NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
484202 | 2glo | 7097 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2glo save_dihedral_constraint_statistics_1 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 122 _TA_constraint_stats_list.Viol_count 808 _TA_constraint_stats_list.Viol_total 178031.25 _TA_constraint_stats_list.Viol_max 156.28 _TA_constraint_stats_list.Viol_rms 11.55 _TA_constraint_stats_list.Viol_average_all_restraints 3.65 _TA_constraint_stats_list.Viol_average_violations_only 11.02 _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 . 3 6 PHE N 3 6 PHE CA 3 6 PHE CB 3 6 PHE CG -90.00 -30.00 -69.15 -73.01 -64.41 . . 0 "[ . 1 . 2]" 2 . 3 9 HIS N 3 9 HIS CA 3 9 HIS CB 3 9 HIS CG 20.00 140.00 148.37 148.27 147.99 9.23 18 20 [*********-*******+**] 3 . 3 10 PHE N 3 10 PHE CA 3 10 PHE CB 3 10 PHE CG 150.00 -150.00 173.21 172.70 173.92 . . 0 "[ . 1 . 2]" 4 . 3 18 TYR N 3 18 TYR CA 3 18 TYR CB 3 18 TYR CG 150.00 -150.00 166.06 166.36 166.24 . . 0 "[ . 1 . 2]" 5 . 3 35 TYR N 3 35 TYR CA 3 35 TYR CB 3 35 TYR CG -90.00 -30.00 -89.42 -89.09 -89.46 0.33 1 0 "[ . 1 . 2]" 6 . 3 38 HIS N 3 38 HIS CA 3 38 HIS CB 3 38 HIS CG 60.00 -60.00 -140.32 -141.59 -144.91 . . 0 "[ . 1 . 2]" 7 . 3 45 TRP N 3 45 TRP CA 3 45 TRP CB 3 45 TRP CG -90.00 -30.00 -56.78 -58.55 -55.19 . . 0 "[ . 1 . 2]" 8 . 3 4 ARG N 3 4 ARG CA 3 4 ARG CB 3 4 ARG CG -90.00 -30.00 -56.02 -89.88 -34.24 . . 0 "[ . 1 . 2]" 9 . 3 8 PRO N 3 8 PRO CA 3 8 PRO CB 3 8 PRO CG 30.00 90.00 21.25 20.34 22.07 9.66 14 20 [*************+*-****] 10 . 3 11 LYS N 3 11 LYS CA 3 11 LYS CB 3 11 LYS CG -90.00 -30.00 -70.24 -71.39 -69.20 . . 0 "[ . 1 . 2]" 11 . 3 12 LEU N 3 12 LEU CA 3 12 LEU CB 3 12 LEU CG -90.00 -30.00 -63.27 -64.32 -61.21 . . 0 "[ . 1 . 2]" 12 . 3 15 LEU N 3 15 LEU CA 3 15 LEU CB 3 15 LEU CG -90.00 -30.00 -64.98 -65.00 -65.13 . . 0 "[ . 1 . 2]" 13 . 3 17 SER N 3 17 SER CA 3 17 SER CB 3 17 SER OG -90.00 -30.00 -124.22 -122.56 -122.77 37.73 12 20 [***-*******+********] 14 . 3 21 ASP N 3 21 ASP CA 3 21 ASP CB 3 21 ASP CG 150.00 -150.00 -176.43 -175.89 -176.41 . . 0 "[ . 1 . 2]" 15 . 3 25 LYS N 3 25 LYS CA 3 25 LYS CB 3 25 LYS CG 150.00 -150.00 153.16 154.88 154.61 . . 0 "[ . 1 . 2]" 16 . 3 27 ASN N 3 27 ASN CA 3 27 ASN CB 3 27 ASN CG -90.00 -30.00 -92.29 -92.19 -92.36 4.15 9 0 "[ . 1 . 2]" 17 . 