139.95 -97.11 . . 0 "[ . 1 . 2 .]" 62 . 2 53 ARG C 2 54 GLU N 2 54 GLU CA 2 54 GLU C 180.00 -60.00 -73.02 -75.51 -82.17 16.50 17 1 "[ . 1 . + 2 .]" 63 . 2 54 GLU C 2 55 ARG N 2 55 ARG CA 2 55 ARG C 180.00 -60.00 -81.22 -164.95 -45.81 14.19 14 2 "[ . 1 +. 2 - .]" 64 . 2 57 ALA C 2 58 ARG N 2 58 ARG CA 2 58 ARG C 180.00 -60.00 -97.02 178.35 -76.77 1.65 12 0 "[ . 1 . 2 .]" 65 . 2 58 ARG C 2 59 LYS N 2 59 LYS CA 2 59 LYS C 180.00 -60.00 -144.33 124.79 -79.21 55.21 12 1 "[ . 1 + . 2 .]" 66 . 2 60 GLY C 2 61 ARG N 2 61 ARG CA 2 61 ARG C 180.00 -60.00 -144.13 -167.32 -71.29 . . 0 "[ . 1 . 2 .]" 67 . 2 61 ARG C 2 62 ASN N 2 62 ASN CA 2 62 ASN C 60.00 -60.00 -70.10 -141.35 61.88 5.97 20 1 "[ . 1 . + .]" 68 . 2 63 PRO C 2 64 GLN N 2 64 GLN CA 2 64 GLN C 180.00 -60.00 -84.22 -85.44 -85.59 1.17 16 0 "[ . 1 . 2 .]" 69 . 2 64 GLN C 2 65 THR N 2 65 THR CA 2 65 THR C 180.00 -60.00 -80.07 -77.31 -94.43 . . 0 "[ . 1 . 2 .]" 70 . 2 66 GLY C 2 67 GLU N 2 67 GLU CA 2 67 GLU C 180.00 -60.00 -123.67 148.25 -96.21 31.75 25 1 "[ . 1 . 2 +]" 71 . 2 68 GLU C 2 69 MET N 2 69 MET CA 2 69 MET C 180.00 -60.00 -137.33 -149.81 -155.28 . . 0 "[ . 1 . 2 .]" 72 . 2 69 MET C 2 70 GLU N 2 70 GLU CA 2 70 GLU C 180.00 -60.00 -81.83 -78.13 -80.08 . . 0 "[ . 1 . 2 .]" 73 . 2 70 GLU C 2 71 ILE N 2 71 ILE CA 2 71 ILE C 180.00 -60.00 -85.40 -101.57 -74.17 . . 0 "[ . 1 . 2 .]" 74 . 2 73 ALA C 2 74 SER N 2 74 SER CA 2 74 SER C 180.00 -60.00 -154.64 -169.39 -134.58 . . 0 "[ . 1 . 2 .]" 75 . 2 75 LYS C 2 76 VAL N 2 76 VAL CA 2 76 VAL C 180.00 -60.00 -111.34 -116.38 -116.90 . . 0 "[ . 1 . 2 .]" 76 . 2 77 PRO C 2 78 ALA N 2 78 ALA CA 2 78 ALA C 180.00 -60.00 -134.15 -140.39 -144.50 . . 0 "[ . 1 . 2 .]" 77 . 2 78 ALA C 2 79 PHE N 2 79 PHE CA 2 79 PHE C 180.00 -60.00 -143.06 -153.79 -95.22 . . 0 "[ . 1 . 2 .]" 78 . 2 79 PHE C 2 80 LYS N 2 80 LYS CA 2 80 LYS C 180.00 -60.00 -83.05 -98.85 -72.31 . . 0 "[ . 1 . 2 .]" 79 . 2 83 LYS C 2 84 ALA N 2 84 ALA CA 2 84 ALA C -120.00 0.00 -55.87 -79.58 -49.33 . . 0 "[ . 1 . 2 .]" 80 . 2 84 ALA C 2 85 LEU N 2 85 LEU CA 2 85 LEU C -120.00 0.00 -61.88 -64.56 -58.69 . . 0 "[ . 1 . 2 .]" 81 . 2 86 LYS C 2 87 ASP N 2 87 ASP CA 2 87 ASP C -120.00 0.00 -80.12 -82.85 -83.77 . . 0 "[ . 1 . 2 .]" 82 . 