data_2yen_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2yen _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.641 ' HA ' ' HA3' ' A' ' 9' ' ' GLY . 60.2 m . . . . . 0 CA--C 1.514 -0.434 0 CA-C-O 121.99 0.9 . . . . 0.0 112.284 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 63.7 m -108.46 16.18 23.26 Favored 'General case' 0 C--N 1.262 -3.202 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.706 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -117.18 -23.23 7.98 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.569 -178.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.59 163.75 13.56 Favored Glycine 0 N--CA 1.434 -1.494 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -70.75 -19.12 31.79 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.156 2.571 . . . . 0.0 114.493 -175.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.445 ' HZ2' ' HB3' ' A' ' 8' ' ' LYS . 7.6 mtpm? -104.67 -4.42 22.48 Favored 'General case' 0 C--N 1.311 -1.086 0 O-C-N 122.013 -0.43 . . . . 0.0 111.852 -175.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.641 ' HA3' ' HA ' ' A' ' 3' ' ' CYS . . . -63.54 -52.77 43.59 Favored Glycine 0 C--O 1.219 -0.836 0 C-N-CA 121.116 -0.564 . . . . 0.0 112.995 -176.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -84.41 5.53 26.82 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.688 0.756 . . . . 0.0 110.688 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.1 t -91.75 -15.39 28.41 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 31.3 m -86.7 127.12 34.95 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -61.59 -33.94 74.76 Favored 'General case' 0 C--O 1.198 -1.616 0 CA-C-O 118.923 -0.56 . . . . 0.0 112.351 -174.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.6 t90 -57.37 -44.49 84.47 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.29 0.567 . . . . 0.0 110.262 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.435 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 68.1 m -70.23 -34.89 73.42 Favored 'General case' 0 C--O 1.207 -1.145 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.097 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -66.15 -39.4 89.8 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.802 0.334 . . . . 0.0 110.334 175.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -70.25 -52.14 25.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.299 0.571 . . . . 0.0 111.471 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -93.36 -38.19 11.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -170.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.13 124.69 34.06 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.365 0.602 . . . . 0.0 110.789 -174.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -69.44 -21.92 63.7 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.535 -177.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.2 p -77.46 -13.82 59.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.076 0.465 . . . . 0.0 111.685 178.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.8 m . . . . . 0 C--O 1.241 0.62 0 CA-C-O 121.258 0.551 . . . . 0.0 110.206 176.702 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.409 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 34.2 m . . . . . 0 N--CA 1.444 -0.755 0 CA-C-O 121.496 0.665 . . . . 0.0 111.264 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 18.9 m -93.93 25.72 3.53 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.324 -176.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -88.13 -24.53 23.34 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.001 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.52 176.88 47.45 Favored Glycine 0 N--CA 1.435 -1.402 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.085 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -62.85 -21.87 73.43 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.676 2.918 . . . . 0.0 114.219 -177.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -89.15 -6.35 57.05 Favored 'General case' 0 C--O 1.24 0.567 0 O-C-N 121.927 -0.483 . . . . 0.0 110.158 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.409 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -70.43 -32.71 68.03 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.151 -1.58 . . . . 0.0 109.151 175.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.1 m -80.18 2.08 25.69 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.661 -0.769 . . . . 0.0 112.243 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.9 m -90.87 25.0 2.53 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.832 0.825 . . . . 0.0 109.79 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.498 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 12.4 m -127.52 131.7 50.04 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -64.4 -39.9 94.75 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.479 -175.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -54.19 -39.25 66.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.703 0.763 . . . . 0.0 110.296 177.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.498 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 55.9 m -74.24 -31.89 62.77 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.57 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -72.39 -37.0 68.82 Favored 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -75.74 -47.46 25.9 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.234 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -100.01 -30.73 11.82 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 114.714 1.376 . . . . 0.0 114.714 -168.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -89.94 131.73 35.69 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.823 -175.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -66.96 -31.09 71.43 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.097 -176.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.7 p -69.21 -23.79 63.94 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.056 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 15' ' ' CYS . 56.3 m . . . . . 0 N--CA 1.435 -1.214 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.3 m . . . . . 0 N--CA 1.438 -1.035 0 CA-C-O 122.105 0.955 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 45.5 m -88.09 8.78 25.12 Favored 'General case' 0 C--N 1.275 -2.64 0 CA-C-N 114.96 -1.018 . . . . 0.0 113.739 -172.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -111.25 42.36 1.67 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 122.48 1.133 . . . . 0.0 108.368 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 170.86 144.12 4.24 Favored Glycine 0 N--CA 1.424 -2.102 0 CA-C-N 114.5 -1.227 . . . . 0.0 110.146 177.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_exo -62.38 -28.06 78.06 Favored 'Trans proline' 0 C--O 1.214 -0.709 0 C-N-CA 122.619 2.213 . . . . 0.0 112.109 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -103.86 11.27 35.86 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 121.115 0.483 . . . . 0.0 109.804 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.28 -32.22 52.56 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 177.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.4 m -91.61 29.09 1.58 Allowed 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 122.799 0.44 . . . . 0.0 111.408 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.5 p -62.5 -45.79 91.4 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 123.799 0.839 . . . . 0.0 110.969 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.0 m -67.49 137.59 55.93 Favored 'General case' 0 C--O 1.253 1.261 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.055 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 12.6 tmtt? -59.39 -33.86 71.72 Favored 'General case' 0 C--O 1.208 -1.083 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 175.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -51.14 -50.29 59.17 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.6 m -65.32 -45.85 82.67 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.541 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -64.75 -28.12 69.36 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.057 0.456 . . . . 0.0 111.31 -178.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -88.34 -47.49 8.35 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.917 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -93.71 -23.22 18.3 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -172.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -95.79 120.87 36.82 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 121.713 0.768 . . . . 0.0 109.976 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -74.87 -22.48 58.64 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.995 -175.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 p -83.96 3.23 35.07 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 114.775 -1.102 . . . . 0.0 111.885 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 95.4 m . . . . . 0 N--CA 1.443 -0.821 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 176.856 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.472 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 64.6 m . . . . . 0 C--O 1.212 -0.893 0 CA-C-O 121.485 0.659 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.6 m -114.48 41.28 2.35 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.057 0.932 . . . . 0.0 110.157 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -93.59 12.05 26.64 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.279 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 159.6 164.99 15.67 Favored Glycine 0 N--CA 1.432 -1.584 0 N-CA-C 110.044 -1.223 . . . . 0.0 110.044 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -59.54 -18.38 46.65 Favored 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.472 2.782 . . . . 0.0 115.287 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -104.12 13.72 31.87 Favored 'General case' 0 C--O 1.241 0.61 0 O-C-N 121.386 -0.821 . . . . 0.0 111.731 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.13 -39.53 52.87 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.298 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.407 ' HA ' ' HB3' ' A' ' 15' ' ' CYS . 74.0 m -97.21 34.04 1.84 Allowed 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.126 0.488 . . . . 0.0 111.373 -178.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.4 p -72.82 -36.9 67.62 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.6 0.714 . . . . 0.0 109.239 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -69.89 144.7 52.39 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.657 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -57.54 -44.67 85.33 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 123.991 0.916 . . . . 0.0 112.592 -176.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.0 t90 -62.96 -49.95 72.7 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.472 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 68.6 m -57.03 -41.07 77.95 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -60.97 -37.95 84.22 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.774 0.321 . . . . 0.0 111.019 178.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.24 -51.36 11.05 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 177.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 72.1 m-70 -88.88 -17.69 29.13 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 115.05 1.5 . . . . 0.0 115.05 -165.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.94 114.78 23.11 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 44.2 mtm180 -67.73 -24.44 65.37 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.348 0.594 . . . . 0.0 110.131 -176.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -71.39 -12.5 61.45 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.591 176.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.0 m . . . . . 0 N--CA 1.433 -1.325 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 176.312 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.437 ' HB2' ' HB3' ' A' ' 15' ' ' CYS . 97.0 m . . . . . 0 C--O 1.223 -0.324 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 61.0 m -117.2 11.96 14.27 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 122.53 1.157 . . . . 0.0 108.603 171.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -144.57 150.12 36.96 Favored 'General case' 0 N--CA 1.425 -1.691 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 136.02 -164.43 25.01 Favored Glycine 0 C--N 1.292 -1.881 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.34 -42.02 45.17 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.138 2.559 . . . . 0.0 113.46 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -134.45 17.49 3.66 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 120.558 0.218 . . . . 0.0 111.094 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.31 -83.6 0.75 Allowed Glycine 0 N--CA 1.433 -1.526 0 N-CA-C 109.19 -1.564 . . . . 0.0 109.19 -174.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.8 m -101.3 64.12 1.01 Allowed 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.357 0.598 . . . . 0.0 109.515 177.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.2 t -78.04 -32.58 51.02 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -71.26 131.46 43.51 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -54.94 -46.68 74.99 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.256 1.022 . . . . 0.0 112.601 -173.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 91.3 t90 -55.71 -44.21 77.21 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.576 0.703 . . . . 0.0 110.664 178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 3' ' ' CYS . 60.7 m -67.26 -32.05 72.81 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.707 -176.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -64.71 -32.32 73.94 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -97.09 -20.52 17.95 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -114.9 -18.32 11.32 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 -170.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.13 158.74 31.43 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 118.727 0.694 . . . . 0.0 111.31 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -84.18 -37.95 21.24 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.4 p -69.78 -13.72 62.42 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.899 -1.046 . . . . 0.0 113.249 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 63.2 m . . . . . 0 N--CA 1.437 -1.087 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.165 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 75.1 m . . . . . 0 C--O 1.246 0.891 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 66.6 m -83.69 70.67 10.36 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-O 121.557 0.694 . . . . 0.0 111.037 -176.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 32.5 p-10 -149.28 13.19 0.85 Allowed 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.281 176.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -160.25 163.07 33.69 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.73 -15.63 37.3 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.38 2.72 . . . . 0.0 114.173 -176.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -102.62 1.9 35.32 Favored 'General case' 0 C--N 1.307 -1.253 0 O-C-N 122.088 -0.383 . . . . 0.0 110.225 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.46 -59.95 9.33 Favored Glycine 0 C--O 1.218 -0.897 0 O-C-N 123.717 0.635 . . . . 0.0 113.32 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.9 m -82.49 -3.14 55.32 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.528 0.68 . . . . 0.0 111.146 -177.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.8 m -87.45 -16.01 36.06 Favored 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.315 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.9 m -79.1 134.26 36.74 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.673 ' HA ' ' HE2' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -51.7 -55.28 20.47 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.914 0.886 . . . . 0.0 112.897 -175.093 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.8 t90 -62.0 -49.22 76.92 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -177.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.0 m -61.92 -35.2 77.67 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.47 -175.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -58.54 -38.95 78.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.86 0.362 . . . . 0.0 111.383 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -103.3 -27.15 12.64 Favored 'General case' 0 C--N 1.31 -1.124 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -175.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -102.9 -7.5 21.47 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -172.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.24 119.79 39.94 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 107.216 -1.401 . . . . 0.0 107.216 173.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -66.23 -19.69 65.9 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.982 -173.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 3.4 p -77.61 -4.06 44.02 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.958 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 N--CA 1.441 -0.901 0 CA-C-O 121.403 0.621 . . . . 0.0 110.381 177.702 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.483 ' HB2' ' HB3' ' A' ' 19' ' ' ALA . 70.6 m . . . . . 0 C--O 1.206 -1.189 0 CA-C-O 121.04 0.447 . . . . 0.0 110.382 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.402 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 71.2 m -116.19 11.23 15.12 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.847 0.832 . . . . 0.0 109.658 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -101.06 116.7 33.45 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.436 -177.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 114.9 168.92 15.9 Favored Glycine 0 C--N 1.303 -1.302 0 C-N-CA 121.185 -0.531 . . . . 0.0 112.349 173.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -66.02 -18.03 56.25 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 123.283 2.655 . . . . 0.0 112.424 179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.587 ' HB2' ' HZ3' ' A' ' 8' ' ' LYS . 10.0 mtmp? -88.88 -60.26 2.01 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.69 -98.69 1.07 Allowed Glycine 0 N--CA 1.424 -2.124 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 79.6 m -90.56 77.25 6.47 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 121.977 0.894 . . . . 0.0 109.47 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.533 ' HB3' ' HB3' ' A' ' 8' ' ' LYS . 4.1 p -94.67 -27.1 16.04 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 114.253 -1.34 . . . . 0.0 109.002 175.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 t -90.06 134.67 34.11 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 174.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -63.79 -37.4 87.24 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 123.642 0.588 . . . . 0.0 111.551 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.5 t90 -59.07 -41.25 87.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.392 0.615 . . . . 0.0 109.753 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 96.2 m -65.44 -29.41 70.09 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.718 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -71.38 -19.71 62.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.275 0.559 . . . . 0.0 110.876 -176.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -100.61 -13.26 18.65 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 62.0 m-70 -120.6 -22.92 6.2 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.679 1.362 . . . . 0.0 114.679 -171.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.483 ' HB3' ' HB2' ' A' ' 3' ' ' CYS . . . -77.71 140.86 39.57 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -66.38 -17.31 64.7 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -176.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.3 p -87.45 -3.66 59.01 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 122.906 0.482 . . . . 0.0 111.101 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 70.9 m . . . . . 0 N--CA 1.439 -1.004 0 CA-C-O 121.39 0.614 . . . . 0.0 110.075 -179.381 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.715 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 71.3 m . . . . . 0 CA--C 1.506 -0.722 0 CA-C-O 122.173 0.987 . . . . 0.0 109.733 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 73.1 m -84.51 73.14 10.57 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.022 175.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -120.42 2.44 10.76 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 114.16 -1.382 . . . . 0.0 108.96 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.49 -163.12 33.84 Favored Glycine 0 N--CA 1.421 -2.326 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.007 -177.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -86.62 4.9 6.12 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.286 2.657 . . . . 0.0 115.565 -174.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.428 ' HZ3' ' HB3' ' A' ' 8' ' ' LYS . 2.3 mmmp? -123.99 5.96 8.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.542 0.61 . . . . 0.0 110.216 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.715 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -79.97 -33.52 32.98 Favored Glycine 0 C--O 1.214 -1.096 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.705 -175.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 67.0 m -92.6 21.92 5.08 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.328 0.585 . . . . 0.0 110.937 -178.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.6 t -76.1 -48.7 19.72 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -178.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.7 m -59.29 137.78 57.86 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.188 176.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -50.72 -48.01 58.98 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.155 0.982 . . . . 0.0 110.864 -178.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.7 t90 -56.43 -40.91 75.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.557 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.9 m -70.85 -32.44 69.46 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.526 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.1 ttt85 -72.85 -18.93 61.39 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 121.215 0.531 . . . . 0.0 110.877 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -98.99 -45.27 6.01 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.587 0.708 . . . . 0.0 111.144 176.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 34.1 m-70 -89.88 -23.51 21.62 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -168.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.84 126.68 30.96 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 177.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -72.47 -16.18 61.8 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.509 0.671 . . . . 0.0 110.948 -174.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -94.82 0.12 54.59 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 114.755 -1.112 . . . . 0.0 111.314 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 84.4 m . . . . . 0 C--N 1.321 -0.64 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.056 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 89.9 m . . . . . 0 C--O 1.209 -1.034 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 58.5 m -113.28 17.18 18.77 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.18 0.99 . . . . 0.0 108.751 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -89.81 -22.11 22.27 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.59 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.69 154.79 26.05 Favored Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.72 -28.94 82.72 Favored 'Trans proline' 0 C--O 1.244 0.812 0 C-N-CA 123.224 2.616 . . . . 0.0 113.597 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -90.27 -1.72 57.95 Favored 'General case' 0 N--CA 1.438 -1.039 0 O-C-N 121.866 -0.521 . . . . 0.0 111.345 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.05 -42.04 78.79 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.3 m -72.26 12.73 0.4 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.6 m -82.69 -22.53 34.5 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 m -72.81 123.08 22.65 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -62.59 -33.78 75.67 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.243 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -60.4 -36.71 78.76 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.758 0.79 . . . . 0.0 109.435 178.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 91.7 m -80.11 -11.86 59.72 Favored 'General case' 0 C--O 1.2 -1.528 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.262 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -77.71 -32.98 53.25 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -90.9 -34.48 15.21 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.26 178.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -93.12 -38.81 11.39 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -175.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.76 107.08 18.96 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.407 ' HD3' ' HA ' ' A' ' 20' ' ' ARG . 23.4 mmt180 -78.45 3.72 15.11 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.852 0.834 . . . . 0.0 111.905 -176.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 p -89.63 -9.32 50.08 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.261 171.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 80.6 m . . . . . 0 C--O 1.247 0.958 0 CA-C-O 121.172 0.51 . . . . 0.0 110.119 176.843 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.558 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 55.7 m . . . . . 0 N--CA 1.439 -0.991 0 CA-C-O 122.156 0.979 . . . . 0.0 110.361 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 58.9 m -90.44 72.2 6.98 Favored 'General case' 0 C--N 1.268 -2.964 0 CA-C-N 114.92 -1.036 . . . . 0.0 112.63 -173.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -147.54 12.51 1.03 Allowed 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 122.274 1.035 . . . . 0.0 108.234 173.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.44 164.79 35.81 Favored Glycine 0 N--CA 1.434 -1.478 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 -178.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -69.79 -20.51 34.6 Favored 'Trans proline' 0 C--O 1.223 -0.246 0 C-N-CA 122.944 2.429 . . . . 0.0 113.855 -176.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -112.62 33.98 4.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.977 0.418 . . . . 0.0 111.158 -177.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.558 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -92.75 -7.41 62.97 Favored Glycine 0 N--CA 1.438 -1.185 0 C-N-CA 120.447 -0.883 . . . . 0.0 113.745 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.5 m -115.71 24.84 11.21 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 117.651 0.725 . . . . 0.0 111.588 -176.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 p -84.13 -14.72 49.54 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.866 -177.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.1 p -98.24 153.41 18.51 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 121.025 0.44 . . . . 0.0 111.444 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -62.4 -40.14 95.55 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.242 177.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 71.4 t90 -59.49 -50.95 71.93 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.635 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 81.5 m -68.58 -37.9 80.23 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.197 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -64.3 -39.64 94.33 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.955 0.407 . . . . 0.0 111.433 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.15 -47.99 12.72 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -176.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -93.44 -12.14 30.48 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -168.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.403 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . . . -111.0 124.19 51.67 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 176.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -76.83 -20.36 56.45 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.86 0.362 . . . . 0.0 110.977 -177.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.403 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 5.9 p -66.79 -20.75 66.01 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.999 173.126 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.4 m . . . . . 0 N--CA 1.437 -1.089 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.236 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 62.1 m . . . . . 0 N--CA 1.447 -0.61 0 CA-C-O 121.595 0.712 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 38.9 m -93.95 -18.84 21.49 Favored 'General case' 0 C--N 1.292 -1.907 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.439 -177.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -97.22 79.75 2.85 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 122.623 1.202 . . . . 0.0 111.405 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 149.52 145.23 4.09 Favored Glycine 0 N--CA 1.432 -1.624 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.843 176.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -59.97 -35.63 92.61 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.035 2.49 . . . . 0.0 111.968 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -96.97 17.88 15.93 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.358 -178.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -67.15 -32.12 79.4 Favored Glycine 0 N--CA 1.433 -1.563 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 50.7 m -93.96 15.67 16.27 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 122.846 0.458 . . . . 0.0 111.897 -176.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.5 m -66.14 -44.59 83.76 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.735 0.302 . . . . 0.0 111.05 -177.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.1 m -74.66 134.38 42.01 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.7 -32.78 70.84 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 123.008 0.193 . . . . 0.0 110.86 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -55.13 -49.64 71.28 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 176.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 98.9 m -64.57 -43.2 94.66 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.259 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -65.65 -41.01 93.07 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 120.984 0.421 . . . . 0.0 111.81 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -78.58 -46.19 19.94 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.104 -176.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -92.03 -24.76 19.09 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -170.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -95.88 113.61 25.25 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 175.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -77.35 4.15 11.48 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 124.469 1.108 . . . . 0.0 111.931 -172.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.9 p -83.49 -20.13 34.52 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 173.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.8 m . . . . . 0 N--CA 1.43 -1.427 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.504 179.452 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 70.2 m . . . . . 0 C--O 1.209 -1.04 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.517 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 70.8 m -106.02 24.8 11.81 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 122.548 1.166 . . . . 0.0 108.689 -177.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.3 p-10 -88.89 -15.26 34.85 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.756 -1.565 . . . . 0.0 109.716 -178.