3 28 GLN N 3 28 GLN CA 3 28 GLN CB 3 28 GLN CG -90.00 -30.00 -62.08 -66.62 -69.13 . . 0 "[ . 1 . 2]" 18 . 3 29 ARG N 3 29 ARG CA 3 29 ARG CB 3 29 ARG CG -90.00 -30.00 -51.21 -68.09 -28.52 1.48 7 0 "[ . 1 . 2]" 19 . 3 33 ARG N 3 33 ARG CA 3 33 ARG CB 3 33 ARG CG -90.00 -30.00 -89.23 -91.16 -86.29 1.16 14 0 "[ . 1 . 2]" 20 . 3 34 LYS N 3 34 LYS CA 3 34 LYS CB 3 34 LYS CG 150.00 -150.00 -170.79 -168.36 -169.43 . . 0 "[ . 1 . 2]" 21 . 3 36 ASN N 3 36 ASN CA 3 36 ASN CB 3 36 ASN CG 150.00 -150.00 -169.43 -172.44 -164.42 . . 0 "[ . 1 . 2]" 22 . 3 41 GLN N 3 41 GLN CA 3 41 GLN CB 3 41 GLN CG -90.00 -30.00 -87.04 -87.06 -87.56 0.23 13 0 "[ . 1 . 2]" 23 . 3 43 GLN N 3 43 GLN CA 3 43 GLN CB 3 43 GLN CG -90.00 -30.00 -90.05 -91.39 -92.02 7.30 6 2 "[ .+ 1- . 2]" 24 . 3 44 LYS N 3 44 LYS CA 3 44 LYS CB 3 44 LYS CG -90.00 -30.00 -83.97 -90.30 -76.82 0.30 16 0 "[ . 1 . 2]" 25 . 3 46 LEU N 3 46 LEU CA 3 46 LEU CB 3 46 LEU CG -90.00 -30.00 -82.09 -80.25 -80.47 . . 0 "[ . 1 . 2]" 26 . 3 48 CYS N 3 48 CYS CA 3 48 CYS CB 3 48 CYS SG 150.00 -150.00 -143.61 -145.34 -142.47 7.53 20 19 "[***-** ************+]" 27 . 3 49 GLU N 3 49 GLU CA 3 49 GLU CB 3 49 GLU CG 150.00 -150.00 153.14 149.10 159.30 0.90 7 0 "[ . 1 . 2]" 28 . 3 52 LEU N 3 52 LEU CA 3 52 LEU CB 3 52 LEU CG -90.00 -30.00 -68.52 -69.50 -67.31 . . 0 "[ . 1 . 2]" 29 . 3 58 ASN N 3 58 ASN CA 3 58 ASN CB 3 58 ASN CG 150.00 -150.00 -170.32 179.04 -158.87 . . 0 "[ . 1 . 2]" 30 . 3 59 ASN N 3 59 ASN CA 3 59 ASN CB 3 59 ASN CG 150.00 -150.00 -163.82 -171.84 -150.91 . . 0 "[ . 1 . 2]" 31 . 3 1 GLY C 3 2 SER N 3 2 SER CA 3 2 SER C -97.00 -65.00 -103.32 -84.14 -84.67 132.68 17 7 "[ * .- * * . +**2]" 32 . 3 2 SER N 3 2 SER CA 3 2 SER C 3 3 ARG N 121.00 167.00 148.51 -83.65 -179.60 142.62 10 12 "[ * * *-*+* **. * **]" 33 . 3 2 SER C 3 3 ARG N 3 3 ARG CA 3 3 ARG C -121.00 -75.00 -143.27 75.63 -88.77 156.28 10 14 "[*** .* **+-* .*****]" 34 . 3 3 ARG N 3 3 ARG CA 3 3 ARG C 3 4 ARG N 115.00 157.00 92.76 76.85 109.49 38.15 10 20 [******-**+**********] 35 . 3 4 ARG C 3 5 ILE N 3 5 ILE CA 3 5 ILE C -122.00 -86.00 -94.23 -97.93 -88.73 . . 0 "[ . 1 . 2]" 36 . 3 5 ILE N 3 5 ILE CA 3 5 ILE C 3 6 PHE N 123.00 153.00 110.29 95.59 94.45 28.55 1 10 "[+* *- ** ** *. * 2]" 37 . 3 5 ILE C 3 6 PHE N 3 6 PHE CA 3 6 PHE C -132.67 -102.67 -95.33 -94.34 -95.50 14.52 16 14 "[*** .