2 87 ASP C 2 88 ALA N 2 88 ALA CA 2 88 ALA C -120.00 0.00 -50.25 -50.81 -51.72 . . 0 "[ . 1 . 2 .]" 83 . 1 2 ASN N 1 2 ASN CA 1 2 ASN CB 1 2 ASN CG 0.00 120.00 65.96 50.42 75.76 . . 0 "[ . 1 . 2 .]" 84 . 2 2 ASN N 2 2 ASN CA 2 2 ASN CB 2 2 ASN CG 0.00 120.00 67.37 53.82 73.98 . . 0 "[ . 1 . 2 .]" 85 . 1 6 LEU N 1 6 LEU CA 1 6 LEU CB 1 6 LEU CG -120.00 0.00 -127.39 -122.56 -129.64 16.21 18 14 "[* ***- * 1 * . *+** * **]" 86 . 2 6 LEU N 2 6 LEU CA 2 6 LEU CB 2 6 LEU CG -120.00 0.00 -126.18 -136.06 -113.07 16.06 4 13 "[ **+.** * -** *** * .]" 87 . 1 7 ILE N 1 7 ILE CA 1 7 ILE CB 1 7 ILE CG2 120.00 -120.00 -175.23 -171.35 -174.48 . . 0 "[ . 1 . 2 .]" 88 . 2 7 ILE N 2 7 ILE CA 2 7 ILE CB 2 7 ILE CG2 120.00 -120.00 -176.14 178.51 -168.63 . . 0 "[ . 1 . 2 .]" 89 . 1 8 ASN N 1 8 ASN CA 1 8 ASN CB 1 8 ASN CG -120.00 0.00 -63.22 -67.37 -59.13 . . 0 "[ . 1 . 2 .]" 90 . 2 8 ASN N 2 8 ASN CA 2 8 ASN CB 2 8 ASN CG -120.00 0.00 -63.28 -61.07 -62.03 . . 0 "[ . 1 . 2 .]" 91 . 1 10 VAL N 1 10 VAL CA 1 10 VAL CB 1 10 VAL CG1 120.00 -120.00 -148.97 -142.36 -143.61 . . 0 "[ . 1 . 2 .]" 92 . 2 10 VAL N 2 10 VAL CA 2 10 VAL CB 2 10 VAL CG1 120.00 -120.00 -149.99 -154.48 -139.09 . . 0 "[ . 1 . 2 .]" 93 . 1 12 GLU N 1 12 GLU CA 1 12 GLU CB 1 12 GLU CG 120.00 -120.00 -175.13 -178.73 -172.44 . . 0 "[ . 1 . 2 .]" 94 . 2 12 GLU N 2 12 GLU CA 2 12 GLU CB 2 12 GLU CG 120.00 -120.00 -174.94 -179.93 -172.50 . . 0 "[ . 1 . 2 .]" 95 . 1 17 SER N 1 17 SER CA 1 17 SER CB 1 17 SER OG -120.00 0.00 -57.04 -59.85 -54.34 . . 0 "[ . 1 . 2 .]" 96 . 2 17 SER N 2 17 SER CA 2 17 SER CB 2 17 SER OG -120.00 0.00 -56.95 -57.07 -57.32 . . 0 "[ . 1 . 2 .]" 97 . 1 19 LYS N 1 19 LYS CA 1 19 LYS CB 1 19 LYS CG 120.00 -0.00 -116.00 -175.37 -56.74 . . 0 "[ . 1 . 2 .]" 98 . 2 19 LYS N 2 19 LYS CA 2 19 LYS CB 2 19 LYS CG 120.00 -0.00 -121.29 -72.60 -168.13 . . 0 "[ . 1 . 2 .]" 99 . 1 20 ASP N 1 20 ASP CA 1 20 ASP CB 1 20 ASP CG -120.00 0.00 -80.57 -85.76 -68.25 . . 0 "[ . 1 . 2 .]" 100 . 2 20 ASP N 2 20 ASP CA 2 20 ASP CB 2 20 ASP CG -120.00 0.00 -78.95 -79.32 -79.36 . . 0 "[ . 1 . 2 .]" 101 . 1 23 LYS N 1 23 LYS CA 1 23 LYS CB 1 23 LYS CG -120.00 0.00 -77.07 -89.22 -73.04 . . 0 "[ . 1 . 2 .]" 102 . 