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -169.03 165.83 39.23 Favored Glycine 0 N--CA 1.431 -1.635 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -62.93 -27.21 74.47 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 123.163 2.575 . . . . 0.0 112.991 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.418 ' HA ' ' HB2' ' A' ' 11' ' ' SER . 53.2 mtpt -89.44 -11.94 41.63 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.732 -179.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.92 -46.29 91.92 Favored Glycine 0 CA--C 1.499 -0.918 0 N-CA-C 107.814 -2.115 . . . . 0.0 107.814 172.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.2 m -79.33 0.33 29.39 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.649 -0.776 . . . . 0.0 112.425 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.418 ' HB2' ' HA ' ' A' ' 8' ' ' LYS . 22.1 t -76.64 -33.08 58.35 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.177 0.513 . . . . 0.0 109.851 -178.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.6 m -75.28 130.32 38.89 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -50.64 -45.64 57.88 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.37 1.068 . . . . 0.0 112.245 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.0 t90 -53.22 -46.65 69.17 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.603 0.716 . . . . 0.0 110.174 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 91.0 m -69.47 -43.76 72.58 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.962 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -61.77 -31.88 72.12 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.591 0.71 . . . . 0.0 110.461 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.01 -41.32 51.39 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.834 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -94.03 -37.07 11.83 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -174.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.517 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . . . -86.81 113.75 22.89 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -88.07 -3.63 58.87 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.802 -174.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.4 p -88.58 5.8 41.12 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.575 175.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 84.3 m . . . . . 0 N--CA 1.437 -1.1 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.808 176.529 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 22.3 m . . . . . 0 CA--C 1.498 -1.023 0 CA-C-O 122.156 0.979 . . . . 0.0 111.02 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.6 m -92.78 25.21 3.23 Favored 'General case' 0 C--N 1.273 -2.742 0 CA-C-N 114.583 -1.189 . . . . 0.0 112.004 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 35.7 p30 -89.32 -11.61 42.89 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 153.88 -174.03 32.45 Favored Glycine 0 N--CA 1.425 -2.035 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.96 -23.37 72.58 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.523 2.815 . . . . 0.0 113.288 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -89.04 -5.4 57.92 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 122.138 -0.351 . . . . 0.0 111.169 -177.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -82.27 -25.0 53.07 Favored Glycine 0 N--CA 1.435 -1.388 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.119 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.3 m -86.77 20.6 2.5 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 123.535 0.734 . . . . 0.0 111.062 -178.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.6 p -69.86 -33.14 71.86 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.643 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.1 p -83.97 159.94 21.14 Favored 'General case' 0 C--O 1.253 1.283 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -72.51 -34.62 67.76 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.1 t90 -55.37 -55.22 34.09 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.262 179.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.1 m -65.42 -41.52 93.46 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.912 179.451 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -65.33 -28.08 69.05 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.777 0.322 . . . . 0.0 111.724 -177.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -91.89 -44.82 8.7 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 120.872 0.368 . . . . 0.0 111.677 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 65.7 m-70 -92.48 -19.33 22.11 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -171.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.477 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . . . -99.53 139.22 35.51 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-O 121.321 0.582 . . . . 0.0 109.934 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -90.64 -4.49 56.76 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 121.857 0.837 . . . . 0.0 110.105 -175.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.477 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 9.2 p -86.52 3.82 42.51 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.571 177.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.1 m . . . . . 0 N--CA 1.421 -1.894 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.451 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.53 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 30.6 m . . . . . 0 N--CA 1.444 -0.754 0 CA-C-O 121.427 0.632 . . . . 0.0 111.877 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.4 m -95.93 9.3 41.09 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-O 121.535 0.683 . . . . 0.0 110.939 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -108.13 15.9 23.8 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.818 0.818 . . . . 0.0 108.926 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -145.48 148.5 20.27 Favored Glycine 0 N--CA 1.429 -1.769 0 CA-C-O 118.755 -1.025 . . . . 0.0 110.542 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -52.04 -41.89 61.84 Favored 'Trans proline' 0 C--O 1.245 0.843 0 C-N-CA 123.162 2.575 . . . . 0.0 112.298 177.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.7 mttp -122.66 74.57 1.2 Allowed 'General case' 0 N--CA 1.433 -1.307 0 CA-C-O 121.469 0.652 . . . . 0.0 110.81 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.53 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -102.35 -52.37 1.0 Allowed Glycine 0 N--CA 1.432 -1.572 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 173.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.507 ' HA ' ' HB2' ' A' ' 15' ' ' CYS . 75.9 m -81.92 15.35 2.3 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.194 0.521 . . . . 0.0 111.903 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.1 p -71.99 -27.86 63.03 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-O 121.926 0.869 . . . . 0.0 109.068 175.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.6 t -86.52 138.59 31.6 Favored 'General case' 0 N--CA 1.418 -2.025 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -59.55 -24.22 63.53 Favored 'General case' 0 C--N 1.315 -0.923 0 O-C-N 123.621 0.576 . . . . 0.0 111.675 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -64.39 -54.31 34.78 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.507 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 97.5 m -68.9 -36.89 78.57 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.032 178.396 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.9 ttt180 -60.18 -33.02 71.63 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 120.83 0.348 . . . . 0.0 110.541 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -92.1 -49.73 6.05 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.654 -0.418 . . . . 0.0 112.071 179.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -89.95 -11.51 41.5 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -167.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.45 142.33 35.98 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 119.286 -0.965 . . . . 0.0 108.54 176.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -84.45 -21.82 30.56 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 -177.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.6 p -81.86 -16.85 49.37 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.258 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.1 m . . . . . 0 C--N 1.314 -0.954 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 176.137 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.467 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 58.3 m . . . . . 0 C--O 1.219 -0.546 0 CA-C-O 121.367 0.604 . . . . 0.0 111.667 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.5 m -95.65 13.05 27.6 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-O 121.156 0.503 . . . . 0.0 112.238 -170.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -90.05 -11.34 41.74 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.959 0.409 . . . . 0.0 111.505 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -154.33 162.66 30.74 Favored Glycine 0 N--CA 1.433 -1.554 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.332 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -69.22 -13.21 35.63 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.966 2.444 . . . . 0.0 113.192 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -87.23 -28.3 22.45 Favored 'General case' 0 C--O 1.244 0.815 0 O-C-N 121.876 -0.515 . . . . 0.0 109.841 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.467 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -61.37 -51.96 54.6 Favored Glycine 0 N--CA 1.432 -1.588 0 N-CA-C 110.009 -1.236 . . . . 0.0 110.009 175.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.3 m -75.38 -9.95 59.02 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.3 t -80.95 -19.75 43.49 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 m -76.5 126.66 31.37 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 176.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -56.74 -37.82 71.54 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -174.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 91.1 t90 -62.27 -43.73 98.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.451 0.643 . . . . 0.0 109.326 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 62.2 m -73.99 -38.08 64.23 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.035 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -60.56 -36.21 77.93 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.132 0.492 . . . . 0.0 110.573 176.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -81.14 -52.67 7.12 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.273 -178.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -94.54 -32.4 13.48 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -169.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.32 120.92 23.02 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.5 mmm180 -78.84 -9.5 59.49 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.118 -170.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.6 p -97.87 3.99 49.69 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 121.764 0.792 . . . . 0.0 110.203 174.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 86.9 m . . . . . 0 N--CA 1.435 -1.198 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.634 174.255 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 78.5 m . . . . . 0 N--CA 1.463 0.218 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 46.8 m -98.54 4.56 48.2 Favored 'General case' 0 C--N 1.271 -2.837 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.664 -175.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -102.58 13.95 33.2 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 121.347 0.594 . . . . 0.0 110.671 -179.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.76 147.06 12.0 Favored Glycine 0 N--CA 1.426 -1.972 0 C-N-CA 120.144 -1.026 . . . . 0.0 111.44 178.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.69 -27.95 85.69 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.219 2.612 . . . . 0.0 113.104 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -88.71 -1.89 58.31 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 122.104 -0.373 . . . . 0.0 110.195 -178.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -70.07 -69.18 1.44 Allowed Glycine 0 N--CA 1.439 -1.142 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.263 -178.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.5 m -80.84 10.74 4.59 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.4 t -69.86 -38.8 76.55 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 171.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 m -68.28 130.39 42.77 Favored 'General case' 0 N--CA 1.426 -1.669 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -60.62 -31.03 70.23 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 123.07 0.548 . . . . 0.0 111.22 -175.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -61.81 -48.4 80.75 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 176.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 54.2 m -70.27 -23.69 62.93 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 116.116 -0.493 . . . . 0.0 112.303 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -70.49 -42.77 70.94 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 120.019 -0.672 . . . . 0.0 110.432 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -87.81 -43.72 11.64 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -89.03 5.06 46.1 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -168.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -116.47 114.71 24.59 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 173.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 20' ' ' ARG . 47.3 mtm180 -64.78 -22.51 67.0 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.71 -173.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.2 p -74.88 -13.52 60.56 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 82.9 m . . . . . 0 C--N 1.316 -0.874 0 CA-C-O 121.28 0.562 . . . . 0.0 110.546 176.19 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.49 ' HA ' ' HA3' ' A' ' 9' ' ' GLY . 2.6 m . . . . . 0 N--CA 1.444 -0.728 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.43 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 60.6 m -105.86 -11.85 16.07 Favored 'General case' 0 C--N 1.285 -2.216 0 CA-C-O 121.468 0.651 . . . . 0.0 110.787 -176.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -91.99 -34.17 14.55 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.637 0.732 . . . . 0.0 109.516 179.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -96.18 132.07 10.9 Favored Glycine 0 N--CA 1.433 -1.556 0 N-CA-C 109.031 -1.627 . . . . 0.0 109.031 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -54.73 -36.02 89.19 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.875 2.384 . . . . 0.0 114.359 -176.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -105.22 27.95 7.76 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.09 0.472 . . . . 0.0 110.381 178.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.49 ' HA3' ' HA ' ' A' ' 3' ' ' CYS . . . -60.72 -36.16 91.19 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.896 -179.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.2 m -84.79 28.32 0.69 Allowed 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 117.119 0.46 . . . . 0.0 112.096 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.5 t -72.76 -34.97 67.34 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.7 p -80.37 150.58 29.81 Favored 'General case' 0 C--O 1.259 1.565 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.174 178.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.738 ' HA ' ' HE2' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -58.61 -40.09 82.29 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.064 -179.914 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -57.74 -56.93 15.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 123.991 0.807 . . . . 0.0 109.965 177.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.489 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 78.6 m -61.57 -38.75 88.65 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -177.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -65.5 -23.16 66.82 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.481 -0.488 . . . . 0.0 111.396 -177.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -102.22 -49.33 3.93 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 120.971 0.415 . . . . 0.0 111.903 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -89.43 -24.88 21.77 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -168.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.43 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . . . -70.83 136.04 48.47 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -70.55 -11.85 61.19 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -170.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.0 p -84.55 -18.67 34.93 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.186 0.517 . . . . 0.0 110.381 176.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.9 m . . . . . 0 N--CA 1.432 -1.333 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -177.541 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.472 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 35.3 m . . . . . 0 N--CA 1.439 -1.02 0 CA-C-O 121.753 0.787 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 50.0 m -104.71 17.06 24.83 Favored 'General case' 0 C--N 1.279 -2.496 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.089 -176.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -89.43 0.22 57.01 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.442 0.639 . . . . 0.0 110.495 -176.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 157.71 177.32 30.71 Favored Glycine 0 N--CA 1.433 -1.515 0 C-N-CA 120.512 -0.851 . . . . 0.0 111.624 178.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -52.82 -35.46 69.9 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.857 3.038 . . . . 0.0 113.313 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -89.03 17.92 5.37 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.088 0.47 . . . . 0.0 110.985 -177.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -91.79 -28.77 13.12 Favored Glycine 0 N--CA 1.414 -2.772 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 171.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 70.1 m -95.86 11.86 32.22 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 123.234 0.613 . . . . 0.0 111.67 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.4 p -74.46 -28.71 61.15 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 123.394 0.677 . . . . 0.0 111.348 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.5 p -88.11 141.26 28.71 Favored 'General case' 0 N--CA 1.424 -1.757 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.889 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -61.14 -35.18 76.37 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -54.38 -52.55 61.31 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.971 177.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.472 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 82.8 m -70.15 -34.96 73.68 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.695 177.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -61.61 -37.07 82.6 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.318 0.58 . . . . 0.0 109.739 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -78.09 -44.23 26.8 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.451 179.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -89.48 -34.49 16.41 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -170.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.459 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . . . -92.84 122.77 35.56 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-O 121.417 0.627 . . . . 0.0 111.077 -175.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -82.42 -3.94 56.52 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.55 0.69 . . . . 0.0 110.312 -178.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.459 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 27.6 p -79.4 -9.28 59.56 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.46 -0.791 . . . . 0.0 108.954 173.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.7 m . . . . . 0 N--CA 1.434 -1.255 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.136 179.561 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.571 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 30.5 m . . . . . 0 N--CA 1.451 -0.386 0 CA-C-O 121.439 0.638 . . . . 0.0 112.365 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.653 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 81.4 m -84.61 -10.69 57.12 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.356 179.344 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -101.03 0.6 38.35 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -175.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.39 147.11 18.26 Favored Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -178.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -58.56 -41.59 63.05 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 123.392 2.728 . . . . 0.0 114.127 -177.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -111.92 27.89 9.25 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.913 0.387 . . . . 0.0 110.25 -178.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.571 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -58.2 -37.95 88.3 Favored Glycine 0 C--O 1.22 -0.725 0 CA-C-N 115.109 -0.95 . . . . 0.0 113.342 -178.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 82.6 m -80.05 -3.18 47.48 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.7 t -85.34 66.39 9.68 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-O 122.135 0.969 . . . . 0.0 108.712 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.0 t -174.33 138.94 0.58 Allowed 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.661 1.585 . . . . 0.0 106.842 -178.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -71.89 -34.96 69.58 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -178.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.8 t90 -60.7 -43.82 97.31 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.764 0.792 . . . . 0.0 109.216 178.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.2 m -71.62 -37.7 70.87 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.618 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.509 ' HA ' ' CB ' ' A' ' 22' ' ' CYS . 1.7 tmt_? -64.71 -36.89 85.73 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -68.68 -42.45 77.8 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.866 179.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -98.23 -44.03 6.74 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 -172.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.653 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . . . -75.85 131.98 40.06 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.318 0.58 . . . . 0.0 111.521 -172.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -74.09 -12.26 60.55 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.225 -174.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 20.2 p -89.03 -10.48 47.35 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.572 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.509 ' CB ' ' HA ' ' A' ' 16' ' ' ARG . 59.8 m . . . . . 0 C--N 1.309 -1.156 0 CA-C-O 121.024 0.44 . . . . 0.0 110.931 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.495 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 57.1 m . . . . . 0 N--CA 1.437 -1.075 0 CA-C-O 121.927 0.87 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 73.5 m -97.05 24.84 5.88 Favored 'General case' 0 C--N 1.275 -2.651 0 CA-C-N 114.671 -1.149 . . . . 0.0 111.225 -177.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.4 p-10 -89.72 -11.2 42.99 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-O 121.195 0.521 . . . . 0.0 110.132 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 151.07 -164.1 29.95 Favored Glycine 0 N--CA 1.424 -2.163 0 C-N-CA 120.417 -0.897 . . . . 0.0 111.846 178.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -60.96 -15.3 37.93 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.97 3.114 . . . . 0.0 114.997 -175.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.46 ' HZ2' ' HB3' ' A' ' 8' ' ' LYS . 9.7 mtpm? -89.1 -11.78 43.02 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.427 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -77.35 -50.32 6.78 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 119.982 -1.104 . . . . 0.0 111.775 -178.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -67.27 -2.65 6.27 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.2 m -71.12 -30.26 66.28 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-O 120.674 0.273 . . . . 0.0 110.86 178.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.4 t -83.98 137.09 33.8 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 176.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -60.91 -32.87 72.34 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.875 0.734 . . . . 0.0 109.675 178.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -61.94 -53.49 54.95 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.184 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.495 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.2 m -66.46 -39.31 88.75 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.598 178.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -60.28 -33.32 72.17 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 122.736 0.414 . . . . 0.0 111.252 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -86.91 -38.25 16.88 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.844 0.354 . . . . 0.0 111.729 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -92.71 -26.3 17.83 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -172.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.467 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . . . -96.75 138.46 34.28 Favored 'General case' 0 C--N 1.295 -1.789 0 C-N-CA 120.426 -0.509 . . . . 0.0 110.731 -177.327 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -88.04 0.97 55.3 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-O 121.105 0.479 . . . . 0.0 111.532 -177.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.3 p -83.06 -13.24 56.18 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-O 121.73 0.776 . . . . 0.0 109.107 174.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 61.3 m . . . . . 0 N--CA 1.426 -1.673 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.879 179.678 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . 0.254 . . . . . . . 0 N--CA 1.433 -1.284 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 96.34 -52.37 1.58 Allowed Glycine 0 CA--C 1.499 -0.919 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -178.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.641 ' HA ' ' HA3' ' A' ' 9' ' ' GLY . 60.2 m -53.68 -41.68 67.13 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 121.99 0.9 . . . . 0.0 112.284 -179.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 63.7 m -108.46 16.18 23.26 Favored 'General case' 0 C--N 1.262 -3.202 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.706 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -117.18 -23.23 7.98 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.569 -178.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.59 163.75 13.56 Favored Glycine 0 N--CA 1.434 -1.494 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -70.75 -19.12 31.79 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.156 2.571 . . . . 0.0 114.493 -175.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.445 ' HZ2' ' HB3' ' A' ' 8' ' ' LYS . 7.6 mtpm? -104.67 -4.42 22.48 Favored 'General case' 0 C--N 1.311 -1.086 0 O-C-N 122.013 -0.43 . . . . 0.0 111.852 -175.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.641 ' HA3' ' HA ' ' A' ' 3' ' ' CYS . . . -63.54 -52.77 43.59 Favored Glycine 0 C--O 1.219 -0.836 0 C-N-CA 121.116 -0.564 . . . . 0.0 112.995 -176.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -84.41 5.53 26.82 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.688 0.756 . . . . 0.0 110.688 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.1 t -91.75 -15.39 28.41 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 31.3 m -86.7 127.12 34.95 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -61.59 -33.94 74.76 Favored 'General case' 0 C--O 1.198 -1.616 0 CA-C-O 118.923 -0.56 . . . . 0.0 112.351 -174.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.6 t90 -57.37 -44.49 84.47 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.29 0.567 . . . . 0.0 110.262 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.435 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 68.1 m -70.23 -34.89 73.42 Favored 'General case' 0 C--O 1.207 -1.145 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.097 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -66.15 -39.4 89.8 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.802 0.334 . . . . 0.0 110.334 175.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -70.25 -52.14 25.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.299 0.571 . . . . 0.0 111.471 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -93.36 -38.19 11.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -170.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.13 124.69 34.06 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.365 0.602 . . . . 0.0 110.789 -174.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -69.44 -21.92 63.7 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.535 -177.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.2 p -77.46 -13.82 59.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.076 0.465 . . . . 0.0 111.685 178.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.8 m -92.97 90.63 7.03 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.258 0.551 . . . . 0.0 110.206 176.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.582 0 CA-C-N 116.418 -0.356 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . 0.253 . . . . . . . 0 N--CA 1.421 -1.922 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 101.75 -0.75 52.34 Favored Glycine 0 CA--C 1.5 -0.906 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 -178.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.409 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 34.2 m -90.69 -15.29 30.58 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 121.496 0.665 . . . . 0.0 111.264 -175.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 18.9 m -93.93 25.72 3.53 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.324 -176.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -88.13 -24.53 23.34 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.001 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.52 176.88 47.45 Favored Glycine 0 N--CA 1.435 -1.402 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.085 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -62.85 -21.87 73.43 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.676 2.918 . . . . 0.0 114.219 -177.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -89.15 -6.35 57.05 Favored 'General case' 0 C--O 1.24 0.567 0 O-C-N 121.927 -0.483 . . . . 0.0 110.158 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.409 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -70.43 -32.71 68.03 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.151 -1.58 . . . . 0.0 109.151 175.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.1 m -80.18 2.08 25.69 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.661 -0.769 . . . . 0.0 112.243 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.9 m -90.87 25.0 2.53 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.832 0.825 . . . . 0.0 109.79 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.498 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 12.4 m -127.52 131.7 50.04 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -64.4 -39.9 94.75 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.479 -175.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -54.19 -39.25 66.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.703 0.763 . . . . 0.0 110.296 177.