* *** *- *+ ***]" 38 . 3 6 PHE N 3 6 PHE CA 3 6 PHE C 3 7 THR N 134.99 161.07 128.35 122.50 134.50 12.49 2 10 "[*+ ** ** *- *. * 2]" 39 . 3 6 PHE C 3 7 THR N 3 7 THR CA 3 7 THR C -110.01 -71.79 -91.67 -95.57 -88.36 . . 0 "[ . 1 . 2]" 40 . 3 7 THR N 3 7 THR CA 3 7 THR C 3 8 PRO N 134.40 171.82 154.05 152.32 150.89 . . 0 "[ . 1 . 2]" 41 . 3 7 THR C 3 8 PRO N 3 8 PRO CA 3 8 PRO C -62.17 -53.35 -61.29 -63.67 -59.39 1.50 11 0 "[ . 1 . 2]" 42 . 3 8 PRO N 3 8 PRO CA 3 8 PRO C 3 9 HIS N -40.80 -29.10 -36.84 -36.25 -36.33 . . 0 "[ . 1 . 2]" 43 . 3 8 PRO C 3 9 HIS N 3 9 HIS CA 3 9 HIS C -69.19 -58.97 -61.47 -64.31 -59.23 . . 0 "[ . 1 . 2]" 44 . 3 9 HIS N 3 9 HIS CA 3 9 HIS C 3 10 PHE N -47.14 -38.50 -39.37 -39.26 -39.51 0.19 11 0 "[ . 1 . 2]" 45 . 3 9 HIS C 3 10 PHE N 3 10 PHE CA 3 10 PHE C -71.32 -60.68 -66.41 -67.70 -65.59 . . 0 "[ . 1 . 2]" 46 . 3 10 PHE N 3 10 PHE CA 3 10 PHE C 3 11 LYS N -52.23 -42.25 -46.89 -47.08 -47.21 . . 0 "[ . 1 . 2]" 47 . 3 10 PHE C 3 11 LYS N 3 11 LYS CA 3 11 LYS C -67.37 -54.59 -54.11 -53.79 -54.08 1.45 4 0 "[ . 1 . 2]" 48 . 3 11 LYS N 3 11 LYS CA 3 11 LYS C 3 12 LEU N -49.85 -39.89 -49.31 -49.99 -48.72 0.14 2 0 "[ . 1 . 2]" 49 . 3 11 LYS C 3 12 LEU N 3 12 LEU CA 3 12 LEU C -69.52 -57.88 -69.39 -69.07 -69.16 0.68 11 0 "[ . 1 . 2]" 50 . 3 12 LEU N 3 12 LEU CA 3 12 LEU C 3 13 GLN N -43.11 -24.13 -21.89 -22.14 -22.28 2.57 11 0 "[ . 1 . 2]" 51 . 3 12 LEU C 3 13 GLN N 3 13 GLN CA 3 13 GLN C -74.10 -61.36 -74.85 -75.72 -74.29 1.62 13 0 "[ . 1 . 2]" 52 . 3 13 GLN N 3 13 GLN CA 3 13 GLN C 3 14 VAL N -50.00 -36.48 -36.90 -36.84 -36.89 0.34 13 0 "[ . 1 . 2]" 53 . 3 13 GLN C 3 14 VAL N 3 14 VAL CA 3 14 VAL C -68.50 -59.58 -67.47 -68.03 -66.38 . . 0 "[ . 1 . 2]" 54 . 3 14 VAL N 3 14 VAL CA 3 14 VAL C 3 15 LEU N -49.38 -40.06 -53.04 -53.57 -52.34 4.19 6 0 "[ . 1 . 2]" 55 . 3 14 VAL C 3 15 LEU N 3 15 LEU CA 3 15 LEU C -63.21 -54.91 -59.61 -60.67 -60.80 . . 0 "[ . 1 . 2]" 56 . 3 15 LEU N 3 15 LEU CA 3 15 LEU C 3 16 GLU N -47.54 -30.62 -44.71 -44.85 -44.89 . . 0 "[ . 1 . 2]" 57 . 3 15 LEU C 3 16 GLU N 3 16 GLU CA 3 16 GLU C -69.42 -55.44 -62.75 -63.62 -61.93 . . 0 "[ . 1 . 2]" 58 . 3 16 GLU N 3 16 GLU CA 3 16 GLU C 3 17 SER N -43.90 -35.32 -51.16 -50.90 -51.14 8.76 6 20 [*****+****-*********] 59 . 3 16 GLU C 3 17 SER N 3 17 SER CA 3 17 SER C -72.61 -62.51 -55.71 -56.95 -54.29 8.22 6 20 [*****+****-*********] 60 . 