2 23 LYS N 2 23 LYS CA 2 23 LYS CB 2 23 LYS CG -120.00 0.00 -76.32 -74.24 -74.83 . . 0 "[ . 1 . 2 .]" 103 . 1 25 VAL N 1 25 VAL CA 1 25 VAL CB 1 25 VAL CG1 120.00 -120.00 151.94 149.19 154.19 . . 0 "[ . 1 . 2 .]" 104 . 2 25 VAL N 2 25 VAL CA 2 25 VAL CB 2 25 VAL CG1 120.00 -120.00 151.91 151.37 151.16 . . 0 "[ . 1 . 2 .]" 105 . 1 28 VAL N 1 28 VAL CA 1 28 VAL CB 1 28 VAL CG1 120.00 -120.00 -174.73 -174.93 -176.61 . . 0 "[ . 1 . 2 .]" 106 . 2 28 VAL N 2 28 VAL CA 2 28 VAL CB 2 28 VAL CG1 120.00 -120.00 -170.68 -120.53 -160.37 . . 0 "[ . 1 . 2 .]" 107 . 1 29 PHE N 1 29 PHE CA 1 29 PHE CB 1 29 PHE CG -120.00 0.00 -54.45 -58.27 -50.36 . . 0 "[ . 1 . 2 .]" 108 . 2 29 PHE N 2 29 PHE CA 2 29 PHE CB 2 29 PHE CG -120.00 0.00 -54.77 -59.44 -47.49 . . 0 "[ . 1 . 2 .]" 109 . 1 30 ASP N 1 30 ASP CA 1 30 ASP CB 1 30 ASP CG 120.00 -120.00 -158.85 -165.76 -153.85 . . 0 "[ . 1 . 2 .]" 110 . 2 30 ASP N 2 30 ASP CA 2 30 ASP CB 2 30 ASP CG 120.00 -120.00 -159.40 -166.21 -153.73 . . 0 "[ . 1 . 2 .]" 111 . 1 31 SER N 1 31 SER CA 1 31 SER CB 1 31 SER OG -120.00 0.00 -54.78 -60.36 -46.32 . . 0 "[ . 1 . 2 .]" 112 . 2 31 SER N 2 31 SER CA 2 31 SER CB 2 31 SER OG -120.00 0.00 -61.46 -66.07 -56.47 . . 0 "[ . 1 . 2 .]" 113 . 1 32 ILE N 1 32 ILE CA 1 32 ILE CB 1 32 ILE CG2 120.00 -120.00 -171.06 173.62 -154.42 . . 0 "[ . 1 . 2 .]" 114 . 2 32 ILE N 2 32 ILE CA 2 32 ILE CB 2 32 ILE CG2 120.00 -120.00 -170.64 -162.51 -163.84 . . 0 "[ . 1 . 2 .]" 115 . 1 34 GLU N 1 34 GLU CA 1 34 GLU CB 1 34 GLU CG 120.00 -0.00 -124.32 -175.22 -67.29 . . 0 "[ . 1 . 2 .]" 116 . 2 34 GLU N 2 34 GLU CA 2 34 GLU CB 2 34 GLU CG 120.00 -0.00 -119.52 -175.34 -68.11 . . 0 "[ . 1 . 2 .]" 117 . 1 36 LEU N 1 36 LEU CA 1 36 LEU CB 1 36 LEU CG -120.00 0.00 -56.77 -70.50 -46.09 . . 0 "[ . 1 . 2 .]" 118 . 2 36 LEU N 2 36 LEU CA 2 36 LEU CB 2 36 LEU CG -120.00 0.00 -53.26 -59.06 -68.38 . . 0 "[ . 1 . 2 .]" 119 . 1 40 ASP N 1 40 ASP CA 1 40 ASP CB 1 40 ASP CG -120.00 0.00 -63.59 -81.69 -47.29 . . 0 "[ . 1 . 2 .]" 120 . 2 40 ASP N 2 40 ASP CA 2 40 ASP CB 2 40 ASP CG -120.00 0.00 -61.97 -82.54 21.33 21.33 7 1 "[ . + 1 . 2 .]" 121 . 1 41 LYS N 1 41 LYS CA 1 41 LYS CB 1 41 LYS CG -120.00 0.00 -52.26 -51.91 -52.66 . . 0 "[ . 1 . 2 .]" 122 . 2 41 LYS N 2 41 LYS CA 2 41 LYS CB 2 41 LYS CG -120.00 0.00 -54.11 -55.28 -55.62 . . 