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.498 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 55.9 m -74.24 -31.89 62.77 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.57 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -72.39 -37.0 68.82 Favored 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -75.74 -47.46 25.9 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.234 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -100.01 -30.73 11.82 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 114.714 1.376 . . . . 0.0 114.714 -168.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -89.94 131.73 35.69 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.823 -175.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -66.96 -31.09 71.43 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.097 -176.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.7 p -69.21 -23.79 63.94 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.056 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 15' ' ' CYS . 56.3 m -109.12 -76.73 0.61 Allowed 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.484 0 O-C-N 122.024 -0.423 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . 0.425 ' HA ' ' HB2' ' A' ' 5' ' ' ASN . . . . . . . . 0 N--CA 1.416 -2.126 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.13 -89.42 1.03 Allowed Glycine 0 N--CA 1.427 -1.932 0 N-CA-C 110.1 -1.2 . . . . 0.0 110.1 -177.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.3 m -93.25 -38.43 11.53 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-O 122.105 0.955 . . . . 0.0 110.223 -178.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 45.5 m -88.09 8.78 25.12 Favored 'General case' 0 C--N 1.275 -2.64 0 CA-C-N 114.96 -1.018 . . . . 0.0 113.739 -172.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.425 ' HB2' ' HA ' ' A' ' 1' ' ' PCA . 10.4 t30 -111.25 42.36 1.67 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 122.48 1.133 . . . . 0.0 108.368 179.045 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 170.86 144.12 4.24 Favored Glycine 0 N--CA 1.424 -2.102 0 CA-C-N 114.5 -1.227 . . . . 0.0 110.146 177.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_exo -62.38 -28.06 78.06 Favored 'Trans proline' 0 C--O 1.214 -0.709 0 C-N-CA 122.619 2.213 . . . . 0.0 112.109 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -103.86 11.27 35.86 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 121.115 0.483 . . . . 0.0 109.804 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.28 -32.22 52.56 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 177.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.4 m -91.61 29.09 1.58 Allowed 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 122.799 0.44 . . . . 0.0 111.408 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.5 p -62.5 -45.79 91.4 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 123.799 0.839 . . . . 0.0 110.969 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.0 m -67.49 137.59 55.93 Favored 'General case' 0 C--O 1.253 1.261 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.055 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 12.6 tmtt? -59.39 -33.86 71.72 Favored 'General case' 0 C--O 1.208 -1.083 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 175.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -51.14 -50.29 59.17 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.6 m -65.32 -45.85 82.67 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.541 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -64.75 -28.12 69.36 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.057 0.456 . . . . 0.0 111.31 -178.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -88.34 -47.49 8.35 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.917 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -93.71 -23.22 18.3 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -172.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -95.79 120.87 36.82 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 121.713 0.768 . . . . 0.0 109.976 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -74.87 -22.48 58.64 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.995 -175.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 p -83.96 3.23 35.07 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 114.775 -1.102 . . . . 0.0 111.885 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 95.4 m -98.83 92.89 5.77 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 176.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.327 0 CA-C-N 116.628 -0.26 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . 0.409 ' HG2' ' SG ' ' A' ' 21' ' ' CYS . . . . . . . . 0 N--CA 1.417 -2.102 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -74.71 -22.42 77.13 Favored Glycine 0 C--N 1.311 -0.822 0 C-N-CA 121.56 -0.352 . . . . 0.0 112.82 -175.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.472 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 64.6 m -90.44 1.92 56.17 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.485 0.659 . . . . 0.0 111.241 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.6 m -114.48 41.28 2.35 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.057 0.932 . . . . 0.0 110.157 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -93.59 12.05 26.64 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.279 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 159.6 164.99 15.67 Favored Glycine 0 N--CA 1.432 -1.584 0 N-CA-C 110.044 -1.223 . . . . 0.0 110.044 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -59.54 -18.38 46.65 Favored 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.472 2.782 . . . . 0.0 115.287 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -104.12 13.72 31.87 Favored 'General case' 0 C--O 1.241 0.61 0 O-C-N 121.386 -0.821 . . . . 0.0 111.731 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.13 -39.53 52.87 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.298 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.407 ' HA ' ' HB3' ' A' ' 15' ' ' CYS . 74.0 m -97.21 34.04 1.84 Allowed 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.126 0.488 . . . . 0.0 111.373 -178.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.4 p -72.82 -36.9 67.62 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.6 0.714 . . . . 0.0 109.239 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -69.89 144.7 52.39 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.657 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -57.54 -44.67 85.33 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 123.991 0.916 . . . . 0.0 112.592 -176.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.0 t90 -62.96 -49.95 72.7 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.472 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 68.6 m -57.03 -41.07 77.95 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -60.97 -37.95 84.22 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.774 0.321 . . . . 0.0 111.019 178.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.24 -51.36 11.05 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 177.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 72.1 m-70 -88.88 -17.69 29.13 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 115.05 1.5 . . . . 0.0 115.05 -165.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.94 114.78 23.11 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 44.2 mtm180 -67.73 -24.44 65.37 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.348 0.594 . . . . 0.0 110.131 -176.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.409 ' SG ' ' HG2' ' A' ' 1' ' ' PCA . 0.7 OUTLIER -71.39 -12.5 61.45 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.591 176.342 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.0 m -118.62 -94.26 0.5 Allowed 'General case' 0 N--CA 1.433 -1.325 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 176.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.381 0 O-C-N 121.86 -0.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.42 -1.93 0 CA-C-O 120.959 0.409 . . . . 0.0 110.536 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 102.79 -103.0 2.34 Favored Glycine 0 N--CA 1.419 -2.436 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.44 178.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.437 ' HB2' ' HB3' ' A' ' 15' ' ' CYS . 97.0 m -90.28 49.84 1.76 Allowed 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -173.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 61.0 m -117.2 11.96 14.27 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 122.53 1.157 . . . . 0.0 108.603 171.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -144.57 150.12 36.96 Favored 'General case' 0 N--CA 1.425 -1.691 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 136.02 -164.43 25.01 Favored Glycine 0 C--N 1.292 -1.881 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.34 -42.02 45.17 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.138 2.559 . . . . 0.0 113.46 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -134.45 17.49 3.66 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 120.558 0.218 . . . . 0.0 111.094 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.31 -83.6 0.75 Allowed Glycine 0 N--CA 1.433 -1.526 0 N-CA-C 109.19 -1.564 . . . . 0.0 109.19 -174.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.8 m -101.3 64.12 1.01 Allowed 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.357 0.598 . . . . 0.0 109.515 177.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.2 t -78.04 -32.58 51.02 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -71.26 131.46 43.51 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -54.94 -46.68 74.99 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.256 1.022 . . . . 0.0 112.601 -173.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 91.3 t90 -55.71 -44.21 77.21 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.576 0.703 . . . . 0.0 110.664 178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 3' ' ' CYS . 60.7 m -67.26 -32.05 72.81 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.707 -176.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -64.71 -32.32 73.94 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -97.09 -20.52 17.95 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -114.9 -18.32 11.32 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 -170.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.13 158.74 31.43 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 118.727 0.694 . . . . 0.0 111.31 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -84.18 -37.95 21.24 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.4 p -69.78 -13.72 62.42 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.899 -1.046 . . . . 0.0 113.249 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 63.2 m -120.84 99.55 6.58 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.308 -1.226 0 CA-C-N 116.379 -0.373 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . 0.252 . . . . . . . 0 N--CA 1.432 -1.372 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -75.76 81.02 1.02 Allowed Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.778 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 75.1 m -76.35 -24.91 54.24 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 123.595 0.758 . . . . 0.0 112.533 -177.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 66.6 m -83.69 70.67 10.36 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-O 121.557 0.694 . . . . 0.0 111.037 -176.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 32.5 p-10 -149.28 13.19 0.85 Allowed 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.281 176.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -160.25 163.07 33.69 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.73 -15.63 37.3 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.38 2.72 . . . . 0.0 114.173 -176.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -102.62 1.9 35.32 Favored 'General case' 0 C--N 1.307 -1.253 0 O-C-N 122.088 -0.383 . . . . 0.0 110.225 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.46 -59.95 9.33 Favored Glycine 0 C--O 1.218 -0.897 0 O-C-N 123.717 0.635 . . . . 0.0 113.32 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.9 m -82.49 -3.14 55.32 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.528 0.68 . . . . 0.0 111.146 -177.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.8 m -87.45 -16.01 36.06 Favored 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.315 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.9 m -79.1 134.26 36.74 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.673 ' HA ' ' HE2' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -51.7 -55.28 20.47 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.914 0.886 . . . . 0.0 112.897 -175.093 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.8 t90 -62.0 -49.22 76.92 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -177.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.0 m -61.92 -35.2 77.67 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.47 -175.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -58.54 -38.95 78.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.86 0.362 . . . . 0.0 111.383 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -103.3 -27.15 12.64 Favored 'General case' 0 C--N 1.31 -1.124 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -175.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -102.9 -7.5 21.47 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -172.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.24 119.79 39.94 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 107.216 -1.401 . . . . 0.0 107.216 173.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -66.23 -19.69 65.9 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.982 -173.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 3.4 p -77.61 -4.06 44.02 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.958 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.7 m -105.05 85.75 2.33 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 121.403 0.621 . . . . 0.0 110.381 177.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.946 0 CA-C-N 116.148 -0.478 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.42 -1.963 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.56 -42.44 88.38 Favored Glycine 0 C--O 1.228 -0.256 0 N-CA-C 111.399 -0.68 . . . . 0.0 111.399 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.483 ' HB2' ' HB3' ' A' ' 19' ' ' ALA . 70.6 m -90.52 19.85 5.0 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-O 121.04 0.447 . . . . 0.0 110.382 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.402 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 71.2 m -116.19 11.23 15.12 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.847 0.832 . . . . 0.0 109.658 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -101.06 116.7 33.45 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.436 -177.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 114.9 168.92 15.9 Favored Glycine 0 C--N 1.303 -1.302 0 C-N-CA 121.185 -0.531 . . . . 0.0 112.349 173.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -66.02 -18.03 56.25 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 123.283 2.655 . . . . 0.0 112.424 179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.587 ' HB2' ' HZ3' ' A' ' 8' ' ' LYS . 10.0 mtmp? -88.88 -60.26 2.01 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.69 -98.69 1.07 Allowed Glycine 0 N--CA 1.424 -2.124 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 79.6 m -90.56 77.25 6.47 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 121.977 0.894 . . . . 0.0 109.47 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.533 ' HB3' ' HB3' ' A' ' 8' ' ' LYS . 4.1 p -94.67 -27.1 16.04 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 114.253 -1.34 . . . . 0.0 109.002 175.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 t -90.06 134.67 34.11 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 174.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -63.79 -37.4 87.24 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 123.642 0.588 . . . . 0.0 111.551 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.5 t90 -59.07 -41.25 87.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.392 0.615 . . . . 0.0 109.753 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 96.2 m -65.44 -29.41 70.09 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.718 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -71.38 -19.71 62.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.275 0.559 . . . . 0.0 110.876 -176.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -100.61 -13.26 18.65 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 62.0 m-70 -120.6 -22.92 6.2 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.679 1.362 . . . . 0.0 114.679 -171.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.483 ' HB3' ' HB2' ' A' ' 3' ' ' CYS . . . -77.71 140.86 39.57 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -66.38 -17.31 64.7 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -176.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.3 p -87.45 -3.66 59.01 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 122.906 0.482 . . . . 0.0 111.101 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 70.9 m -133.61 95.01 3.39 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.39 0.614 . . . . 0.0 110.075 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.297 -1.696 0 CA-C-N 116.256 -0.429 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.418 -2.056 0 CA-C-O 121.002 0.43 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 126.15 82.07 0.43 Allowed Glycine 0 N--CA 1.425 -2.092 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.715 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 71.3 m -81.58 -28.75 33.67 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 122.173 0.987 . . . . 0.0 109.733 -178.41 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 73.1 m -84.51 73.14 10.57 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.022 175.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -120.42 2.44 10.76 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 114.16 -1.382 . . . . 0.0 108.96 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.49 -163.12 33.84 Favored Glycine 0 N--CA 1.421 -2.326 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.007 -177.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -86.62 4.9 6.12 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.286 2.657 . . . . 0.0 115.565 -174.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.428 ' HZ3' ' HB3' ' A' ' 8' ' ' LYS . 2.3 mmmp? -123.99 5.96 8.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.542 0.61 . . . . 0.0 110.216 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.715 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -79.97 -33.52 32.98 Favored Glycine 0 C--O 1.214 -1.096 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.705 -175.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 67.0 m -92.6 21.92 5.08 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.328 0.585 . . . . 0.0 110.937 -178.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.6 t -76.1 -48.7 19.72 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -178.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.7 m -59.29 137.78 57.86 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.188 176.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -50.72 -48.01 58.98 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.155 0.982 . . . . 0.0 110.864 -178.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.7 t90 -56.43 -40.91 75.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.557 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.9 m -70.85 -32.44 69.46 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.526 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.1 ttt85 -72.85 -18.93 61.39 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 121.215 0.531 . . . . 0.0 110.877 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -98.99 -45.27 6.01 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.587 0.708 . . . . 0.0 111.144 176.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 34.1 m-70 -89.88 -23.51 21.62 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -168.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.84 126.68 30.96 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 177.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -72.47 -16.18 61.8 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.509 0.671 . . . . 0.0 110.948 -174.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -94.82 0.12 54.59 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 114.755 -1.112 . . . . 0.0 111.314 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 84.4 m -141.14 -86.06 0.18 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.296 -1.741 0 O-C-N 121.747 -0.595 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . 0.655 ' HB3' ' HB3' ' A' ' 19' ' ' ALA . . . . . . . . 0 N--CA 1.416 -2.132 0 CA-C-O 120.791 0.329 . . . . 0.0 110.128 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -94.45 67.87 1.36 Allowed Glycine 0 N--CA 1.434 -1.446 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 89.9 m -128.82 1.25 5.4 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 58.5 m -113.28 17.18 18.77 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.18 0.99 . . . . 0.0 108.751 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -89.81 -22.11 22.27 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.59 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.69 154.79 26.05 Favored Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.72 -28.94 82.72 Favored 'Trans proline' 0 C--O 1.244 0.812 0 C-N-CA 123.224 2.616 . . . . 0.0 113.597 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -90.27 -1.72 57.95 Favored 'General case' 0 N--CA 1.438 -1.039 0 O-C-N 121.866 -0.521 . . . . 0.0 111.345 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.05 -42.04 78.79 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.3 m -72.26 12.73 0.4 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.6 m -82.69 -22.53 34.5 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 m -72.81 123.08 22.65 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -62.59 -33.78 75.67 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.243 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -60.4 -36.71 78.76 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.758 0.79 . . . . 0.0 109.435 178.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 91.7 m -80.11 -11.86 59.72 Favored 'General case' 0 C--O 1.2 -1.528 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.262 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -77.71 -32.98 53.25 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -90.9 -34.48 15.21 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.26 178.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -93.12 -38.81 11.39 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -175.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.655 ' HB3' ' HB3' ' A' ' 1' ' ' PCA . . . -91.76 107.08 18.96 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.407 ' HD3' ' HA ' ' A' ' 20' ' ' ARG . 23.4 mmt180 -78.45 3.72 15.11 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.852 0.834 . . . . 0.0 111.905 -176.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 p -89.63 -9.32 50.08 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.261 171.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 80.6 m -99.66 88.82 3.93 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-O 121.172 0.51 . . . . 0.0 110.119 176.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.379 0 O-C-N 122.159 -0.338 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.419 -1.988 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.59 -46.98 44.25 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.991 -0.624 . . . . 0.0 112.732 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.558 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 55.7 m -93.66 -51.96 4.68 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 122.156 0.979 . . . . 0.0 110.361 -177.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 58.9 m -90.44 72.2 6.98 Favored 'General case' 0 C--N 1.268 -2.964 0 CA-C-N 114.92 -1.036 . . . . 0.0 112.63 -173.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -147.54 12.51 1.03 Allowed 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 122.274 1.035 . . . . 0.0 108.234 173.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.44 164.79 35.81 Favored Glycine 0 N--CA 1.434 -1.478 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 -178.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -69.79 -20.51 34.6 Favored 'Trans proline' 0 C--O 1.223 -0.246 0 C-N-CA 122.944 2.429 . . . . 0.0 113.855 -176.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -112.62 33.98 4.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.977 0.418 . . . . 0.0 111.158 -177.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.558 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -92.75 -7.41 62.97 Favored Glycine 0 N--CA 1.438 -1.185 0 C-N-CA 120.447 -0.883 . . . . 0.0 113.745 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.5 m -115.71 24.84 11.21 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 117.651 0.725 . . . . 0.0 111.588 -176.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 p -84.13 -14.72 49.54 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.866 -177.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.1 p -98.24 153.41 18.51 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 121.025 0.44 . . . . 0.0 111.444 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -62.4 -40.14 95.55 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.242 177.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 71.4 t90 -59.49 -50.95 71.93 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.635 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 81.5 m -68.58 -37.9 80.23 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.197 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -64.3 -39.64 94.33 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.955 0.407 . . . . 0.0 111.433 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.15 -47.99 12.72 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -176.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -93.44 -12.14 30.48 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -168.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.403 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . . . -111.0 124.19 51.67 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 176.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -76.83 -20.36 56.45 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.86 0.362 . . . . 0.0 110.977 -177.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.403 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 5.9 p -66.79 -20.75 66.01 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.999 173.126 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.4 m -97.85 -82.48 0.42 Allowed 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.147 0 O-C-N 122.039 -0.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . 0.282 . . . . . . . 0 N--CA 1.426 -1.64 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -103.61 69.38 0.29 Allowed Glycine 0 N--CA 1.429 -1.809 0 CA-C-N 115.969 -0.56 . . . . 0.0 113.224 -174.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 62.1 m -105.36 -13.8 15.54 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.595 0.712 . . . . 0.0 110.212 176.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 38.9 m -93.95 -18.84 21.49 Favored 'General case' 0 C--N 1.292 -1.907 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.439 -177.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -97.22 79.75 2.85 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 122.623 1.202 . . . . 0.0 111.405 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 149.52 145.23 4.09 Favored Glycine 0 N--CA 1.432 -1.624 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.843 176.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -59.97 -35.63 92.61 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.035 2.49 . . . . 0.0 111.968 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -96.97 17.88 15.93 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.358 -178.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -67.15 -32.12 79.4 Favored Glycine 0 N--CA 1.433 -1.563 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 50.7 m -93.96 15.67 16.27 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 122.846 0.458 . . . . 0.0 111.897 -176.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.5 m -66.14 -44.59 83.76 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.735 0.302 . . . . 0.0 111.05 -177.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.1 m -74.66 134.38 42.01 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.7 -32.78 70.84 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 123.008 0.193 . . . . 0.0 110.86 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -55.13 -49.64 71.28 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 176.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 98.9 m -64.57 -43.2 94.66 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.259 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -65.65 -41.01 93.07 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 120.984 0.421 . . . . 0.0 111.81 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -78.58 -46.19 19.94 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.104 -176.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -92.03 -24.76 19.09 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -170.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -95.88 113.61 25.25 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 175.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -77.35 4.15 11.48 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 124.469 1.108 . . . . 0.0 111.931 -172.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.9 p -83.49 -20.13 34.52 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 173.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.8 m -93.73 -78.62 0.43 Allowed 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.504 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.942 0 O-C-N 122.098 -0.376 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.413 -2.3 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 83.58 -59.99 4.91 Favored Glycine 0 C--N 1.304 -1.195 0 CA-C-N 116.023 -0.535 . . . . 0.0 113.455 176.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 70.2 m -126.83 17.97 7.32 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -174.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.517 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 70.8 m -106.02 24.8 11.81 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 122.548 1.166 . . . . 0.0 108.689 -177.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.3 p-10 -88.89 -15.26 34.85 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.756 -1.565 . . . . 0.0 109.716 -178.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -169.03 165.83 39.23 Favored Glycine 0 N--CA 1.431 -1.635 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -62.93 -27.21 74.47 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 123.163 2.575 . . . . 0.0 112.991 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.418 ' HA ' ' HB2' ' A' ' 11' ' ' SER . 53.2 mtpt -89.44 -11.94 41.63 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.732 -179.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.92 -46.29 91.92 Favored Glycine 0 CA--C 1.499 -0.918 0 N-CA-C 107.814 -2.115 . . . . 0.0 107.814 172.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.2 m -79.33 0.33 29.39 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.649 -0.776 . . . . 0.0 112.425 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.418 ' HB2' ' HA ' ' A' ' 8' ' ' LYS . 22.1 t -76.64 -33.08 58.35 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.177 0.513 . . . . 0.0 109.851 -178.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.6 m -75.28 130.32 38.89 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -50.64 -45.64 57.88 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.37 1.068 . . . . 0.0 112.245 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.0 t90 -53.22 -46.65 69.17 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.603 0.716 . . . . 