3 17 SER N 3 17 SER CA 3 17 SER C 3 18 TYR N -47.51 -32.29 -49.99 -49.53 -49.76 4.22 20 0 "[ . 1 . 2]" 61 . 3 17 SER C 3 18 TYR N 3 18 TYR CA 3 18 TYR C -72.39 -57.75 -49.81 -50.62 -48.77 8.98 20 20 [**-****************+] 62 . 3 18 TYR N 3 18 TYR CA 3 18 TYR C 3 19 ARG N -46.07 -29.43 -39.62 -39.91 -40.15 . . 0 "[ . 1 . 2]" 63 . 3 18 TYR C 3 19 ARG N 3 19 ARG CA 3 19 ARG C -97.66 -75.20 -89.53 -90.53 -88.75 . . 0 "[ . 1 . 2]" 64 . 3 19 ARG N 3 19 ARG CA 3 19 ARG C 3 20 ASN N -42.91 -9.45 -9.64 -9.43 -9.69 2.47 19 0 "[ . 1 . 2]" 65 . 3 19 ARG C 3 20 ASN N 3 20 ASN CA 3 20 ASN C -120.00 -78.00 -142.93 -142.88 -142.92 24.67 19 20 [******************+-] 66 . 3 20 ASN N 3 20 ASN CA 3 20 ASN C 3 21 ASP N -46.00 4.00 -22.44 -25.23 -20.50 . . 0 "[ . 1 . 2]" 67 . 3 21 ASP C 3 22 ASN N 3 22 ASN CA 3 22 ASN C -69.59 -53.51 -55.56 -56.52 -54.64 . . 0 "[ . 1 . 2]" 68 . 3 22 ASN N 3 22 ASN CA 3 22 ASN C 3 23 ASP N -45.23 -21.89 -16.73 -17.56 -18.13 6.41 19 11 "[ *- .** *1* *** *+2]" 69 . 3 22 ASN C 3 23 ASP N 3 23 ASP CA 3 23 ASP C -83.16 -62.72 -87.37 -88.47 -85.56 5.31 19 2 "[ . - 1 . +2]" 70 . 3 23 ASP N 3 23 ASP CA 3 23 ASP C 3 24 CYS N -35.03 -1.71 -24.17 -25.41 -22.58 . . 0 "[ . 1 . 2]" 71 . 3 26 GLY C 3 27 ASN N 3 27 ASN CA 3 27 ASN C -112.00 -80.00 -128.74 -131.24 -126.04 19.24 9 20 [****-***+***********] 72 . 3 27 ASN N 3 27 ASN CA 3 27 ASN C 3 28 GLN N 111.00 161.00 135.56 135.35 134.93 . . 0 "[ . 1 . 2]" 73 . 3 27 ASN C 3 28 GLN N 3 28 GLN CA 3 28 GLN C -59.98 -53.66 -89.16 -90.68 -87.89 30.70 14 20 [-************+******] 74 . 3 28 GLN N 3 28 GLN CA 3 28 GLN C 3 29 ARG N -49.65 -27.53 -38.48 -41.28 -35.89 . . 0 "[ . 1 . 2]" 75 . 3 28 GLN C 3 29 ARG N 3 29 ARG CA 3 29 ARG C -69.88 -54.44 -60.98 -61.18 -61.45 . . 0 "[ . 1 . 2]" 76 . 3 29 ARG N 3 29 ARG CA 3 29 ARG C 3 30 ALA N -50.53 -36.55 -45.54 -47.28 -43.59 . . 0 "[ . 1 . 2]" 77 . 3 29 ARG C 3 30 ALA N 3 30 ALA CA 3 30 ALA C -68.43 -61.27 -61.64 -65.68 -58.57 2.70 6 0 "[ . 1 . 2]" 78 . 3 30 ALA N 3 30 ALA CA 3 30 ALA C 3 31 THR N -45.03 -33.39 -42.62 -43.12 -43.32 . . 0 "[ . 1 . 2]" 79 . 3 30 ALA C 3 31 THR N 3 31 THR CA 3 31 THR C -78.62 -58.36 -64.45 -66.31 -62.30 . . 0 "[ . 1 . 2]" 80 . 3 31 THR N 3 31 THR CA 3 31 THR C 3 32 ALA N -45.13 -32.17 -42.85 -44.51 -41.31 . . 