0 "[ . 1 . 2 .]" 123 . 1 42 VAL N 1 42 VAL CA 1 42 VAL CB 1 42 VAL CG1 120.00 -120.00 -174.84 168.20 -164.57 . . 0 "[ . 1 . 2 .]" 124 . 2 42 VAL N 2 42 VAL CA 2 42 VAL CB 2 42 VAL CG1 120.00 -120.00 -174.94 170.92 -159.28 . . 0 "[ . 1 . 2 .]" 125 . 1 43 GLN N 1 43 GLN CA 1 43 GLN CB 1 43 GLN CG -120.00 120.00 -67.37 -70.17 -72.63 . . 0 "[ . 1 . 2 .]" 126 . 2 43 GLN N 2 43 GLN CA 2 43 GLN CB 2 43 GLN CG -120.00 120.00 -67.44 -73.87 -73.89 . . 0 "[ . 1 . 2 .]" 127 . 1 44 LEU N 1 44 LEU CA 1 44 LEU CB 1 44 LEU CG -120.00 0.00 -56.18 -71.39 -32.17 . . 0 "[ . 1 . 2 .]" 128 . 2 44 LEU N 2 44 LEU CA 2 44 LEU CB 2 44 LEU CG -120.00 0.00 -52.58 -80.89 -26.96 . . 0 "[ . 1 . 2 .]" 129 . 1 47 PHE N 1 47 PHE CA 1 47 PHE CB 1 47 PHE CG 120.00 -0.00 -164.24 -157.08 -159.29 . . 0 "[ . 1 . 2 .]" 130 . 2 47 PHE N 2 47 PHE CA 2 47 PHE CB 2 47 PHE CG 120.00 -0.00 -164.02 -169.88 -176.81 . . 0 "[ . 1 . 2 .]" 131 . 1 50 PHE N 1 50 PHE CA 1 50 PHE CB 1 50 PHE CG -120.00 0.00 -57.97 -55.29 -56.96 . . 0 "[ . 1 . 2 .]" 132 . 2 50 PHE N 2 50 PHE CA 2 50 PHE CB 2 50 PHE CG -120.00 0.00 -59.10 -153.30 -45.56 33.30 11 1 "[ . 1+ . 2 .]" 133 . 1 52 VAL N 1 52 VAL CA 1 52 VAL CB 1 52 VAL CG1 120.00 -120.00 108.06 104.12 102.50 17.50 1 24 "[+*****-***** ************]" 134 . 2 52 VAL N 2 52 VAL CA 2 52 VAL CB 2 52 VAL CG1 120.00 -120.00 108.16 105.08 104.69 16.74 5 24 "[****+***** *****-********]" 135 . 1 58 ARG N 1 58 ARG CA 1 58 ARG CB 1 58 ARG CG -120.00 0.00 -42.41 -136.18 -11.27 16.18 16 1 "[ . 1 .+ 2 .]" 136 . 2 58 ARG N 2 58 ARG CA 2 58 ARG CB 2 58 ARG CG -120.00 0.00 -41.93 -54.98 26.24 26.24 12 2 "[ . 1 + -. 2 .]" 137 . 1 61 ARG N 1 61 ARG CA 1 61 ARG CB 1 61 ARG CG 120.00 -0.00 -119.76 175.76 -46.90 . . 0 "[ . 1 . 2 .]" 138 . 2 61 ARG N 2 61 ARG CA 2 61 ARG CB 2 61 ARG CG 120.00 -0.00 -153.58 -178.08 178.17 . . 0 "[ . 1 . 2 .]" 139 . 1 65 THR N 1 65 THR CA 1 65 THR CB 1 65 THR CG2 -120.00 0.00 -51.04 -55.43 -56.20 . . 0 "[ . 1 . 2 .]" 140 . 2 65 THR N 2 65 THR CA 2 65 THR CB 2 65 THR CG2 -120.00 0.00 -51.87 -56.90 -39.88 . . 0 "[ . 1 . 2 .]" 141 . 1 67 GLU N 1 67 GLU CA 1 67 GLU CB 1 67 GLU CG 120.00 -0.00 -166.07 146.96 -137.02 . . 0 "[ . 1 . 2 .]" 142 . 