0.0 110.174 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 91.0 m -69.47 -43.76 72.58 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.962 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -61.77 -31.88 72.12 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.591 0.71 . . . . 0.0 110.461 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.01 -41.32 51.39 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.834 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -94.03 -37.07 11.83 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -174.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.517 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . . . -86.81 113.75 22.89 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -88.07 -3.63 58.87 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.802 -174.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.4 p -88.58 5.8 41.12 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.575 175.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 84.3 m -92.29 -84.06 0.28 Allowed 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.808 176.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.572 0 O-C-N 122.268 -0.27 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.415 -2.184 0 CA-C-O 121.159 0.504 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -126.52 116.15 2.45 Favored Glycine 0 N--CA 1.421 -2.312 0 N-CA-C 107.479 -2.248 . . . . 0.0 107.479 176.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 22.3 m -98.45 -44.67 6.41 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-O 122.156 0.979 . . . . 0.0 111.02 -174.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.6 m -92.78 25.21 3.23 Favored 'General case' 0 C--N 1.273 -2.742 0 CA-C-N 114.583 -1.189 . . . . 0.0 112.004 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 35.7 p30 -89.32 -11.61 42.89 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 153.88 -174.03 32.45 Favored Glycine 0 N--CA 1.425 -2.035 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.96 -23.37 72.58 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.523 2.815 . . . . 0.0 113.288 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -89.04 -5.4 57.92 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 122.138 -0.351 . . . . 0.0 111.169 -177.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -82.27 -25.0 53.07 Favored Glycine 0 N--CA 1.435 -1.388 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.119 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.3 m -86.77 20.6 2.5 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 123.535 0.734 . . . . 0.0 111.062 -178.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.6 p -69.86 -33.14 71.86 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.643 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.1 p -83.97 159.94 21.14 Favored 'General case' 0 C--O 1.253 1.283 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -72.51 -34.62 67.76 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.1 t90 -55.37 -55.22 34.09 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.262 179.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.1 m -65.42 -41.52 93.46 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.912 179.451 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -65.33 -28.08 69.05 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.777 0.322 . . . . 0.0 111.724 -177.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -91.89 -44.82 8.7 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 120.872 0.368 . . . . 0.0 111.677 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 65.7 m-70 -92.48 -19.33 22.11 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -171.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.477 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . . . -99.53 139.22 35.51 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-O 121.321 0.582 . . . . 0.0 109.934 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -90.64 -4.49 56.76 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 121.857 0.837 . . . . 0.0 110.105 -175.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.477 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 9.2 p -86.52 3.82 42.51 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.571 177.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.1 m -115.03 98.55 6.87 Favored 'General case' 0 N--CA 1.421 -1.894 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.472 0 CA-C-N 116.595 -0.275 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.417 -2.117 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -68.35 -11.97 62.73 Favored Glycine 0 CA--C 1.509 -0.306 0 O-C-N 123.134 0.271 . . . . 0.0 113.086 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.53 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 30.6 m -65.2 -26.59 68.2 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 121.427 0.632 . . . . 0.0 111.877 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.4 m -95.93 9.3 41.09 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-O 121.535 0.683 . . . . 0.0 110.939 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -108.13 15.9 23.8 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.818 0.818 . . . . 0.0 108.926 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -145.48 148.5 20.27 Favored Glycine 0 N--CA 1.429 -1.769 0 CA-C-O 118.755 -1.025 . . . . 0.0 110.542 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -52.04 -41.89 61.84 Favored 'Trans proline' 0 C--O 1.245 0.843 0 C-N-CA 123.162 2.575 . . . . 0.0 112.298 177.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.7 mttp -122.66 74.57 1.2 Allowed 'General case' 0 N--CA 1.433 -1.307 0 CA-C-O 121.469 0.652 . . . . 0.0 110.81 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.53 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -102.35 -52.37 1.0 Allowed Glycine 0 N--CA 1.432 -1.572 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 173.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.507 ' HA ' ' HB2' ' A' ' 15' ' ' CYS . 75.9 m -81.92 15.35 2.3 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.194 0.521 . . . . 0.0 111.903 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.1 p -71.99 -27.86 63.03 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-O 121.926 0.869 . . . . 0.0 109.068 175.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.6 t -86.52 138.59 31.6 Favored 'General case' 0 N--CA 1.418 -2.025 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -59.55 -24.22 63.53 Favored 'General case' 0 C--N 1.315 -0.923 0 O-C-N 123.621 0.576 . . . . 0.0 111.675 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -64.39 -54.31 34.78 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.507 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 97.5 m -68.9 -36.89 78.57 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.032 178.396 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.9 ttt180 -60.18 -33.02 71.63 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 120.83 0.348 . . . . 0.0 110.541 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -92.1 -49.73 6.05 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.654 -0.418 . . . . 0.0 112.071 179.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -89.95 -11.51 41.5 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -167.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.45 142.33 35.98 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 119.286 -0.965 . . . . 0.0 108.54 176.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -84.45 -21.82 30.56 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 -177.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.6 p -81.86 -16.85 49.37 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.258 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.1 m -116.37 -79.53 0.59 Allowed 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 176.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.14 0 O-C-N 122.255 -0.278 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.417 -2.121 0 N-CA-C 110.129 -0.322 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 89.62 -72.65 2.11 Favored Glycine 0 N--CA 1.433 -1.536 0 CA-C-N 115.929 -0.578 . . . . 0.0 113.286 174.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.467 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 58.3 m -98.12 -1.87 41.31 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-O 121.367 0.604 . . . . 0.0 111.667 -173.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.5 m -95.65 13.05 27.6 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-O 121.156 0.503 . . . . 0.0 112.238 -170.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -90.05 -11.34 41.74 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.959 0.409 . . . . 0.0 111.505 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -154.33 162.66 30.74 Favored Glycine 0 N--CA 1.433 -1.554 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.332 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -69.22 -13.21 35.63 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.966 2.444 . . . . 0.0 113.192 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -87.23 -28.3 22.45 Favored 'General case' 0 C--O 1.244 0.815 0 O-C-N 121.876 -0.515 . . . . 0.0 109.841 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.467 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -61.37 -51.96 54.6 Favored Glycine 0 N--CA 1.432 -1.588 0 N-CA-C 110.009 -1.236 . . . . 0.0 110.009 175.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.3 m -75.38 -9.95 59.02 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.3 t -80.95 -19.75 43.49 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 m -76.5 126.66 31.37 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 176.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -56.74 -37.82 71.54 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -174.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 91.1 t90 -62.27 -43.73 98.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.451 0.643 . . . . 0.0 109.326 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 62.2 m -73.99 -38.08 64.23 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.035 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -60.56 -36.21 77.93 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.132 0.492 . . . . 0.0 110.573 176.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -81.14 -52.67 7.12 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.273 -178.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -94.54 -32.4 13.48 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -169.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.32 120.92 23.02 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.5 mmm180 -78.84 -9.5 59.49 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.118 -170.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.6 p -97.87 3.99 49.69 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 121.764 0.792 . . . . 0.0 110.203 174.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 86.9 m -111.9 -76.69 0.59 Allowed 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.634 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.28 0 O-C-N 121.991 -0.443 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.42 -1.933 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 82.11 -55.38 4.93 Favored Glycine 0 C--N 1.306 -1.091 0 N-CA-C 114.431 0.532 . . . . 0.0 114.431 175.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 78.5 m -51.7 -42.67 62.38 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -173.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 46.8 m -98.54 4.56 48.2 Favored 'General case' 0 C--N 1.271 -2.837 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.664 -175.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -102.58 13.95 33.2 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 121.347 0.594 . . . . 0.0 110.671 -179.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.76 147.06 12.0 Favored Glycine 0 N--CA 1.426 -1.972 0 C-N-CA 120.144 -1.026 . . . . 0.0 111.44 178.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.69 -27.95 85.69 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.219 2.612 . . . . 0.0 113.104 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -88.71 -1.89 58.31 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 122.104 -0.373 . . . . 0.0 110.195 -178.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -70.07 -69.18 1.44 Allowed Glycine 0 N--CA 1.439 -1.142 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.263 -178.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.5 m -80.84 10.74 4.59 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.4 t -69.86 -38.8 76.55 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 171.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 m -68.28 130.39 42.77 Favored 'General case' 0 N--CA 1.426 -1.669 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -60.62 -31.03 70.23 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 123.07 0.548 . . . . 0.0 111.22 -175.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -61.81 -48.4 80.75 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 176.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 54.2 m -70.27 -23.69 62.93 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 116.116 -0.493 . . . . 0.0 112.303 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -70.49 -42.77 70.94 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 120.019 -0.672 . . . . 0.0 110.432 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -87.81 -43.72 11.64 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -89.03 5.06 46.1 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -168.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -116.47 114.71 24.59 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 173.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 20' ' ' ARG . 47.3 mtm180 -64.78 -22.51 67.0 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.71 -173.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.2 p -74.88 -13.52 60.56 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 82.9 m -109.05 87.65 2.54 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.28 0.562 . . . . 0.0 110.546 176.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.313 -1.007 0 CA-C-N 116.303 -0.408 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.604 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -90.75 53.21 3.34 Favored Glycine 0 C--O 1.241 0.533 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.49 ' HA ' ' HA3' ' A' ' 9' ' ' GLY . 2.6 m -73.9 -14.41 61.06 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 123.66 0.784 . . . . 0.0 112.472 -171.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.43 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 60.6 m -105.86 -11.85 16.07 Favored 'General case' 0 C--N 1.285 -2.216 0 CA-C-O 121.468 0.651 . . . . 0.0 110.787 -176.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -91.99 -34.17 14.55 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.637 0.732 . . . . 0.0 109.516 179.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -96.18 132.07 10.9 Favored Glycine 0 N--CA 1.433 -1.556 0 N-CA-C 109.031 -1.627 . . . . 0.0 109.031 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -54.73 -36.02 89.19 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.875 2.384 . . . . 0.0 114.359 -176.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -105.22 27.95 7.76 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.09 0.472 . . . . 0.0 110.381 178.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.49 ' HA3' ' HA ' ' A' ' 3' ' ' CYS . . . -60.72 -36.16 91.19 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.896 -179.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.2 m -84.79 28.32 0.69 Allowed 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 117.119 0.46 . . . . 0.0 112.096 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.5 t -72.76 -34.97 67.34 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.7 p -80.37 150.58 29.81 Favored 'General case' 0 C--O 1.259 1.565 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.174 178.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.738 ' HA ' ' HE2' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -58.61 -40.09 82.29 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.064 -179.914 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -57.74 -56.93 15.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 123.991 0.807 . . . . 0.0 109.965 177.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.489 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 78.6 m -61.57 -38.75 88.65 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -177.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -65.5 -23.16 66.82 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.481 -0.488 . . . . 0.0 111.396 -177.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -102.22 -49.33 3.93 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 120.971 0.415 . . . . 0.0 111.903 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -89.43 -24.88 21.77 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -168.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.43 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . . . -70.83 136.04 48.47 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -70.55 -11.85 61.19 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -170.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.0 p -84.55 -18.67 34.93 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.186 0.517 . . . . 0.0 110.381 176.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.9 m -124.73 -81.97 0.64 Allowed 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -177.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.473 0 O-C-N 121.971 -0.456 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.424 -1.725 0 CA-C-O 121.01 0.433 . . . . 0.0 110.439 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -82.24 55.1 4.93 Favored Glycine 0 C--O 1.237 0.338 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 176.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.472 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 35.3 m -78.33 -21.93 48.84 Favored 'General case' 0 C--N 1.299 -1.629 0 C-N-CA 123.815 0.846 . . . . 0.0 111.065 -174.479 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 50.0 m -104.71 17.06 24.83 Favored 'General case' 0 C--N 1.279 -2.496 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.089 -176.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -89.43 0.22 57.01 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.442 0.639 . . . . 0.0 110.495 -176.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 157.71 177.32 30.71 Favored Glycine 0 N--CA 1.433 -1.515 0 C-N-CA 120.512 -0.851 . . . . 0.0 111.624 178.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -52.82 -35.46 69.9 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.857 3.038 . . . . 0.0 113.313 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -89.03 17.92 5.37 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.088 0.47 . . . . 0.0 110.985 -177.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -91.79 -28.77 13.12 Favored Glycine 0 N--CA 1.414 -2.772 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 171.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 70.1 m -95.86 11.86 32.22 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 123.234 0.613 . . . . 0.0 111.67 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.4 p -74.46 -28.71 61.15 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 123.394 0.677 . . . . 0.0 111.348 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.5 p -88.11 141.26 28.71 Favored 'General case' 0 N--CA 1.424 -1.757 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.889 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -61.14 -35.18 76.37 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -54.38 -52.55 61.31 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.971 177.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.472 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 82.8 m -70.15 -34.96 73.68 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.695 177.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -61.61 -37.07 82.6 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.318 0.58 . . . . 0.0 109.739 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -78.09 -44.23 26.8 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.451 179.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -89.48 -34.49 16.41 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -170.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.459 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . . . -92.84 122.77 35.56 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-O 121.417 0.627 . . . . 0.0 111.077 -175.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -82.42 -3.94 56.52 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.55 0.69 . . . . 0.0 110.312 -178.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.459 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 27.6 p -79.4 -9.28 59.56 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.46 -0.791 . . . . 0.0 108.954 173.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.7 m -104.4 90.74 3.64 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.136 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.377 0 CA-C-N 116.554 -0.294 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -1.708 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 112.55 -14.35 24.98 Favored Glycine 0 N--CA 1.446 -0.688 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.656 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.571 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 30.5 m -75.99 -17.36 59.73 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 121.439 0.638 . . . . 0.0 112.365 -174.067 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.653 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 81.4 m -84.61 -10.69 57.12 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.356 179.344 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -101.03 0.6 38.35 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -175.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.39 147.11 18.26 Favored Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -178.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -58.56 -41.59 63.05 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 123.392 2.728 . . . . 0.0 114.127 -177.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -111.92 27.89 9.25 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.913 0.387 . . . . 0.0 110.25 -178.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.571 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -58.2 -37.95 88.3 Favored Glycine 0 C--O 1.22 -0.725 0 CA-C-N 115.109 -0.95 . . . . 0.0 113.342 -178.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 82.6 m -80.05 -3.18 47.48 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.7 t -85.34 66.39 9.68 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-O 122.135 0.969 . . . . 0.0 108.712 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.0 t -174.33 138.94 0.58 Allowed 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.661 1.585 . . . . 0.0 106.842 -178.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -71.89 -34.96 69.58 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -178.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.8 t90 -60.7 -43.82 97.31 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.764 0.792 . . . . 0.0 109.216 178.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.2 m -71.62 -37.7 70.87 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.618 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.509 ' HA ' ' CB ' ' A' ' 22' ' ' CYS . 1.7 tmt_? -64.71 -36.89 85.73 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -68.68 -42.45 77.8 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.866 179.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -98.23 -44.03 6.74 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 -172.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.653 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . . . -75.85 131.98 40.06 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.318 0.58 . . . . 0.0 111.521 -172.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -74.09 -12.26 60.55 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.225 -174.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 20.2 p -89.03 -10.48 47.35 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.572 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.509 ' CB ' ' HA ' ' A' ' 16' ' ' ARG . 59.8 m -98.33 91.89 5.43 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.024 0.44 . . . . 0.0 110.931 -175.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.326 0 O-C-N 122.279 -0.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -1.796 0 CA-C-O 120.931 0.396 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -123.69 68.42 0.48 Allowed Glycine 0 N--CA 1.429 -1.811 0 N-CA-C 109.214 -1.555 . . . . 0.0 109.214 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.495 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 57.1 m -101.12 -45.13 5.48 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 121.927 0.87 . . . . 0.0 110.11 -177.766 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 19' ' ' ALA . 73.5 m -97.05 24.84 5.88 Favored 'General case' 0 C--N 1.275 -2.651 0 CA-C-N 114.671 -1.149 . . . . 0.0 111.225 -177.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.4 p-10 -89.72 -11.2 42.99 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-O 121.195 0.521 . . . . 0.0 110.132 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 151.07 -164.1 29.95 Favored Glycine 0 N--CA 1.424 -2.163 0 C-N-CA 120.417 -0.897 . . . . 0.0 111.846 178.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -60.96 -15.3 37.93 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.97 3.114 . . . . 0.0 114.997 -175.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.46 ' HZ2' ' HB3' ' A' ' 8' ' ' LYS . 9.7 mtpm? -89.1 -11.78 43.02 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.427 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -77.35 -50.32 6.78 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 119.982 -1.104 . . . . 0.0 111.775 -178.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -67.27 -2.65 6.27 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.2 m -71.12 -30.26 66.28 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-O 120.674 0.273 . . . . 0.0 110.86 178.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.4 t -83.98 137.09 33.8 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 176.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -60.91 -32.87 72.34 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.875 0.734 . . . . 0.0 109.675 178.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -61.94 -53.49 54.95 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.184 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.495 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.2 m -66.46 -39.31 88.75 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.598 178.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -60.28 -33.32 72.17 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 122.736 0.414 . . . . 0.0 111.252 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -86.91 -38.25 16.88 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.844 0.354 . . . . 0.0 111.729 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -92.71 -26.3 17.83 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -172.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.467 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . . . -96.75 138.46 34.28 Favored 'General case' 0 C--N 1.295 -1.789 0 C-N-CA 120.426 -0.509 . . . . 0.0 110.731 -177.327 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -88.04 0.97 55.3 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-O 121.105 0.479 . . . . 0.0 111.532 -177.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.3 p -83.06 -13.24 56.18 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-O 121.73 0.776 . . . . 0.0 109.107 174.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 61.3 m -101.67 88.24 3.36 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.879 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.16 0 CA-C-N 116.092 -0.503 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.657 ' HA ' ' HA3' ' A' ' 9' ' ' GLY . 60.2 m . . . . . 0 CA--C 1.514 -0.434 0 CA-C-O 121.99 0.9 . . . . 0.0 112.284 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 63.7 m -108.46 16.18 23.26 Favored 'General case' 0 C--N 1.262 -3.202 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.706 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -117.18 -23.23 7.98 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.569 -178.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.59 163.75 13.56 Favored Glycine 0 N--CA 1.434 -1.494 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -70.75 -19.12 31.79 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.156 2.571 . . . . 0.0 114.493 -175.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -104.67 -4.42 22.48 Favored 'General case' 0 C--N 1.311 -1.086 0 O-C-N 122.013 -0.43 . . . . 0.0 111.852 -175.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.657 ' HA3' ' HA ' ' A' ' 3' ' ' CYS . . . -63.54 -52.77 43.59 Favored Glycine 0 C--O 1.219 -0.836 0 C-N-CA 121.116 -0.564 . . . . 0.0 112.995 -176.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -84.41 5.53 26.82 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.688 0.756 . . . . 0.0 110.688 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.1 t -91.75 -15.39 28.41 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 31.3 m -86.7 127.12 34.95 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -61.59 -33.94 74.76 Favored 'General case' 0 C--O 1.198 -1.616 0 CA-C-O 118.923 -0.56 . . . . 0.0 112.351 -174.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.6 t90 -57.37 -44.49 84.47 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.29 0.567 . . . . 0.0 110.262 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.478 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 68.1 m -70.23 -34.89 73.42 Favored 'General case' 0 C--O 1.207 -1.145 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.097 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -66.15 -39.4 89.8 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.802 0.334 . . . . 0.0 110.334 175.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -70.25 -52.14 25.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.299 0.571 . . . . 0.0 111.471 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -93.36 -38.19 11.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -170.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.13 124.69 34.06 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.365 0.602 . . . . 0.0 110.789 -174.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -69.44 -21.92 63.7 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.535 -177.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.2 p -77.46 -13.82 59.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.076 0.465 . . . . 0.0 111.685 178.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.8 m . . . . . 0 C--O 1.241 0.62 0 CA-C-O 121.258 0.551 . . . . 0.0 110.206 176.702 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.402 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 34.2 m . . . . . 0 N--CA 1.444 -0.755 0 CA-C-O 121.496 0.665 . . . . 0.0 111.264 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 18.9 m -93.93 25.72 3.53 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.324 -176.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -88.13 -24.53 23.34 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.001 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.52 176.88 47.45 Favored Glycine 0 N--CA 1.435 -1.402 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.085 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -62.85 -21.87 73.43 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.676 2.918 . . . . 0.0 114.219 -177.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -89.15 -6.35 57.05 Favored 'General case' 0 C--O 1.24 0.567 0 O-C-N 121.927 -0.483 . . . . 0.0 110.158 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.402 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -70.43 -32.71 68.03 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.151 -1.58 . . . . 