0 "[ . 1 . 2]" 81 . 3 31 THR C 3 32 ALA N 3 32 ALA CA 3 32 ALA C -65.94 -56.88 -63.82 -65.20 -62.70 . . 0 "[ . 1 . 2]" 82 . 3 32 ALA N 3 32 ALA CA 3 32 ALA C 3 33 ARG N -46.30 -33.54 -36.21 -35.63 -35.99 . . 0 "[ . 1 . 2]" 83 . 3 32 ALA C 3 33 ARG N 3 33 ARG CA 3 33 ARG C -70.29 -60.63 -68.54 -68.26 -68.48 . . 0 "[ . 1 . 2]" 84 . 3 33 ARG N 3 33 ARG CA 3 33 ARG C 3 34 LYS N -43.54 -35.64 -47.20 -49.22 -45.52 5.68 15 2 "[ . 1 + - 2]" 85 . 3 33 ARG C 3 34 LYS N 3 34 LYS CA 3 34 LYS C -72.40 -61.02 -62.42 -63.59 -60.56 0.46 15 0 "[ . 1 . 2]" 86 . 3 34 LYS N 3 34 LYS CA 3 34 LYS C 3 35 TYR N -39.93 -21.11 -40.52 -45.96 -36.85 6.03 5 1 "[ + 1 . 2]" 87 . 3 34 LYS C 3 35 TYR N 3 35 TYR CA 3 35 TYR C -101.84 -81.24 -93.71 -93.94 -95.24 . . 0 "[ . 1 . 2]" 88 . 3 35 TYR N 3 35 TYR CA 3 35 TYR C 3 36 ASN N -34.78 10.32 -2.14 -3.37 -3.50 . . 0 "[ . 1 . 2]" 89 . 3 38 HIS C 3 39 ARG N 3 39 ARG CA 3 39 ARG C -78.56 -63.92 -88.15 -96.22 -81.97 17.66 16 16 "[****.****1 ****+**-2]" 90 . 3 39 ARG N 3 39 ARG CA 3 39 ARG C 3 40 ARG N -46.25 -26.91 -9.73 -9.47 -10.34 27.04 13 20 [***********-+*******] 91 . 3 39 ARG C 3 40 ARG N 3 40 ARG CA 3 40 ARG C -75.00 -61.00 -75.14 -75.70 -76.35 8.56 13 4 "[ .* 1 + . -*2]" 92 . 3 40 ARG N 3 40 ARG CA 3 40 ARG C 3 41 GLN N -44.00 -32.00 -34.04 -33.48 -34.06 0.59 9 0 "[ . 1 . 2]" 93 . 3 40 ARG C 3 41 GLN N 3 41 GLN CA 3 41 GLN C -71.22 -57.76 -66.27 -69.41 -62.27 . . 0 "[ . 1 . 2]" 94 . 3 41 GLN N 3 41 GLN CA 3 41 GLN C 3 42 ILE N -47.48 -34.52 -42.30 -43.07 -43.57 . . 0 "[ . 1 . 2]" 95 . 3 41 GLN C 3 42 ILE N 3 42 ILE CA 3 42 ILE C -68.77 -58.39 -62.50 -64.26 -60.64 . . 0 "[ . 1 . 2]" 96 . 3 42 ILE N 3 42 ILE CA 3 42 ILE C 3 43 GLN N -51.13 -36.25 -41.68 -40.73 -41.24 . . 0 "[ . 1 . 2]" 97 . 3 42 ILE C 3 43 GLN N 3 43 GLN CA 3 43 GLN C -64.25 -54.01 -66.42 -67.47 -67.50 4.33 10 0 "[ . 1 . 2]" 98 . 3 43 GLN N 3 43 GLN CA 3 43 GLN C 3 44 LYS N -49.05 -31.69 -43.05 -42.59 -42.79 . . 0 "[ . 1 . 2]" 99 . 3 43 GLN C 3 44 LYS N 3 44 LYS CA 3 44 LYS C -68.09 -62.25 -68.57 -70.94 -66.71 2.85 12 0 "[ . 1 . 2]" 100 . 3 44 LYS N 3 44 LYS CA 3 44 LYS C 3 45 TRP N -48.29 -24.39 -45.15 -45.23 -45.39 . . 0 "[ . 1 . 2]" 101 . 3 44 LYS C 3 45 TRP N 3 45 TRP CA 3 45 TRP C -85.67 -57.37 -60.74 -62.29 -59.22 . . 0 "[ . 1 . 2]" 102 . 