2 67 GLU N 2 67 GLU CA 2 67 GLU CB 2 67 GLU CG 120.00 -0.00 -166.72 170.62 -160.00 . . 0 "[ . 1 . 2 .]" 143 . 1 70 GLU N 1 70 GLU CA 1 70 GLU CB 1 70 GLU CG -120.00 120.00 90.83 64.65 -128.06 14.95 20 9 "[* *. * 1 * .-* + * *]" 144 . 2 70 GLU N 2 70 GLU CA 2 70 GLU CB 2 70 GLU CG -120.00 120.00 75.04 64.56 -130.55 15.83 21 4 "[ . * 1 * . - 2+ .]" 145 . 1 71 ILE N 1 71 ILE CA 1 71 ILE CB 1 71 ILE CG2 120.00 -120.00 178.54 169.15 166.57 . . 0 "[ . 1 . 2 .]" 146 . 2 71 ILE N 2 71 ILE CA 2 71 ILE CB 2 71 ILE CG2 120.00 -120.00 179.28 -175.35 179.89 . . 0 "[ . 1 . 2 .]" 147 . 1 75 LYS N 1 75 LYS CA 1 75 LYS CB 1 75 LYS CG -120.00 0.00 -30.34 -52.42 13.43 13.43 13 1 "[ . 1 + . 2 .]" 148 . 2 75 LYS N 2 75 LYS CA 2 75 LYS CB 2 75 LYS CG -120.00 0.00 -32.59 -45.66 -24.26 . . 0 "[ . 1 . 2 .]" 149 . 1 76 VAL N 1 76 VAL CA 1 76 VAL CB 1 76 VAL CG1 120.00 -0.00 129.77 -34.68 146.05 13.83 22 1 "[ . 1 . 2 + .]" 150 . 2 76 VAL N 2 76 VAL CA 2 76 VAL CB 2 76 VAL CG1 120.00 -0.00 128.28 134.80 134.33 10.19 5 1 "[ + 1 . 2 .]" 151 . 1 80 LYS N 1 80 LYS CA 1 80 LYS CB 1 80 LYS CG -120.00 0.00 -68.85 -71.67 -72.10 15.46 20 1 "[ . 1 . + .]" 152 . 2 80 LYS N 2 80 LYS CA 2 80 LYS CB 2 80 LYS CG -120.00 0.00 -72.51 -68.46 -68.63 19.97 6 1 "[ .+ 1 . 2 .]" 153 . 1 83 LYS N 1 83 LYS CA 1 83 LYS CB 1 83 LYS CG -120.00 0.00 -101.23 -99.30 -100.15 . . 0 "[ . 1 . 2 .]" 154 . 2 83 LYS N 2 83 LYS CA 2 83 LYS CB 2 83 LYS CG -120.00 0.00 -101.92 -107.46 -95.33 . . 0 "[ . 1 . 2 .]" 155 . 1 85 LEU N 1 85 LEU CA 1 85 LEU CB 1 85 LEU CG 120.00 -120.00 179.15 176.98 -178.13 . . 0 "[ . 1 . 2 .]" 156 . 2 85 LEU N 2 85 LEU CA 2 85 LEU CB 2 85 LEU CG 120.00 -120.00 179.59 177.80 176.39 . . 0 "[ . 1 . 2 .]" 157 . 1 87 ASP N 1 87 ASP CA 1 87 ASP CB 1 87 ASP CG -120.00 0.00 -129.45 -132.00 -127.15 12.00 18 25 [********-********+*******] 158 . 2 87 ASP N 2 87 ASP CA 2 87 ASP CB 2 87 ASP CG -120.00 0.00 -128.97 -129.08 -129.56 11.64 4 25 [***+-********************] 159 . 1 89 VAL N 1 89 VAL CA 1 89 VAL CB 1 89 VAL CG1 0.00 120.00 85.75 86.19 86.13 . . 0 "[ . 1 . 2 .]" 160 . 2 89 VAL N 2 89 VAL CA 2 89 VAL CB 2 89 VAL CG1 0.00 120.00 85.06 87.26 86.95 21.55 12 1 "[ . 1 + . 2 .]" stop_ save_
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