0.0 109.151 175.598 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.1 m -80.18 2.08 25.69 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.661 -0.769 . . . . 0.0 112.243 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.9 m -90.87 25.0 2.53 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.832 0.825 . . . . 0.0 109.79 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.513 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 12.4 m -127.52 131.7 50.04 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -64.4 -39.9 94.75 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.479 -175.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -54.19 -39.25 66.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.703 0.763 . . . . 0.0 110.296 177.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.513 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 55.9 m -74.24 -31.89 62.77 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.57 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -72.39 -37.0 68.82 Favored 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -75.74 -47.46 25.9 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.234 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -100.01 -30.73 11.82 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 114.714 1.376 . . . . 0.0 114.714 -168.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -89.94 131.73 35.69 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.823 -175.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -66.96 -31.09 71.43 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.097 -176.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.7 p -69.21 -23.79 63.94 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.056 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 15' ' ' CYS . 56.3 m . . . . . 0 N--CA 1.435 -1.214 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.3 m . . . . . 0 N--CA 1.438 -1.035 0 CA-C-O 122.105 0.955 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 45.5 m -88.09 8.78 25.12 Favored 'General case' 0 C--N 1.275 -2.64 0 CA-C-N 114.96 -1.018 . . . . 0.0 113.739 -172.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -111.25 42.36 1.67 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 122.48 1.133 . . . . 0.0 108.368 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 170.86 144.12 4.24 Favored Glycine 0 N--CA 1.424 -2.102 0 CA-C-N 114.5 -1.227 . . . . 0.0 110.146 177.159 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_exo -62.38 -28.06 78.06 Favored 'Trans proline' 0 C--O 1.214 -0.709 0 C-N-CA 122.619 2.213 . . . . 0.0 112.109 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -103.86 11.27 35.86 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 121.115 0.483 . . . . 0.0 109.804 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.28 -32.22 52.56 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 177.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.4 m -91.61 29.09 1.58 Allowed 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 122.799 0.44 . . . . 0.0 111.408 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.5 p -62.5 -45.79 91.4 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 123.799 0.839 . . . . 0.0 110.969 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.0 m -67.49 137.59 55.93 Favored 'General case' 0 C--O 1.253 1.261 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.055 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.402 ' HD3' ' O ' ' A' ' 13' ' ' LYS . 12.6 tmtt? -59.39 -33.86 71.72 Favored 'General case' 0 C--O 1.208 -1.083 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 175.595 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -51.14 -50.29 59.17 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.6 m -65.32 -45.85 82.67 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.541 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -64.75 -28.12 69.36 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.057 0.456 . . . . 0.0 111.31 -178.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -88.34 -47.49 8.35 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.917 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 30.0 m80 -93.71 -23.22 18.3 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -172.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -95.79 120.87 36.82 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 121.713 0.768 . . . . 0.0 109.976 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -74.87 -22.48 58.64 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.995 -175.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 p -83.96 3.23 35.07 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 114.775 -1.102 . . . . 0.0 111.885 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 95.4 m . . . . . 0 N--CA 1.443 -0.821 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 176.856 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.482 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 64.6 m . . . . . 0 C--O 1.212 -0.893 0 CA-C-O 121.485 0.659 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.6 m -114.48 41.28 2.35 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.057 0.932 . . . . 0.0 110.157 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -93.59 12.05 26.64 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.279 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 159.6 164.99 15.67 Favored Glycine 0 N--CA 1.432 -1.584 0 N-CA-C 110.044 -1.223 . . . . 0.0 110.044 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -59.54 -18.38 46.65 Favored 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.472 2.782 . . . . 0.0 115.287 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -104.12 13.72 31.87 Favored 'General case' 0 C--O 1.241 0.61 0 O-C-N 121.386 -0.821 . . . . 0.0 111.731 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.13 -39.53 52.87 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.298 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.422 ' HA ' ' HB3' ' A' ' 15' ' ' CYS . 74.0 m -97.21 34.04 1.84 Allowed 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.126 0.488 . . . . 0.0 111.373 -178.457 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.4 p -72.82 -36.9 67.62 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.6 0.714 . . . . 0.0 109.239 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -69.89 144.7 52.39 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.657 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -57.54 -44.67 85.33 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 123.991 0.916 . . . . 0.0 112.592 -176.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.0 t90 -62.96 -49.95 72.7 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.482 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 68.6 m -57.03 -41.07 77.95 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -60.97 -37.95 84.22 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.774 0.321 . . . . 0.0 111.019 178.351 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.24 -51.36 11.05 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 177.566 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 72.1 m-70 -88.88 -17.69 29.13 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 115.05 1.5 . . . . 0.0 115.05 -165.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.94 114.78 23.11 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 44.2 mtm180 -67.73 -24.44 65.37 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.348 0.594 . . . . 0.0 110.131 -176.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -71.39 -12.5 61.45 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.591 176.342 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.0 m . . . . . 0 N--CA 1.433 -1.325 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 176.312 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.457 ' HB2' ' HB3' ' A' ' 15' ' ' CYS . 97.0 m . . . . . 0 C--O 1.223 -0.324 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 61.0 m -117.2 11.96 14.27 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 122.53 1.157 . . . . 0.0 108.603 171.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -144.57 150.12 36.96 Favored 'General case' 0 N--CA 1.425 -1.691 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 136.02 -164.43 25.01 Favored Glycine 0 C--N 1.292 -1.881 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.34 -42.02 45.17 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.138 2.559 . . . . 0.0 113.46 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -134.45 17.49 3.66 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 120.558 0.218 . . . . 0.0 111.094 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.31 -83.6 0.75 Allowed Glycine 0 N--CA 1.433 -1.526 0 N-CA-C 109.19 -1.564 . . . . 0.0 109.19 -174.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.8 m -101.3 64.12 1.01 Allowed 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.357 0.598 . . . . 0.0 109.515 177.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.2 t -78.04 -32.58 51.02 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -71.26 131.46 43.51 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -54.94 -46.68 74.99 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.256 1.022 . . . . 0.0 112.601 -173.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 91.3 t90 -55.71 -44.21 77.21 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.576 0.703 . . . . 0.0 110.664 178.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.457 ' HB3' ' HB2' ' A' ' 3' ' ' CYS . 60.7 m -67.26 -32.05 72.81 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.707 -176.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -64.71 -32.32 73.94 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -97.09 -20.52 17.95 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 53.3 m80 -114.9 -18.32 11.32 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 -170.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.13 158.74 31.43 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 118.727 0.694 . . . . 0.0 111.31 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -84.18 -37.95 21.24 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.4 p -69.78 -13.72 62.42 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.899 -1.046 . . . . 0.0 113.249 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 63.2 m . . . . . 0 N--CA 1.437 -1.087 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.165 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 75.1 m . . . . . 0 C--O 1.246 0.891 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 66.6 m -83.69 70.67 10.36 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-O 121.557 0.694 . . . . 0.0 111.037 -176.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 32.5 p-10 -149.28 13.19 0.85 Allowed 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.281 176.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -160.25 163.07 33.69 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.73 -15.63 37.3 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.38 2.72 . . . . 0.0 114.173 -176.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -102.62 1.9 35.32 Favored 'General case' 0 C--N 1.307 -1.253 0 O-C-N 122.088 -0.383 . . . . 0.0 110.225 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.46 -59.95 9.33 Favored Glycine 0 C--O 1.218 -0.897 0 O-C-N 123.717 0.635 . . . . 0.0 113.32 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.9 m -82.49 -3.14 55.32 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.528 0.68 . . . . 0.0 111.146 -177.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.8 m -87.45 -16.01 36.06 Favored 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.315 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.9 m -79.1 134.26 36.74 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.673 ' HE2' ' HA ' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -51.7 -55.28 20.47 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.914 0.886 . . . . 0.0 112.897 -175.093 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.8 t90 -62.0 -49.22 76.92 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -177.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.0 m -61.92 -35.2 77.67 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.47 -175.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -58.54 -38.95 78.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.86 0.362 . . . . 0.0 111.383 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -103.3 -27.15 12.64 Favored 'General case' 0 C--N 1.31 -1.124 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -175.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -102.9 -7.5 21.47 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -172.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.24 119.79 39.94 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 107.216 -1.401 . . . . 0.0 107.216 173.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -66.23 -19.69 65.9 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.982 -173.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 3.4 p -77.61 -4.06 44.02 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.958 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 N--CA 1.441 -0.901 0 CA-C-O 121.403 0.621 . . . . 0.0 110.381 177.702 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 19' ' ' ALA . 70.6 m . . . . . 0 C--O 1.206 -1.189 0 CA-C-O 121.04 0.447 . . . . 0.0 110.382 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.416 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 71.2 m -116.19 11.23 15.12 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.847 0.832 . . . . 0.0 109.658 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -101.06 116.7 33.45 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.436 -177.119 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 114.9 168.92 15.9 Favored Glycine 0 C--N 1.303 -1.302 0 C-N-CA 121.185 -0.531 . . . . 0.0 112.349 173.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -66.02 -18.03 56.25 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 123.283 2.655 . . . . 0.0 112.424 179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.545 ' HB3' ' HB3' ' A' ' 11' ' ' SER . 10.0 mtmp? -88.88 -60.26 2.01 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.268 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.69 -98.69 1.07 Allowed Glycine 0 N--CA 1.424 -2.124 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 79.6 m -90.56 77.25 6.47 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 121.977 0.894 . . . . 0.0 109.47 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.545 ' HB3' ' HB3' ' A' ' 8' ' ' LYS . 4.1 p -94.67 -27.1 16.04 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 114.253 -1.34 . . . . 0.0 109.002 175.531 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 t -90.06 134.67 34.11 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 174.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -63.79 -37.4 87.24 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 123.642 0.588 . . . . 0.0 111.551 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.5 t90 -59.07 -41.25 87.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.392 0.615 . . . . 0.0 109.753 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.2 m -65.44 -29.41 70.09 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.718 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -71.38 -19.71 62.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.275 0.559 . . . . 0.0 110.876 -176.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -100.61 -13.26 18.65 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -120.6 -22.92 6.2 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.679 1.362 . . . . 0.0 114.679 -171.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.503 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . . . -77.71 140.86 39.57 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -66.38 -17.31 64.7 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -176.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.3 p -87.45 -3.66 59.01 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 122.906 0.482 . . . . 0.0 111.101 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 70.9 m . . . . . 0 N--CA 1.439 -1.004 0 CA-C-O 121.39 0.614 . . . . 0.0 110.075 -179.381 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.712 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 71.3 m . . . . . 0 CA--C 1.506 -0.722 0 CA-C-O 122.173 0.987 . . . . 0.0 109.733 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 73.1 m -84.51 73.14 10.57 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.022 175.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -120.42 2.44 10.76 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 114.16 -1.382 . . . . 0.0 108.96 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.49 -163.12 33.84 Favored Glycine 0 N--CA 1.421 -2.326 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.007 -177.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -86.62 4.9 6.12 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.286 2.657 . . . . 0.0 115.565 -174.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -123.99 5.96 8.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.542 0.61 . . . . 0.0 110.216 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.712 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -79.97 -33.52 32.98 Favored Glycine 0 C--O 1.214 -1.096 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.705 -175.087 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 67.0 m -92.6 21.92 5.08 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.328 0.585 . . . . 0.0 110.937 -178.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.6 t -76.1 -48.7 19.72 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -178.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.7 m -59.29 137.78 57.86 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.188 176.291 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -50.72 -48.01 58.98 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.155 0.982 . . . . 0.0 110.864 -178.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.7 t90 -56.43 -40.91 75.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.557 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.9 m -70.85 -32.44 69.46 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.526 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.1 ttt85 -72.85 -18.93 61.39 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 121.215 0.531 . . . . 0.0 110.877 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -98.99 -45.27 6.01 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.587 0.708 . . . . 0.0 111.144 176.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -89.88 -23.51 21.62 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -168.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.84 126.68 30.96 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 177.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 20' ' ' ARG . 52.5 mtp180 -72.47 -16.18 61.8 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.509 0.671 . . . . 0.0 110.948 -174.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -94.82 0.12 54.59 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 114.755 -1.112 . . . . 0.0 111.314 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 84.4 m . . . . . 0 C--N 1.321 -0.64 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.056 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 89.9 m . . . . . 0 C--O 1.209 -1.034 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 58.5 m -113.28 17.18 18.77 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.18 0.99 . . . . 0.0 108.751 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -89.81 -22.11 22.27 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.59 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.69 154.79 26.05 Favored Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.72 -28.94 82.72 Favored 'Trans proline' 0 C--O 1.244 0.812 0 C-N-CA 123.224 2.616 . . . . 0.0 113.597 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -90.27 -1.72 57.95 Favored 'General case' 0 N--CA 1.438 -1.039 0 O-C-N 121.866 -0.521 . . . . 0.0 111.345 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.05 -42.04 78.79 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.3 m -72.26 12.73 0.4 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.6 m -82.69 -22.53 34.5 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 m -72.81 123.08 22.65 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -62.59 -33.78 75.67 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.243 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -60.4 -36.71 78.76 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.758 0.79 . . . . 0.0 109.435 178.055 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 91.7 m -80.11 -11.86 59.72 Favored 'General case' 0 C--O 1.2 -1.528 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.262 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -77.71 -32.98 53.25 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.017 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -90.9 -34.48 15.21 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.26 178.274 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 74.7 m80 -93.12 -38.81 11.39 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -175.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.76 107.08 18.96 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.43 ' HA ' ' HD3' ' A' ' 20' ' ' ARG . 23.4 mmt180 -78.45 3.72 15.11 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.852 0.834 . . . . 0.0 111.905 -176.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 p -89.63 -9.32 50.08 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.261 171.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 80.6 m . . . . . 0 C--O 1.247 0.958 0 CA-C-O 121.172 0.51 . . . . 0.0 110.119 176.843 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.57 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 55.7 m . . . . . 0 N--CA 1.439 -0.991 0 CA-C-O 122.156 0.979 . . . . 0.0 110.361 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 58.9 m -90.44 72.2 6.98 Favored 'General case' 0 C--N 1.268 -2.964 0 CA-C-N 114.92 -1.036 . . . . 0.0 112.63 -173.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -147.54 12.51 1.03 Allowed 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 122.274 1.035 . . . . 0.0 108.234 173.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.44 164.79 35.81 Favored Glycine 0 N--CA 1.434 -1.478 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 -178.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -69.79 -20.51 34.6 Favored 'Trans proline' 0 C--O 1.223 -0.246 0 C-N-CA 122.944 2.429 . . . . 0.0 113.855 -176.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -112.62 33.98 4.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.977 0.418 . . . . 0.0 111.158 -177.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.57 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -92.75 -7.41 62.97 Favored Glycine 0 N--CA 1.438 -1.185 0 C-N-CA 120.447 -0.883 . . . . 0.0 113.745 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.5 m -115.71 24.84 11.21 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 117.651 0.725 . . . . 0.0 111.588 -176.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 p -84.13 -14.72 49.54 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.866 -177.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.1 p -98.24 153.41 18.51 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 121.025 0.44 . . . . 0.0 111.444 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -62.4 -40.14 95.55 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.242 177.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 71.4 t90 -59.49 -50.95 71.93 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.635 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.402 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 81.5 m -68.58 -37.9 80.23 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.197 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -64.3 -39.64 94.33 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.955 0.407 . . . . 0.0 111.433 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.15 -47.99 12.72 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -176.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -93.44 -12.14 30.48 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -168.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.421 ' HB1' ' SG ' ' A' ' 21' ' ' CYS . . . -111.0 124.19 51.67 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 176.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -76.83 -20.36 56.45 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.86 0.362 . . . . 0.0 110.977 -177.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.421 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 5.9 p -66.79 -20.75 66.01 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.999 173.126 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.4 m . . . . . 0 N--CA 1.437 -1.089 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.236 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 62.1 m . . . . . 0 N--CA 1.447 -0.61 0 CA-C-O 121.595 0.712 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 38.9 m -93.95 -18.84 21.49 Favored 'General case' 0 C--N 1.292 -1.907 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.439 -177.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -97.22 79.75 2.85 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 122.623 1.202 . . . . 0.0 111.405 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 149.52 145.23 4.09 Favored Glycine 0 N--CA 1.432 -1.624 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.843 176.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -59.97 -35.63 92.61 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.035 2.49 . . . . 0.0 111.968 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -96.97 17.88 15.93 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.358 -178.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -67.15 -32.12 79.4 Favored Glycine 0 N--CA 1.433 -1.563 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 50.7 m -93.96 15.67 16.27 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 122.846 0.458 . . . . 0.0 111.897 -176.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.5 m -66.14 -44.59 83.76 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.735 0.302 . . . . 0.0 111.05 -177.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.1 m -74.66 134.38 42.01 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.7 -32.78 70.84 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 123.008 0.193 . . . . 0.0 110.86 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -55.13 -49.64 71.28 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 176.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 98.9 m -64.57 -43.2 94.66 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.259 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -65.65 -41.01 93.07 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 120.984 0.421 . . . . 0.0 111.81 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -78.58 -46.19 19.94 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.104 -176.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -92.03 -24.76 19.09 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -170.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 15' ' ' CYS . . . -95.88 113.61 25.25 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 175.128 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -77.35 4.15 11.48 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 124.469 1.108 . . . . 0.0 111.931 -172.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.9 p -83.49 -20.13 34.52 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 173.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.8 m . . . . . 0 N--CA 1.43 -1.427 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.504 179.452 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 70.2 m . . . . . 0 C--O 1.209 -1.04 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.53 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 70.8 m -106.02 24.8 11.81 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 122.548 1.166 . . . . 0.0 108.689 -177.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.3 p-10 -88.89 -15.26 34.85 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.756 -1.565 . . . . 0.0 109.716 -178.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -169.03 165.83 39.23 Favored Glycine 0 N--CA 1.431 -1.635 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -62.93 -27.21 74.47 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 123.163 2.575 . . . . 0.0 112.991 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.453 ' HA ' ' HB2' ' A' ' 11' ' ' SER . 53.2 mtpt -89.44 -11.94 41.63 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.732 -179.041 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.92 -46.29 91.92 Favored Glycine 0 CA--C 1.499 -0.918 0 N-CA-C 107.814 -2.115 . . . . 0.0 107.814 172.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.2 m -79.33 0.33 29.39 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.649 -0.776 . . . . 0.0 112.425 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.453 ' HB2' ' HA ' ' A' ' 8' ' ' LYS . 22.1 t -76.64 -33.08 58.35 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.177 0.513 . . . . 0.0 109.851 -178.261 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.6 m -75.28 130.32 38.89 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.256 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -50.64 -45.64 57.88 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.37 1.068 . . . . 0.0 112.245 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.0 t90 -53.22 -46.65 69.17 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.603 0.716 . . . . 0.0 110.174 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 91.0 m -69.47 -43.76 72.58 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.962 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -61.77 -31.88 72.12 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.591 0.71 . . . . 0.0 110.461 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.01 -41.32 51.39 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.834 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -94.03 -37.07 11.83 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -174.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.53 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -86.81 113.75 22.89 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -88.07 -3.63 58.87 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.802 -174.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.4 p -88.58 5.8 41.12 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.575 175.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 84.3 m . . . . . 0 N--CA 1.437 -1.1 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.808 176.529 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 22.3 m . . . . . 0 CA--C 1.498 -1.023 0 CA-C-O 122.156 0.979 . . . . 0.0 111.02 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.6 m -92.78 25.21 3.23 Favored 'General case' 0 C--N 1.273 -2.742 0 CA-C-N 114.583 -1.189 . . . . 0.0 112.004 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 35.7 p30 -89.32 -11.61 42.89 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 153.88 -174.03 32.45 Favored Glycine 0 N--CA 1.425 -2.035 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.96 -23.37 72.58 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.523 2.815 . . . . 0.0 113.288 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -89.04 -5.4 57.92 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 122.138 -0.351 . . . . 0.0 111.169 -177.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -82.27 -25.0 53.07 Favored Glycine 0 N--CA 1.435 -1.388 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.119 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.3 m -86.77 20.6 2.5 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 123.535 0.734 . . . . 0.0 111.062 -178.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.6 p -69.86 -33.14 71.86 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.643 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.1 p -83.97 159.94 21.14 Favored 'General case' 0 C--O 1.253 1.283 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.044 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -72.51 -34.62 67.76 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.161 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.1 t90 -55.37 -55.22 34.09 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.262 179.