3 45 TRP N 3 45 TRP CA 3 45 TRP C 3 46 LEU N -47.92 -32.40 -30.99 -31.17 -32.19 5.35 7 2 "[ - + 1 . 2]" 103 . 3 45 TRP C 3 46 LEU N 3 46 LEU CA 3 46 LEU C -66.31 -55.33 -63.27 -66.47 -59.91 0.16 7 0 "[ . 1 . 2]" 104 . 3 46 LEU N 3 46 LEU CA 3 46 LEU C 3 47 GLN N -47.44 -34.04 -36.57 -38.03 -35.02 . . 0 "[ . 1 . 2]" 105 . 3 46 LEU C 3 47 GLN N 3 47 GLN CA 3 47 GLN C -70.78 -54.14 -66.19 -67.27 -65.27 . . 0 "[ . 1 . 2]" 106 . 3 47 GLN N 3 47 GLN CA 3 47 GLN C 3 48 CYS N -48.83 -22.97 -5.33 -4.48 -4.94 18.84 8 20 [*******+-***********] 107 . 3 47 GLN C 3 48 CYS N 3 48 CYS CA 3 48 CYS C -120.03 -81.59 -152.87 -154.35 -150.99 34.32 12 20 [******-****+********] 108 . 3 48 CYS N 3 48 CYS CA 3 48 CYS C 3 49 GLU N -17.23 26.41 19.71 17.15 22.57 . . 0 "[ . 1 . 2]" 109 . 3 48 CYS C 3 49 GLU N 3 49 GLU CA 3 49 GLU C -61.18 -50.86 -56.08 -54.84 -55.15 . . 0 "[ . 1 . 2]" 110 . 3 49 GLU N 3 49 GLU CA 3 49 GLU C 3 50 SER N -52.26 -34.00 -39.59 -41.19 -38.25 . . 0 "[ . 1 . 2]" 111 . 3 49 GLU C 3 50 SER N 3 50 SER CA 3 50 SER C -67.49 -56.67 -57.39 -58.10 -56.56 0.11 7 0 "[ . 1 . 2]" 112 . 3 50 SER N 3 50 SER CA 3 50 SER C 3 51 ASN N -44.82 -34.26 -37.92 -37.53 -37.67 . . 0 "[ . 1 . 2]" 113 . 3 50 SER C 3 51 ASN N 3 51 ASN CA 3 51 ASN C -72.83 -61.25 -72.70 -72.40 -72.49 0.93 11 0 "[ . 1 . 2]" 114 . 3 51 ASN N 3 51 ASN CA 3 51 ASN C 3 52 LEU N -48.40 -31.88 -30.67 -30.48 -30.69 1.94 4 0 "[ . 1 . 2]" 115 . 3 51 ASN C 3 52 LEU N 3 52 LEU CA 3 52 LEU C -70.22 -55.10 -63.42 -64.28 -62.84 . . 0 "[ . 1 . 2]" 116 . 3 52 LEU N 3 52 LEU CA 3 52 LEU C 3 53 ARG N -45.48 -36.38 -39.74 -40.91 -38.69 . . 0 "[ . 1 . 2]" 117 . 3 52 LEU C 3 53 ARG N 3 53 ARG CA 3 53 ARG C -73.52 -59.68 -60.15 -61.19 -58.51 1.17 1 0 "[ . 1 . 2]" 118 . 3 53 ARG N 3 53 ARG CA 3 53 ARG C 3 54 SER N -44.59 -32.53 -48.56 -48.49 -48.54 4.43 8 0 "[ . 1 . 2]" 119 . 3 53 ARG C 3 54 SER N 3 54 SER CA 3 54 SER C -70.38 -56.02 -72.94 -74.70 -70.25 4.32 19 0 "[ . 1 . 2]" 120 . 3 54 SER N 3 54 SER CA 3 54 SER C 3 55 SER N -51.92 -32.54 -25.93 -23.54 -23.68 11.57 20 17 "[******* *****- ***+]" 121 . 3 54 SER C 3 55 SER N 3 55 SER CA 3 55 SER C -77.00 -59.04 -73.49 -71.46 -71.76 6.39 9 1 "[ . +1 . 2]" 122 . 3 55 SER N 3 55 SER CA 3 55 SER C 3 56 VAL N -48.83 -25.39 -29.09 -41.11 22.41 47.80 9 2 "[ . -+1 . 2]" stop_ save_
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