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.1 m -65.42 -41.52 93.46 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.912 179.451 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -65.33 -28.08 69.05 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.777 0.322 . . . . 0.0 111.724 -177.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -91.89 -44.82 8.7 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 120.872 0.368 . . . . 0.0 111.677 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -92.48 -19.33 22.11 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -171.538 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.516 ' HB1' ' SG ' ' A' ' 21' ' ' CYS . . . -99.53 139.22 35.51 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-O 121.321 0.582 . . . . 0.0 109.934 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -90.64 -4.49 56.76 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 121.857 0.837 . . . . 0.0 110.105 -175.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.516 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 9.2 p -86.52 3.82 42.51 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.571 177.004 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.1 m . . . . . 0 N--CA 1.421 -1.894 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.451 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.526 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 30.6 m . . . . . 0 N--CA 1.444 -0.754 0 CA-C-O 121.427 0.632 . . . . 0.0 111.877 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.4 m -95.93 9.3 41.09 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-O 121.535 0.683 . . . . 0.0 110.939 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -108.13 15.9 23.8 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.818 0.818 . . . . 0.0 108.926 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -145.48 148.5 20.27 Favored Glycine 0 N--CA 1.429 -1.769 0 CA-C-O 118.755 -1.025 . . . . 0.0 110.542 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -52.04 -41.89 61.84 Favored 'Trans proline' 0 C--O 1.245 0.843 0 C-N-CA 123.162 2.575 . . . . 0.0 112.298 177.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.7 mttp -122.66 74.57 1.2 Allowed 'General case' 0 N--CA 1.433 -1.307 0 CA-C-O 121.469 0.652 . . . . 0.0 110.81 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.526 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -102.35 -52.37 1.0 Allowed Glycine 0 N--CA 1.432 -1.572 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 173.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.535 ' HA ' ' HB2' ' A' ' 15' ' ' CYS . 75.9 m -81.92 15.35 2.3 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.194 0.521 . . . . 0.0 111.903 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.1 p -71.99 -27.86 63.03 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-O 121.926 0.869 . . . . 0.0 109.068 175.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.6 t -86.52 138.59 31.6 Favored 'General case' 0 N--CA 1.418 -2.025 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -59.55 -24.22 63.53 Favored 'General case' 0 C--N 1.315 -0.923 0 O-C-N 123.621 0.576 . . . . 0.0 111.675 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -64.39 -54.31 34.78 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.352 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.535 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 97.5 m -68.9 -36.89 78.57 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.032 178.396 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.9 ttt180 -60.18 -33.02 71.63 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 120.83 0.348 . . . . 0.0 110.541 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -92.1 -49.73 6.05 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.654 -0.418 . . . . 0.0 112.071 179.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -89.95 -11.51 41.5 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -167.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.45 142.33 35.98 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 119.286 -0.965 . . . . 0.0 108.54 176.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -84.45 -21.82 30.56 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 -177.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.6 p -81.86 -16.85 49.37 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.258 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.1 m . . . . . 0 C--N 1.314 -0.954 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 176.137 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.455 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 58.3 m . . . . . 0 C--O 1.219 -0.546 0 CA-C-O 121.367 0.604 . . . . 0.0 111.667 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.5 m -95.65 13.05 27.6 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-O 121.156 0.503 . . . . 0.0 112.238 -170.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -90.05 -11.34 41.74 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.959 0.409 . . . . 0.0 111.505 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -154.33 162.66 30.74 Favored Glycine 0 N--CA 1.433 -1.554 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.332 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -69.22 -13.21 35.63 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.966 2.444 . . . . 0.0 113.192 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -87.23 -28.3 22.45 Favored 'General case' 0 C--O 1.244 0.815 0 O-C-N 121.876 -0.515 . . . . 0.0 109.841 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -61.37 -51.96 54.6 Favored Glycine 0 N--CA 1.432 -1.588 0 N-CA-C 110.009 -1.236 . . . . 0.0 110.009 175.808 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.3 m -75.38 -9.95 59.02 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.3 t -80.95 -19.75 43.49 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 m -76.5 126.66 31.37 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 176.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -56.74 -37.82 71.54 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -174.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 91.1 t90 -62.27 -43.73 98.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.451 0.643 . . . . 0.0 109.326 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 62.2 m -73.99 -38.08 64.23 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.035 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -60.56 -36.21 77.93 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.132 0.492 . . . . 0.0 110.573 176.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -81.14 -52.67 7.12 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.273 -178.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -94.54 -32.4 13.48 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -169.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.32 120.92 23.02 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.5 mmm180 -78.84 -9.5 59.49 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.118 -170.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.6 p -97.87 3.99 49.69 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 121.764 0.792 . . . . 0.0 110.203 174.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 86.9 m . . . . . 0 N--CA 1.435 -1.198 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.634 174.255 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 78.5 m . . . . . 0 N--CA 1.463 0.218 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 46.8 m -98.54 4.56 48.2 Favored 'General case' 0 C--N 1.271 -2.837 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.664 -175.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -102.58 13.95 33.2 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 121.347 0.594 . . . . 0.0 110.671 -179.159 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.403 ' HA2' ' HD3' ' A' ' 7' ' ' PRO . . . -164.76 147.06 12.0 Favored Glycine 0 N--CA 1.426 -1.972 0 C-N-CA 120.144 -1.026 . . . . 0.0 111.44 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.403 ' HD3' ' HA2' ' A' ' 6' ' ' GLY . 33.3 Cg_exo -60.69 -27.95 85.69 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.219 2.612 . . . . 0.0 113.104 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -88.71 -1.89 58.31 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 122.104 -0.373 . . . . 0.0 110.195 -178.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -70.07 -69.18 1.44 Allowed Glycine 0 N--CA 1.439 -1.142 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.263 -178.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.5 m -80.84 10.74 4.59 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.4 t -69.86 -38.8 76.55 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 171.229 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 m -68.28 130.39 42.77 Favored 'General case' 0 N--CA 1.426 -1.669 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -60.62 -31.03 70.23 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 123.07 0.548 . . . . 0.0 111.22 -175.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -61.81 -48.4 80.75 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 176.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 54.2 m -70.27 -23.69 62.93 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 116.116 -0.493 . . . . 0.0 112.303 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -70.49 -42.77 70.94 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 120.019 -0.672 . . . . 0.0 110.432 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -87.81 -43.72 11.64 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -89.03 5.06 46.1 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -168.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -116.47 114.71 24.59 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 173.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -64.78 -22.51 67.0 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.71 -173.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.2 p -74.88 -13.52 60.56 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 82.9 m . . . . . 0 C--N 1.316 -0.874 0 CA-C-O 121.28 0.562 . . . . 0.0 110.546 176.19 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HA ' ' HA3' ' A' ' 9' ' ' GLY . 2.6 m . . . . . 0 N--CA 1.444 -0.728 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.445 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 60.6 m -105.86 -11.85 16.07 Favored 'General case' 0 C--N 1.285 -2.216 0 CA-C-O 121.468 0.651 . . . . 0.0 110.787 -176.739 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -91.99 -34.17 14.55 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.637 0.732 . . . . 0.0 109.516 179.169 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.406 ' HA2' ' HD3' ' A' ' 7' ' ' PRO . . . -96.18 132.07 10.9 Favored Glycine 0 N--CA 1.433 -1.556 0 N-CA-C 109.031 -1.627 . . . . 0.0 109.031 179.442 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.406 ' HD3' ' HA2' ' A' ' 6' ' ' GLY . 49.0 Cg_exo -54.73 -36.02 89.19 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.875 2.384 . . . . 0.0 114.359 -176.616 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -105.22 27.95 7.76 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.09 0.472 . . . . 0.0 110.381 178.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.535 ' HA3' ' HA ' ' A' ' 3' ' ' CYS . . . -60.72 -36.16 91.19 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.896 -179.524 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.2 m -84.79 28.32 0.69 Allowed 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 117.119 0.46 . . . . 0.0 112.096 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.5 t -72.76 -34.97 67.34 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.7 p -80.37 150.58 29.81 Favored 'General case' 0 C--O 1.259 1.565 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.174 178.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.759 ' HE2' ' HA ' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -58.61 -40.09 82.29 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.064 -179.914 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -57.74 -56.93 15.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 123.991 0.807 . . . . 0.0 109.965 177.706 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.501 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 78.6 m -61.57 -38.75 88.65 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -177.413 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -65.5 -23.16 66.82 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.481 -0.488 . . . . 0.0 111.396 -177.174 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -102.22 -49.33 3.93 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 120.971 0.415 . . . . 0.0 111.903 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -89.43 -24.88 21.77 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -168.056 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.445 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -70.83 136.04 48.47 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -70.55 -11.85 61.19 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -170.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.0 p -84.55 -18.67 34.93 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.186 0.517 . . . . 0.0 110.381 176.081 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.9 m . . . . . 0 N--CA 1.432 -1.333 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -177.541 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 35.3 m . . . . . 0 N--CA 1.439 -1.02 0 CA-C-O 121.753 0.787 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 50.0 m -104.71 17.06 24.83 Favored 'General case' 0 C--N 1.279 -2.496 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.089 -176.048 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -89.43 0.22 57.01 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.442 0.639 . . . . 0.0 110.495 -176.266 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 157.71 177.32 30.71 Favored Glycine 0 N--CA 1.433 -1.515 0 C-N-CA 120.512 -0.851 . . . . 0.0 111.624 178.084 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -52.82 -35.46 69.9 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.857 3.038 . . . . 0.0 113.313 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -89.03 17.92 5.37 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.088 0.47 . . . . 0.0 110.985 -177.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -91.79 -28.77 13.12 Favored Glycine 0 N--CA 1.414 -2.772 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 171.381 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 70.1 m -95.86 11.86 32.22 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 123.234 0.613 . . . . 0.0 111.67 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.4 p -74.46 -28.71 61.15 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 123.394 0.677 . . . . 0.0 111.348 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.5 p -88.11 141.26 28.71 Favored 'General case' 0 N--CA 1.424 -1.757 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.889 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -61.14 -35.18 76.37 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -54.38 -52.55 61.31 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.971 177.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 82.8 m -70.15 -34.96 73.68 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.695 177.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -61.61 -37.07 82.6 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.318 0.58 . . . . 0.0 109.739 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -78.09 -44.23 26.8 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.451 179.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -89.48 -34.49 16.41 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -170.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.487 ' HB1' ' SG ' ' A' ' 21' ' ' CYS . . . -92.84 122.77 35.56 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-O 121.417 0.627 . . . . 0.0 111.077 -175.292 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -82.42 -3.94 56.52 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.55 0.69 . . . . 0.0 110.312 -178.699 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.487 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 27.6 p -79.4 -9.28 59.56 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.46 -0.791 . . . . 0.0 108.954 173.227 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.7 m . . . . . 0 N--CA 1.434 -1.255 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.136 179.561 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.576 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 30.5 m . . . . . 0 N--CA 1.451 -0.386 0 CA-C-O 121.439 0.638 . . . . 0.0 112.365 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.649 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 81.4 m -84.61 -10.69 57.12 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.356 179.344 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -101.03 0.6 38.35 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -175.437 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.39 147.11 18.26 Favored Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -178.241 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -58.56 -41.59 63.05 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 123.392 2.728 . . . . 0.0 114.127 -177.094 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.426 ' HD3' ' HA ' ' A' ' 8' ' ' LYS . 73.3 mmtt -111.92 27.89 9.25 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.913 0.387 . . . . 0.0 110.25 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.576 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -58.2 -37.95 88.3 Favored Glycine 0 C--O 1.22 -0.725 0 CA-C-N 115.109 -0.95 . . . . 0.0 113.342 -178.384 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 82.6 m -80.05 -3.18 47.48 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.7 t -85.34 66.39 9.68 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-O 122.135 0.969 . . . . 0.0 108.712 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.0 t -174.33 138.94 0.58 Allowed 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.661 1.585 . . . . 0.0 106.842 -178.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -71.89 -34.96 69.58 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -178.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.8 t90 -60.7 -43.82 97.31 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.764 0.792 . . . . 0.0 109.216 178.069 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.2 m -71.62 -37.7 70.87 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.618 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.512 ' HA ' ' CB ' ' A' ' 22' ' ' CYS . 1.7 tmt_? -64.71 -36.89 85.73 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -68.68 -42.45 77.8 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.866 179.657 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 31.5 m170 -98.23 -44.03 6.74 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 -172.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.649 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -75.85 131.98 40.06 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.318 0.58 . . . . 0.0 111.521 -172.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -74.09 -12.26 60.55 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.225 -174.049 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 20.2 p -89.03 -10.48 47.35 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.572 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.512 ' CB ' ' HA ' ' A' ' 16' ' ' ARG . 59.8 m . . . . . 0 C--N 1.309 -1.156 0 CA-C-O 121.024 0.44 . . . . 0.0 110.931 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.494 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 57.1 m . . . . . 0 N--CA 1.437 -1.075 0 CA-C-O 121.927 0.87 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.466 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 73.5 m -97.05 24.84 5.88 Favored 'General case' 0 C--N 1.275 -2.651 0 CA-C-N 114.671 -1.149 . . . . 0.0 111.225 -177.413 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.4 p-10 -89.72 -11.2 42.99 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-O 121.195 0.521 . . . . 0.0 110.132 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 151.07 -164.1 29.95 Favored Glycine 0 N--CA 1.424 -2.163 0 C-N-CA 120.417 -0.897 . . . . 0.0 111.846 178.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -60.96 -15.3 37.93 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.97 3.114 . . . . 0.0 114.997 -175.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -89.1 -11.78 43.02 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.431 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -77.35 -50.32 6.78 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 119.982 -1.104 . . . . 0.0 111.775 -178.662 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -67.27 -2.65 6.27 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.2 m -71.12 -30.26 66.28 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-O 120.674 0.273 . . . . 0.0 110.86 178.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.4 t -83.98 137.09 33.8 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 176.168 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -60.91 -32.87 72.34 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.875 0.734 . . . . 0.0 109.675 178.065 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -61.94 -53.49 54.95 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.184 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.494 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.2 m -66.46 -39.31 88.75 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.598 178.613 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -60.28 -33.32 72.17 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 122.736 0.414 . . . . 0.0 111.252 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -86.91 -38.25 16.88 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.844 0.354 . . . . 0.0 111.729 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -92.71 -26.3 17.83 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -172.357 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.466 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -96.75 138.46 34.28 Favored 'General case' 0 C--N 1.295 -1.789 0 C-N-CA 120.426 -0.509 . . . . 0.0 110.731 -177.327 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -88.04 0.97 55.3 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-O 121.105 0.479 . . . . 0.0 111.532 -177.115 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.42 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 8.3 p -83.06 -13.24 56.18 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-O 121.73 0.776 . . . . 0.0 109.107 174.549 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 61.3 m . . . . . 0 N--CA 1.426 -1.673 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.879 179.678 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . 0.254 . . . . . . . 0 N--CA 1.433 -1.284 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 96.34 -52.37 1.58 Allowed Glycine 0 CA--C 1.499 -0.919 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -178.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.657 ' HA ' ' HA3' ' A' ' 9' ' ' GLY . 60.2 m -53.68 -41.68 67.13 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 121.99 0.9 . . . . 0.0 112.284 -179.123 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 63.7 m -108.46 16.18 23.26 Favored 'General case' 0 C--N 1.262 -3.202 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.706 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -117.18 -23.23 7.98 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.569 -178.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.59 163.75 13.56 Favored Glycine 0 N--CA 1.434 -1.494 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -70.75 -19.12 31.79 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.156 2.571 . . . . 0.0 114.493 -175.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -104.67 -4.42 22.48 Favored 'General case' 0 C--N 1.311 -1.086 0 O-C-N 122.013 -0.43 . . . . 0.0 111.852 -175.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.657 ' HA3' ' HA ' ' A' ' 3' ' ' CYS . . . -63.54 -52.77 43.59 Favored Glycine 0 C--O 1.219 -0.836 0 C-N-CA 121.116 -0.564 . . . . 0.0 112.995 -176.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -84.41 5.53 26.82 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.688 0.756 . . . . 0.0 110.688 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.1 t -91.75 -15.39 28.41 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 31.3 m -86.7 127.12 34.95 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -61.59 -33.94 74.76 Favored 'General case' 0 C--O 1.198 -1.616 0 CA-C-O 118.923 -0.56 . . . . 0.0 112.351 -174.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.6 t90 -57.37 -44.49 84.47 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.29 0.567 . . . . 0.0 110.262 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.478 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 68.1 m -70.23 -34.89 73.42 Favored 'General case' 0 C--O 1.207 -1.145 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.097 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -66.15 -39.4 89.8 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.802 0.334 . . . . 0.0 110.334 175.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -70.25 -52.14 25.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.299 0.571 . . . . 0.0 111.471 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -93.36 -38.19 11.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -170.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.13 124.69 34.06 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.365 0.602 . . . . 0.0 110.789 -174.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -69.44 -21.92 63.7 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.535 -177.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.2 p -77.46 -13.82 59.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.076 0.465 . . . . 0.0 111.685 178.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.8 m -92.97 90.63 7.03 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.258 0.551 . . . . 0.0 110.206 176.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.582 0 CA-C-N 116.418 -0.356 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . 0.253 . . . . . . . 0 N--CA 1.421 -1.922 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 101.75 -0.75 52.34 Favored Glycine 0 CA--C 1.5 -0.906 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 -178.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.402 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 34.2 m -90.69 -15.29 30.58 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 121.496 0.665 . . . . 0.0 111.264 -175.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 18.9 m -93.93 25.72 3.53 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.324 -176.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -88.13 -24.53 23.34 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.001 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.52 176.88 47.45 Favored Glycine 0 N--CA 1.435 -1.402 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.085 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -62.85 -21.87 73.43 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.676 2.918 . . . . 0.0 114.219 -177.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -89.15 -6.35 57.05 Favored 'General case' 0 C--O 1.24 0.567 0 O-C-N 121.927 -0.483 . . . . 0.0 110.158 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.402 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -70.43 -32.71 68.03 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.151 -1.58 . . . . 0.0 109.151 175.598 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.1 m -80.18 2.08 25.69 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.661 -0.769 . . . . 0.0 112.243 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.9 m -90.87 25.0 2.53 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.832 0.825 . . . . 0.0 109.79 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.513 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 12.4 m -127.52 131.7 50.04 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -64.4 -39.9 94.75 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.479 -175.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -54.19 -39.25 66.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.703 0.763 . . . . 0.0 110.296 177.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.513 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 55.9 m -74.24 -31.89 62.77 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.57 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -72.39 -37.0 68.82 Favored 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -75.74 -47.46 25.9 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.234 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -100.01 -30.73 11.82 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 114.714 1.376 . . . . 0.0 114.714 -168.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -89.94 131.73 35.69 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.823 -175.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -66.96 -31.09 71.43 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.097 -176.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.7 p -69.21 -23.79 63.94 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.056 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 15' ' ' CYS . 56.3 m -109.12 -76.73 0.61 Allowed 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.484 0 O-C-N 122.024 -0.423 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PCA . . . . . 0.42 ' HA ' ' HB2' ' A' ' 5' ' ' ASN . . . . . . . . 0 N--CA 1.416 -2.126 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.13 -89.42 1.03 Allowed Glycine 0 N--CA 1.427 -1.932 0 N-CA-C 110.1 -1.2 . . . . 0.0 110.1 -177.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.3 m -93.25 -38.43 11.53 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-O 122.105 0.955 . . . . 0.0 110.223 -178.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 45.5 m -88.09 8.78 25.12 Favored 'General case' 0 C--N 1.275 -2.64 0 CA-C-N 114.96 -1.018 . . . . 0.0 113.739 -172.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.42 ' HB2' ' HA ' ' A' ' 1' ' ' PCA . 10.4 t30 -111.25 42.36 1.67 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 122.48 1.133 . . . . 0.0 108.368 179.045 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 170.86 144.12 4.24 Favored Glycine 0 N--CA 1.424 -2.102 0 CA-C-N 114.5 -1.227 . . . . 0.0 110.146 177.159 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_exo -62.38 -28.06 78.06 Favored 'Trans proline' 0 C--O 1.214 -0.709 0 C-N-CA 122.619 2.213 . . . . 0.0 112.109 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -103.86 11.27 35.86 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 121.115 0.483 . . . . 0.0 109.804 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.28 -32.22 52.56 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 177.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.4 m -91.61 29.09 1.58 Allowed 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 122.799 0.44 . . . . 0.0 111.408 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.5 p -62.5 -45.79 91.4 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 123.799 0.839 . . . . 0.0 110.969 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.0 m -67.49 137.59 55.93 Favored 'General case' 0 C--O 1.253 1.261 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.055 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.402 ' HD3' ' O ' ' A' ' 13' ' ' LYS . 12.6 tmtt? -59.39 -33.86 71.72 Favored 'General case' 0 C--O 1.208 -1.083 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 175.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -51.14 -50.29 59.17 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.6 m -65.32 -45.85 82.67 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.541 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -64.75 -28.12 69.36 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.057 0.456 . . . . 0.0 111.31 -178.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -88.34 -47.49 8.35 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.917 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 30.0 m80 -93.71 -23.22 18.3 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -172.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -95.79 120.87 36.82 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 121.713 0.768 . . . . 0.0 109.976 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -74.87 -22.48 58.64 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.995 -175.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 p -83.96 3.23 35.07 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 114.775 -1.102 . . . . 0.0 111.885 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 95.4 m -98.83 92.89 5.77 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 176.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.327 0 CA-C-N 116.628 -0.26 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.417 -2.102 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -74.71 -22.42 77.13 Favored Glycine 0 C--N 1.311 -0.822 0 C-N-CA 121.56 -0.352 . . . . 0.0 112.82 -175.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.482 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 64.6 m -90.44 1.92 56.17 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.485 0.659 . . . . 0.0 111.241 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.6 m -114.48 41.28 2.35 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.057 0.932 . . . . 0.0 110.157 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -93.59 12.05 26.64 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.279 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 159.6 164.99 15.67 Favored Glycine 0 N--CA 1.432 -1.584 0 N-CA-C 110.044 -1.223 . . . . 0.0 110.044 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -59.54 -18.38 46.65 Favored 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.472 2.782 . . . . 0.0 115.287 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -104.12 13.72 31.87 Favored 'General case' 0 C--O 1.241 0.61 0 O-C-N 121.386 -0.821 . . . . 0.0 111.731 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.13 -39.53 52.87 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.298 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.422 ' HA ' ' HB3' ' A' ' 15' ' ' CYS . 74.0 m -97.21 34.04 1.84 Allowed 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.126 0.488 . . . . 0.0 111.373 -178.457 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.4 p -72.82 -36.9 67.62 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.6 0.714 . . . . 0.0 109.239 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -69.89 144.7 52.39 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.657 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -57.54 -44.67 85.33 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 123.991 0.916 . . . . 0.0 112.592 -176.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.0 t90 -62.96 -49.95 72.7 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.482 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 68.6 m -57.03 -41.07 77.95 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -60.97 -37.95 84.22 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.774 0.321 . . . . 0.0 111.019 178.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.24 -51.36 11.05 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 177.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 72.1 m-70 -88.88 -17.69 29.13 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 115.05 1.5 . . . . 0.0 115.05 -165.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.94 114.78 23.11 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 44.2 mtm180 -67.73 -24.44 65.37 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.348 0.594 . . . . 0.0 110.131 -176.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -71.39 -12.5 61.45 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.591 176.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.0 m -118.62 -94.26 0.5 Allowed 'General case' 0 N--CA 1.433 -1.325 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 176.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.381 0 O-C-N 121.86 -0.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.42 -1.93 0 CA-C-O 120.959 0.409 . . . . 0.0 110.536 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 102.79 -103.0 2.34 Favored Glycine 0 N--CA 1.419 -2.436 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.44 178.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.457 ' HB2' ' HB3' ' A' ' 15' ' ' CYS . 97.0 m -90.28 49.84 1.76 Allowed 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -173.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 61.0 m -117.2 11.96 14.27 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 122.53 1.157 . . . . 0.0 108.603 171.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -144.57 150.12 36.96 Favored 'General case' 0 N--CA 1.425 -1.691 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 136.02 -164.43 25.01 Favored Glycine 0 C--N 1.292 -1.881 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.34 -42.02 45.17 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.138 2.559 . . . . 0.0 113.46 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -134.45 17.49 3.66 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 120.558 0.218 . . . . 0.0 111.094 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.31 -83.6 0.75 Allowed Glycine 0 N--CA 1.433 -1.526 0 N-CA-C 109.19 -1.564 . . . . 0.0 109.19 -174.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.8 m -101.3 64.12 1.01 Allowed 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.357 0.598 . . . . 0.0 109.515 177.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.2 t -78.04 -32.58 51.02 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -71.26 131.46 43.51 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -54.94 -46.68 74.99 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.256 1.022 . . . . 0.0 112.601 -173.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 91.3 t90 -55.71 -44.21 77.21 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.576 0.703 . . . . 0.0 110.664 178.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.457 ' HB3' ' HB2' ' A' ' 3' ' ' CYS . 60.7 m -67.26 -32.05 72.81 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.707 -176.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -64.71 -32.32 73.94 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -97.09 -20.52 17.95 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 53.3 m80 -114.9 -18.32 11.32 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 -170.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.13 158.74 31.43 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 118.727 0.694 . . . . 0.0 111.31 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -84.18 -37.95 21.24 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.4 p -69.78 -13.72 62.42 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.899 -1.046 . . . . 0.0 113.249 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 63.2 m -120.84 99.55 6.58 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.308 -1.226 0 CA-C-N 116.379 -0.373 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . 0.252 . . . . . . . 0 N--CA 1.432 -1.372 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -75.76 81.02 1.02 Allowed Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.778 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 75.1 m -76.35 -24.91 54.24 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 123.595 0.758 . . . . 0.0 112.533 -177.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 66.6 m -83.69 70.67 10.36 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-O 121.557 0.694 . . . . 0.0 111.037 -176.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 32.5 p-10 -149.28 13.19 0.85 Allowed 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.281 176.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -160.25 163.07 33.69 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.73 -15.63 37.3 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.38 2.72 . . . . 0.0 114.173 -176.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -102.62 1.9 35.32 Favored 'General case' 0 C--N 1.307 -1.253 0 O-C-N 122.088 -0.383 . . . . 0.0 110.225 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.46 -59.95 9.33 Favored Glycine 0 C--O 1.218 -0.897 0 O-C-N 123.717 0.635 . . . . 0.0 113.32 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.9 m -82.49 -3.14 55.32 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.528 0.68 . . . . 0.0 111.146 -177.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.8 m -87.45 -16.01 36.06 Favored 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.315 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.9 m -79.1 134.26 36.74 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.673 ' HE2' ' HA ' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -51.7 -55.28 20.47 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.914 0.886 . . . . 0.0 112.897 -175.093 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.8 t90 -62.0 -49.22 76.92 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -177.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.0 m -61.92 -35.2 77.67 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.47 -175.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -58.54 -38.95 78.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.86 0.362 . . . . 0.0 111.383 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -103.3 -27.15 12.64 Favored 'General case' 0 C--N 1.31 -1.124 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -175.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -102.9 -7.5 21.47 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -172.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.24 119.79 39.94 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 107.216 -1.401 . . . . 0.0 107.216 173.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -66.23 -19.69 65.9 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.982 -173.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 3.4 p -77.61 -4.06 44.02 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.958 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.7 m -105.05 85.75 2.33 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 121.403 0.621 . . . . 0.0 110.381 177.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.946 0 CA-C-N 116.148 -0.478 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.42 -1.963 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.56 -42.44 88.38 Favored Glycine 0 C--O 1.228 -0.256 0 N-CA-C 111.399 -0.68 . . . . 0.0 111.399 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 19' ' ' ALA . 70.6 m -90.52 19.85 5.0 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-O 121.04 0.447 . . . . 0.0 110.382 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.416 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 71.2 m -116.19 11.23 15.12 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.847 0.832 . . . . 0.0 109.658 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -101.06 116.7 33.45 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.436 -177.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 114.9 168.92 15.9 Favored Glycine 0 C--N 1.303 -1.302 0 C-N-CA 121.185 -0.531 . . . . 0.0 112.349 173.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -66.02 -18.03 56.25 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 123.283 2.655 . . . . 0.0 112.424 179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.545 ' HB3' ' HB3' ' A' ' 11' ' ' SER . 10.0 mtmp? -88.88 -60.26 2.01 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.69 -98.69 1.07 Allowed Glycine 0 N--CA 1.424 -2.124 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 79.6 m -90.56 77.25 6.47 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 121.977 0.894 . . . . 0.0 109.47 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.545 ' HB3' ' HB3' ' A' ' 8' ' ' LYS . 4.1 p -94.67 -27.1 16.04 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 114.253 -1.34 . . . . 0.0 109.002 175.531 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 t -90.06 134.67 34.11 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 174.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -63.79 -37.4 87.24 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 123.642 0.588 . . . . 0.0 111.551 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.5 t90 -59.07 -41.25 87.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.392 0.615 . . . . 0.0 109.753 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.2 m -65.44 -29.41 70.09 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.718 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -71.38 -19.71 62.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.275 0.559 . . . . 0.0 110.876 -176.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -100.61 -13.26 18.65 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -120.6 -22.92 6.2 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.679 1.362 . . . . 0.0 114.679 -171.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.503 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . . . -77.71 140.86 39.57 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -66.38 -17.31 64.7 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -176.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.3 p -87.45 -3.66 59.01 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 122.906 0.482 . . . . 0.0 111.101 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 70.9 m -133.61 95.01 3.39 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.39 0.614 . . . . 0.0 110.075 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.297 -1.696 0 CA-C-N 116.256 -0.429 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.418 -2.056 0 CA-C-O 121.002 0.43 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 126.15 82.07 0.43 Allowed Glycine 0 N--CA 1.425 -2.092 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.712 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 71.3 m -81.58 -28.75 33.67 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 122.173 0.987 . . . . 0.0 109.733 -178.41 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 73.1 m -84.51 73.14 10.57 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.022 175.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -120.42 2.44 10.76 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 114.16 -1.382 . . . . 0.0 108.96 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.49 -163.12 33.84 Favored Glycine 0 N--CA 1.421 -2.326 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.007 -177.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -86.62 4.9 6.12 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.286 2.657 . . . . 0.0 115.565 -174.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -123.99 5.96 8.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.542 0.61 . . . . 0.0 110.216 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.712 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -79.97 -33.52 32.98 Favored Glycine 0 C--O 1.214 -1.096 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.705 -175.087 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 67.0 m -92.6 21.92 5.08 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.328 0.585 . . . . 0.0 110.937 -178.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.6 t -76.1 -48.7 19.72 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -178.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.7 m -59.29 137.78 57.86 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.188 176.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -50.72 -48.01 58.98 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.155 0.982 . . . . 0.0 110.864 -178.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.7 t90 -56.43 -40.91 75.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.557 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.9 m -70.85 -32.44 69.46 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.526 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.1 ttt85 -72.85 -18.93 61.39 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 121.215 0.531 . . . . 0.0 110.877 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -98.99 -45.27 6.01 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.587 0.708 . . . . 0.0 111.144 176.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -89.88 -23.51 21.62 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -168.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.84 126.68 30.96 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 177.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 20' ' ' ARG . 52.5 mtp180 -72.47 -16.18 61.8 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.509 0.671 . . . . 0.0 110.948 -174.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -94.82 0.12 54.59 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 114.755 -1.112 . . . . 0.0 111.314 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 84.4 m -141.14 -86.06 0.18 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.296 -1.741 0 O-C-N 121.747 -0.595 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PCA . . . . . 0.708 ' HB2' ' HB2' ' A' ' 19' ' ' ALA . . . . . . . . 0 N--CA 1.416 -2.132 0 CA-C-O 120.791 0.329 . . . . 0.0 110.128 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -94.45 67.87 1.36 Allowed Glycine 0 N--CA 1.434 -1.446 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 89.9 m -128.82 1.25 5.4 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 58.5 m -113.28 17.18 18.77 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.18 0.99 . . . . 0.0 108.751 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -89.81 -22.11 22.27 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.59 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.69 154.79 26.05 Favored Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.72 -28.94 82.72 Favored 'Trans proline' 0 C--O 1.244 0.812 0 C-N-CA 123.224 2.616 . . . . 0.0 113.597 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -90.27 -1.72 57.95 Favored 'General case' 0 N--CA 1.438 -1.039 0 O-C-N 121.866 -0.521 . . . . 0.0 111.345 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.05 -42.04 78.79 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.3 m -72.26 12.73 0.4 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.6 m -82.69 -22.53 34.5 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 m -72.81 123.08 22.65 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -62.59 -33.78 75.67 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.243 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -60.4 -36.71 78.76 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.758 0.79 . . . . 0.0 109.435 178.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 91.7 m -80.11 -11.86 59.72 Favored 'General case' 0 C--O 1.2 -1.528 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.262 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -77.71 -32.98 53.25 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.017 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -90.9 -34.48 15.21 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.26 178.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 74.7 m80 -93.12 -38.81 11.39 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -175.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.708 ' HB2' ' HB2' ' A' ' 1' ' ' PCA . . . -91.76 107.08 18.96 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.43 ' HA ' ' HD3' ' A' ' 20' ' ' ARG . 23.4 mmt180 -78.45 3.72 15.11 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.852 0.834 . . . . 0.0 111.905 -176.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 p -89.63 -9.32 50.08 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.261 171.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 80.6 m -99.66 88.82 3.93 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-O 121.172 0.51 . . . . 0.0 110.119 176.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.379 0 O-C-N 122.159 -0.338 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.419 -1.988 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.59 -46.98 44.25 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.991 -0.624 . . . . 0.0 112.732 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.57 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 55.7 m -93.66 -51.96 4.68 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 122.156 0.979 . . . . 0.0 110.361 -177.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 58.9 m -90.44 72.2 6.98 Favored 'General case' 0 C--N 1.268 -2.964 0 CA-C-N 114.92 -1.036 . . . . 0.0 112.63 -173.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -147.54 12.51 1.03 Allowed 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 122.274 1.035 . . . . 0.0 108.234 173.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.44 164.79 35.81 Favored Glycine 0 N--CA 1.434 -1.478 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 -178.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -69.79 -20.51 34.6 Favored 'Trans proline' 0 C--O 1.223 -0.246 0 C-N-CA 122.944 2.429 . . . . 0.0 113.855 -176.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -112.62 33.98 4.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.977 0.418 . . . . 0.0 111.158 -177.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.57 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -92.75 -7.41 62.97 Favored Glycine 0 N--CA 1.438 -1.185 0 C-N-CA 120.447 -0.883 . . . . 0.0 113.745 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.5 m -115.71 24.84 11.21 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 117.651 0.725 . . . . 0.0 111.588 -176.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 p -84.13 -14.72 49.54 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.866 -177.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.1 p -98.24 153.41 18.51 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 121.025 0.44 . . . . 0.0 111.444 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -62.4 -40.14 95.55 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.242 177.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 71.4 t90 -59.49 -50.95 71.93 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.635 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.402 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 81.5 m -68.58 -37.9 80.23 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.197 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -64.3 -39.64 94.33 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.955 0.407 . . . . 0.0 111.433 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.15 -47.99 12.72 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -176.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -93.44 -12.14 30.48 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -168.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.421 ' HB1' ' SG ' ' A' ' 21' ' ' CYS . . . -111.0 124.19 51.67 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 176.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -76.83 -20.36 56.45 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.86 0.362 . . . . 0.0 110.977 -177.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.421 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 5.9 p -66.79 -20.75 66.01 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.999 173.126 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.4 m -97.85 -82.48 0.42 Allowed 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.147 0 O-C-N 122.039 -0.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . 0.282 . . . . . . . 0 N--CA 1.426 -1.64 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -103.61 69.38 0.29 Allowed Glycine 0 N--CA 1.429 -1.809 0 CA-C-N 115.969 -0.56 . . . . 0.0 113.224 -174.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 62.1 m -105.36 -13.8 15.54 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.595 0.712 . . . . 0.0 110.212 176.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 38.9 m -93.95 -18.84 21.49 Favored 'General case' 0 C--N 1.292 -1.907 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.439 -177.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -97.22 79.75 2.85 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 122.623 1.202 . . . . 0.0 111.405 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 149.52 145.23 4.09 Favored Glycine 0 N--CA 1.432 -1.624 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.843 176.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -59.97 -35.63 92.61 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.035 2.49 . . . . 0.0 111.968 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -96.97 17.88 15.93 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.358 -178.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -67.15 -32.12 79.4 Favored Glycine 0 N--CA 1.433 -1.563 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 50.7 m -93.96 15.67 16.27 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 122.846 0.458 . . . . 0.0 111.897 -176.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.5 m -66.14 -44.59 83.76 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.735 0.302 . . . . 0.0 111.05 -177.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.1 m -74.66 134.38 42.01 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.7 -32.78 70.84 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 123.008 0.193 . . . . 0.0 110.86 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -55.13 -49.64 71.28 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 176.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 98.9 m -64.57 -43.2 94.66 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.259 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -65.65 -41.01 93.07 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 120.984 0.421 . . . . 0.0 111.81 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -78.58 -46.19 19.94 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.104 -176.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -92.03 -24.76 19.09 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -170.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 15' ' ' CYS . . . -95.88 113.61 25.25 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 175.128 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -77.35 4.15 11.48 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 124.469 1.108 . . . . 0.0 111.931 -172.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.9 p -83.49 -20.13 34.52 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 173.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.8 m -93.73 -78.62 0.43 Allowed 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.504 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.942 0 O-C-N 122.098 -0.376 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.413 -2.3 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 83.58 -59.99 4.91 Favored Glycine 0 C--N 1.304 -1.195 0 CA-C-N 116.023 -0.535 . . . . 0.0 113.455 176.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 70.2 m -126.83 17.97 7.32 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -174.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.53 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 70.8 m -106.02 24.8 11.81 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 122.548 1.166 . . . . 0.0 108.689 -177.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.3 p-10 -88.89 -15.26 34.85 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.756 -1.565 . . . . 0.0 109.716 -178.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -169.03 165.83 39.23 Favored Glycine 0 N--CA 1.431 -1.635 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -62.93 -27.21 74.47 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 123.163 2.575 . . . . 0.0 112.991 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.453 ' HA ' ' HB2' ' A' ' 11' ' ' SER . 53.2 mtpt -89.44 -11.94 41.63 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.732 -179.041 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.92 -46.29 91.92 Favored Glycine 0 CA--C 1.499 -0.918 0 N-CA-C 107.814 -2.115 . . . . 0.0 107.814 172.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.2 m -79.33 0.33 29.39 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.649 -0.776 . . . . 0.0 112.425 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.453 ' HB2' ' HA ' ' A' ' 8' ' ' LYS . 22.1 t -76.64 -33.08 58.35 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.177 0.513 . . . . 0.0 109.851 -178.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.6 m -75.28 130.32 38.89 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.256 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -50.64 -45.64 57.88 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.37 1.068 . . . . 0.0 112.245 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.0 t90 -53.22 -46.65 69.17 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.603 0.716 . . . . 0.0 110.174 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 91.0 m -69.47 -43.76 72.58 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.962 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -61.77 -31.88 72.12 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.591 0.71 . . . . 0.0 110.461 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.01 -41.32 51.39 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.834 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -94.03 -37.07 11.83 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -174.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.53 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -86.81 113.75 22.89 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -88.07 -3.63 58.87 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.802 -174.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.4 p -88.58 5.8 41.12 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.575 175.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 84.3 m -92.29 -84.06 0.28 Allowed 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.808 176.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.572 0 O-C-N 122.268 -0.27 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.415 -2.184 0 CA-C-O 121.159 0.504 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -126.52 116.15 2.45 Favored Glycine 0 N--CA 1.421 -2.312 0 N-CA-C 107.479 -2.248 . . . . 0.0 107.479 176.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 22.3 m -98.45 -44.67 6.41 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-O 122.156 0.979 . . . . 0.0 111.02 -174.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.6 m -92.78 25.21 3.23 Favored 'General case' 0 C--N 1.273 -2.742 0 CA-C-N 114.583 -1.189 . . . . 0.0 112.004 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 35.7 p30 -89.32 -11.61 42.89 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 153.88 -174.03 32.45 Favored Glycine 0 N--CA 1.425 -2.035 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.96 -23.37 72.58 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.523 2.815 . . . . 0.0 113.288 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -89.04 -5.4 57.92 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 122.138 -0.351 . . . . 0.0 111.169 -177.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -82.27 -25.0 53.07 Favored Glycine 0 N--CA 1.435 -1.388 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.119 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.3 m -86.77 20.6 2.5 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 123.535 0.734 . . . . 0.0 111.062 -178.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.6 p -69.86 -33.14 71.86 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.643 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.1 p -83.97 159.94 21.14 Favored 'General case' 0 C--O 1.253 1.283 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.044 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -72.51 -34.62 67.76 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.1 t90 -55.37 -55.22 34.09 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.262 179.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.1 m -65.42 -41.52 93.46 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.912 179.451 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -65.33 -28.08 69.05 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.777 0.322 . . . . 0.0 111.724 -177.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -91.89 -44.82 8.7 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 120.872 0.368 . . . . 0.0 111.677 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -92.48 -19.33 22.11 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -171.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.516 ' HB1' ' SG ' ' A' ' 21' ' ' CYS . . . -99.53 139.22 35.51 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-O 121.321 0.582 . . . . 0.0 109.934 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -90.64 -4.49 56.76 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 121.857 0.837 . . . . 0.0 110.105 -175.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.516 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 9.2 p -86.52 3.82 42.51 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.571 177.004 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.1 m -115.03 98.55 6.87 Favored 'General case' 0 N--CA 1.421 -1.894 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.472 0 CA-C-N 116.595 -0.275 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.417 -2.117 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -68.35 -11.97 62.73 Favored Glycine 0 CA--C 1.509 -0.306 0 O-C-N 123.134 0.271 . . . . 0.0 113.086 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.526 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 30.6 m -65.2 -26.59 68.2 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 121.427 0.632 . . . . 0.0 111.877 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.4 m -95.93 9.3 41.09 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-O 121.535 0.683 . . . . 0.0 110.939 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -108.13 15.9 23.8 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.818 0.818 . . . . 0.0 108.926 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -145.48 148.5 20.27 Favored Glycine 0 N--CA 1.429 -1.769 0 CA-C-O 118.755 -1.025 . . . . 0.0 110.542 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -52.04 -41.89 61.84 Favored 'Trans proline' 0 C--O 1.245 0.843 0 C-N-CA 123.162 2.575 . . . . 0.0 112.298 177.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.7 mttp -122.66 74.57 1.2 Allowed 'General case' 0 N--CA 1.433 -1.307 0 CA-C-O 121.469 0.652 . . . . 0.0 110.81 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.526 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -102.35 -52.37 1.0 Allowed Glycine 0 N--CA 1.432 -1.572 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 173.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.535 ' HA ' ' HB2' ' A' ' 15' ' ' CYS . 75.9 m -81.92 15.35 2.3 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.194 0.521 . . . . 0.0 111.903 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.1 p -71.99 -27.86 63.03 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-O 121.926 0.869 . . . . 0.0 109.068 175.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.6 t -86.52 138.59 31.6 Favored 'General case' 0 N--CA 1.418 -2.025 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -59.55 -24.22 63.53 Favored 'General case' 0 C--N 1.315 -0.923 0 O-C-N 123.621 0.576 . . . . 0.0 111.675 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -64.39 -54.31 34.78 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.535 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 97.5 m -68.9 -36.89 78.57 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.032 178.396 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.9 ttt180 -60.18 -33.02 71.63 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 120.83 0.348 . . . . 0.0 110.541 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -92.1 -49.73 6.05 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.654 -0.418 . . . . 0.0 112.071 179.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -89.95 -11.51 41.5 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -167.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.45 142.33 35.98 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 119.286 -0.965 . . . . 0.0 108.54 176.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -84.45 -21.82 30.56 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 -177.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.6 p -81.86 -16.85 49.37 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.258 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.1 m -116.37 -79.53 0.59 Allowed 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 176.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.14 0 O-C-N 122.255 -0.278 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.417 -2.121 0 N-CA-C 110.129 -0.322 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 89.62 -72.65 2.11 Favored Glycine 0 N--CA 1.433 -1.536 0 CA-C-N 115.929 -0.578 . . . . 0.0 113.286 174.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.455 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 58.3 m -98.12 -1.87 41.31 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-O 121.367 0.604 . . . . 0.0 111.667 -173.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.5 m -95.65 13.05 27.6 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-O 121.156 0.503 . . . . 0.0 112.238 -170.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -90.05 -11.34 41.74 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.959 0.409 . . . . 0.0 111.505 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -154.33 162.66 30.74 Favored Glycine 0 N--CA 1.433 -1.554 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.332 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -69.22 -13.21 35.63 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.966 2.444 . . . . 0.0 113.192 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -87.23 -28.3 22.45 Favored 'General case' 0 C--O 1.244 0.815 0 O-C-N 121.876 -0.515 . . . . 0.0 109.841 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -61.37 -51.96 54.6 Favored Glycine 0 N--CA 1.432 -1.588 0 N-CA-C 110.009 -1.236 . . . . 0.0 110.009 175.808 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.3 m -75.38 -9.95 59.02 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.3 t -80.95 -19.75 43.49 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 m -76.5 126.66 31.37 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 176.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -56.74 -37.82 71.54 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -174.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 91.1 t90 -62.27 -43.73 98.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.451 0.643 . . . . 0.0 109.326 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 62.2 m -73.99 -38.08 64.23 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.035 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -60.56 -36.21 77.93 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.132 0.492 . . . . 0.0 110.573 176.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -81.14 -52.67 7.12 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.273 -178.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -94.54 -32.4 13.48 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -169.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.32 120.92 23.02 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.5 mmm180 -78.84 -9.5 59.49 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.118 -170.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.6 p -97.87 3.99 49.69 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 121.764 0.792 . . . . 0.0 110.203 174.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 86.9 m -111.9 -76.69 0.59 Allowed 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.634 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.28 0 O-C-N 121.991 -0.443 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.42 -1.933 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 82.11 -55.38 4.93 Favored Glycine 0 C--N 1.306 -1.091 0 N-CA-C 114.431 0.532 . . . . 0.0 114.431 175.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 78.5 m -51.7 -42.67 62.38 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -173.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 46.8 m -98.54 4.56 48.2 Favored 'General case' 0 C--N 1.271 -2.837 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.664 -175.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -102.58 13.95 33.2 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 121.347 0.594 . . . . 0.0 110.671 -179.159 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.403 ' HA2' ' HD3' ' A' ' 7' ' ' PRO . . . -164.76 147.06 12.0 Favored Glycine 0 N--CA 1.426 -1.972 0 C-N-CA 120.144 -1.026 . . . . 0.0 111.44 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.403 ' HD3' ' HA2' ' A' ' 6' ' ' GLY . 33.3 Cg_exo -60.69 -27.95 85.69 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.219 2.612 . . . . 0.0 113.104 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -88.71 -1.89 58.31 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 122.104 -0.373 . . . . 0.0 110.195 -178.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -70.07 -69.18 1.44 Allowed Glycine 0 N--CA 1.439 -1.142 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.263 -178.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.5 m -80.84 10.74 4.59 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.4 t -69.86 -38.8 76.55 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 171.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 m -68.28 130.39 42.77 Favored 'General case' 0 N--CA 1.426 -1.669 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -60.62 -31.03 70.23 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 123.07 0.548 . . . . 0.0 111.22 -175.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -61.81 -48.4 80.75 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 176.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 54.2 m -70.27 -23.69 62.93 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 116.116 -0.493 . . . . 0.0 112.303 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -70.49 -42.77 70.94 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 120.019 -0.672 . . . . 0.0 110.432 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -87.81 -43.72 11.64 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -89.03 5.06 46.1 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -168.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -116.47 114.71 24.59 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 173.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -64.78 -22.51 67.0 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.71 -173.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.2 p -74.88 -13.52 60.56 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 82.9 m -109.05 87.65 2.54 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.28 0.562 . . . . 0.0 110.546 176.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.313 -1.007 0 CA-C-N 116.303 -0.408 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.604 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -90.75 53.21 3.34 Favored Glycine 0 C--O 1.241 0.533 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HA ' ' HA3' ' A' ' 9' ' ' GLY . 2.6 m -73.9 -14.41 61.06 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 123.66 0.784 . . . . 0.0 112.472 -171.147 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.445 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 60.6 m -105.86 -11.85 16.07 Favored 'General case' 0 C--N 1.285 -2.216 0 CA-C-O 121.468 0.651 . . . . 0.0 110.787 -176.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -91.99 -34.17 14.55 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.637 0.732 . . . . 0.0 109.516 179.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.406 ' HA2' ' HD3' ' A' ' 7' ' ' PRO . . . -96.18 132.07 10.9 Favored Glycine 0 N--CA 1.433 -1.556 0 N-CA-C 109.031 -1.627 . . . . 0.0 109.031 179.442 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.406 ' HD3' ' HA2' ' A' ' 6' ' ' GLY . 49.0 Cg_exo -54.73 -36.02 89.19 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.875 2.384 . . . . 0.0 114.359 -176.616 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -105.22 27.95 7.76 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.09 0.472 . . . . 0.0 110.381 178.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.535 ' HA3' ' HA ' ' A' ' 3' ' ' CYS . . . -60.72 -36.16 91.19 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.896 -179.524 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.2 m -84.79 28.32 0.69 Allowed 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 117.119 0.46 . . . . 0.0 112.096 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.5 t -72.76 -34.97 67.34 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.7 p -80.37 150.58 29.81 Favored 'General case' 0 C--O 1.259 1.565 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.174 178.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.759 ' HE2' ' HA ' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -58.61 -40.09 82.29 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.064 -179.914 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -57.74 -56.93 15.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 123.991 0.807 . . . . 0.0 109.965 177.706 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.501 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 78.6 m -61.57 -38.75 88.65 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -177.413 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -65.5 -23.16 66.82 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.481 -0.488 . . . . 0.0 111.396 -177.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -102.22 -49.33 3.93 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 120.971 0.415 . . . . 0.0 111.903 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -89.43 -24.88 21.77 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -168.056 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.445 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -70.83 136.04 48.47 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -70.55 -11.85 61.19 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -170.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.0 p -84.55 -18.67 34.93 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.186 0.517 . . . . 0.0 110.381 176.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.9 m -124.73 -81.97 0.64 Allowed 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -177.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.473 0 O-C-N 121.971 -0.456 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.424 -1.725 0 CA-C-O 121.01 0.433 . . . . 0.0 110.439 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -82.24 55.1 4.93 Favored Glycine 0 C--O 1.237 0.338 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 176.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 35.3 m -78.33 -21.93 48.84 Favored 'General case' 0 C--N 1.299 -1.629 0 C-N-CA 123.815 0.846 . . . . 0.0 111.065 -174.479 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 50.0 m -104.71 17.06 24.83 Favored 'General case' 0 C--N 1.279 -2.496 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.089 -176.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -89.43 0.22 57.01 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.442 0.639 . . . . 0.0 110.495 -176.266 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 157.71 177.32 30.71 Favored Glycine 0 N--CA 1.433 -1.515 0 C-N-CA 120.512 -0.851 . . . . 0.0 111.624 178.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -52.82 -35.46 69.9 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.857 3.038 . . . . 0.0 113.313 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -89.03 17.92 5.37 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.088 0.47 . . . . 0.0 110.985 -177.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -91.79 -28.77 13.12 Favored Glycine 0 N--CA 1.414 -2.772 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 171.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 70.1 m -95.86 11.86 32.22 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 123.234 0.613 . . . . 0.0 111.67 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.4 p -74.46 -28.71 61.15 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 123.394 0.677 . . . . 0.0 111.348 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.5 p -88.11 141.26 28.71 Favored 'General case' 0 N--CA 1.424 -1.757 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.889 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -61.14 -35.18 76.37 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -54.38 -52.55 61.31 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.971 177.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 82.8 m -70.15 -34.96 73.68 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.695 177.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -61.61 -37.07 82.6 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.318 0.58 . . . . 0.0 109.739 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -78.09 -44.23 26.8 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.451 179.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -89.48 -34.49 16.41 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -170.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.487 ' HB1' ' SG ' ' A' ' 21' ' ' CYS . . . -92.84 122.77 35.56 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-O 121.417 0.627 . . . . 0.0 111.077 -175.292 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -82.42 -3.94 56.52 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.55 0.69 . . . . 0.0 110.312 -178.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.487 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 27.6 p -79.4 -9.28 59.56 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.46 -0.791 . . . . 0.0 108.954 173.227 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.7 m -104.4 90.74 3.64 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.136 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.377 0 CA-C-N 116.554 -0.294 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -1.708 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 112.55 -14.35 24.98 Favored Glycine 0 N--CA 1.446 -0.688 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.656 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.576 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 30.5 m -75.99 -17.36 59.73 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 121.439 0.638 . . . . 0.0 112.365 -174.067 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.649 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 81.4 m -84.61 -10.69 57.12 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.356 179.344 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -101.03 0.6 38.35 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -175.437 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.39 147.11 18.26 Favored Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -178.241 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -58.56 -41.59 63.05 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 123.392 2.728 . . . . 0.0 114.127 -177.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.426 ' HD3' ' HA ' ' A' ' 8' ' ' LYS . 73.3 mmtt -111.92 27.89 9.25 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.913 0.387 . . . . 0.0 110.25 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.576 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -58.2 -37.95 88.3 Favored Glycine 0 C--O 1.22 -0.725 0 CA-C-N 115.109 -0.95 . . . . 0.0 113.342 -178.384 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 82.6 m -80.05 -3.18 47.48 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.7 t -85.34 66.39 9.68 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-O 122.135 0.969 . . . . 0.0 108.712 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.0 t -174.33 138.94 0.58 Allowed 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.661 1.585 . . . . 0.0 106.842 -178.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -71.89 -34.96 69.58 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -178.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.8 t90 -60.7 -43.82 97.31 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.764 0.792 . . . . 0.0 109.216 178.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.2 m -71.62 -37.7 70.87 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.618 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.512 ' HA ' ' CB ' ' A' ' 22' ' ' CYS . 1.7 tmt_? -64.71 -36.89 85.73 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -68.68 -42.45 77.8 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.866 179.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 31.5 m170 -98.23 -44.03 6.74 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 -172.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.649 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -75.85 131.98 40.06 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.318 0.58 . . . . 0.0 111.521 -172.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -74.09 -12.26 60.55 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.225 -174.049 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 20.2 p -89.03 -10.48 47.35 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.572 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.512 ' CB ' ' HA ' ' A' ' 16' ' ' ARG . 59.8 m -98.33 91.89 5.43 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.024 0.44 . . . . 0.0 110.931 -175.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.326 0 O-C-N 122.279 -0.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -1.796 0 CA-C-O 120.931 0.396 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -123.69 68.42 0.48 Allowed Glycine 0 N--CA 1.429 -1.811 0 N-CA-C 109.214 -1.555 . . . . 0.0 109.214 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.494 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 57.1 m -101.12 -45.13 5.48 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 121.927 0.87 . . . . 0.0 110.11 -177.766 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.466 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 73.5 m -97.05 24.84 5.88 Favored 'General case' 0 C--N 1.275 -2.651 0 CA-C-N 114.671 -1.149 . . . . 0.0 111.225 -177.413 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.4 p-10 -89.72 -11.2 42.99 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-O 121.195 0.521 . . . . 0.0 110.132 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 151.07 -164.1 29.95 Favored Glycine 0 N--CA 1.424 -2.163 0 C-N-CA 120.417 -0.897 . . . . 0.0 111.846 178.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -60.96 -15.3 37.93 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.97 3.114 . . . . 0.0 114.997 -175.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -89.1 -11.78 43.02 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.431 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -77.35 -50.32 6.78 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 119.982 -1.104 . . . . 0.0 111.775 -178.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -67.27 -2.65 6.27 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.2 m -71.12 -30.26 66.28 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-O 120.674 0.273 . . . . 0.0 110.86 178.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.4 t -83.98 137.09 33.8 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 176.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -60.91 -32.87 72.34 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.875 0.734 . . . . 0.0 109.675 178.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -61.94 -53.49 54.95 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.184 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.494 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.2 m -66.46 -39.31 88.75 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.598 178.613 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -60.28 -33.32 72.17 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 122.736 0.414 . . . . 0.0 111.252 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -86.91 -38.25 16.88 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.844 0.354 . . . . 0.0 111.729 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -92.71 -26.3 17.83 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -172.357 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.466 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -96.75 138.46 34.28 Favored 'General case' 0 C--N 1.295 -1.789 0 C-N-CA 120.426 -0.509 . . . . 0.0 110.731 -177.327 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -88.04 0.97 55.3 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-O 121.105 0.479 . . . . 0.0 111.532 -177.115 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.42 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 8.3 p -83.06 -13.24 56.18 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-O 121.73 0.776 . . . . 0.0 109.107 174.549 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 61.3 m -101.67 88.24 3.36 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.879 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.16 0 CA-C-N 116.092 -0.503 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.657 ' HA ' ' HA3' ' A' ' 9' ' ' GLY . 60.2 m . . . . . 0 CA--C 1.514 -0.434 0 CA-C-O 121.99 0.9 . . . . 0.0 112.284 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 63.7 m -108.46 16.18 23.26 Favored 'General case' 0 C--N 1.262 -3.202 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.706 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -117.18 -23.23 7.98 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.569 -178.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.59 163.75 13.56 Favored Glycine 0 N--CA 1.434 -1.494 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -70.75 -19.12 31.79 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.156 2.571 . . . . 0.0 114.493 -175.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -104.67 -4.42 22.48 Favored 'General case' 0 C--N 1.311 -1.086 0 O-C-N 122.013 -0.43 . . . . 0.0 111.852 -175.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.657 ' HA3' ' HA ' ' A' ' 3' ' ' CYS . . . -63.54 -52.77 43.59 Favored Glycine 0 C--O 1.219 -0.836 0 C-N-CA 121.116 -0.564 . . . . 0.0 112.995 -176.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -84.41 5.53 26.82 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.688 0.756 . . . . 0.0 110.688 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.1 t -91.75 -15.39 28.41 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 31.3 m -86.7 127.12 34.95 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -61.59 -33.94 74.76 Favored 'General case' 0 C--O 1.198 -1.616 0 CA-C-O 118.923 -0.56 . . . . 0.0 112.351 -174.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.6 t90 -57.37 -44.49 84.47 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.29 0.567 . . . . 0.0 110.262 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.478 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 68.1 m -70.23 -34.89 73.42 Favored 'General case' 0 C--O 1.207 -1.145 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.097 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -66.15 -39.4 89.8 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.802 0.334 . . . . 0.0 110.334 175.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -70.25 -52.14 25.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.299 0.571 . . . . 0.0 111.471 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -93.36 -38.19 11.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -170.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.13 124.69 34.06 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.365 0.602 . . . . 0.0 110.789 -174.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -69.44 -21.92 63.7 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.535 -177.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.2 p -77.46 -13.82 59.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.076 0.465 . . . . 0.0 111.685 178.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.8 m . . . . . 0 C--O 1.241 0.62 0 CA-C-O 121.258 0.551 . . . . 0.0 110.206 176.702 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.402 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 34.2 m . . . . . 0 N--CA 1.444 -0.755 0 CA-C-O 121.496 0.665 . . . . 0.0 111.264 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 18.9 m -93.93 25.72 3.53 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.324 -176.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -88.13 -24.53 23.34 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.001 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.52 176.88 47.45 Favored Glycine 0 N--CA 1.435 -1.402 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.085 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -62.85 -21.87 73.43 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.676 2.918 . . . . 0.0 114.219 -177.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -89.15 -6.35 57.05 Favored 'General case' 0 C--O 1.24 0.567 0 O-C-N 121.927 -0.483 . . . . 0.0 110.158 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.402 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -70.43 -32.71 68.03 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.151 -1.58 . . . . 0.0 109.151 175.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.1 m -80.18 2.08 25.69 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.661 -0.769 . . . . 0.0 112.243 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.9 m -90.87 25.0 2.53 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.832 0.825 . . . . 0.0 109.79 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.513 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 12.4 m -127.52 131.7 50.04 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -64.4 -39.9 94.75 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.479 -175.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -54.19 -39.25 66.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.703 0.763 . . . . 0.0 110.296 177.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.513 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 55.9 m -74.24 -31.89 62.77 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.57 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -72.39 -37.0 68.82 Favored 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -75.74 -47.46 25.9 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.234 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -100.01 -30.73 11.82 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 114.714 1.376 . . . . 0.0 114.714 -168.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -89.94 131.73 35.69 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.823 -175.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -66.96 -31.09 71.43 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.097 -176.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.7 p -69.21 -23.79 63.94 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.056 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 15' ' ' CYS . 56.3 m . . . . . 0 N--CA 1.435 -1.214 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.3 m . . . . . 0 N--CA 1.438 -1.035 0 CA-C-O 122.105 0.955 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 45.5 m -88.09 8.78 25.12 Favored 'General case' 0 C--N 1.275 -2.64 0 CA-C-N 114.96 -1.018 . . . . 0.0 113.739 -172.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -111.25 42.36 1.67 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 122.48 1.133 . . . . 0.0 108.368 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 170.86 144.12 4.24 Favored Glycine 0 N--CA 1.424 -2.102 0 CA-C-N 114.5 -1.227 . . . . 0.0 110.146 177.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_exo -62.38 -28.06 78.06 Favored 'Trans proline' 0 C--O 1.214 -0.709 0 C-N-CA 122.619 2.213 . . . . 0.0 112.109 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -103.86 11.27 35.86 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 121.115 0.483 . . . . 0.0 109.804 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.28 -32.22 52.56 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 177.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.4 m -91.61 29.09 1.58 Allowed 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 122.799 0.44 . . . . 0.0 111.408 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.5 p -62.5 -45.79 91.4 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 123.799 0.839 . . . . 0.0 110.969 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.0 m -67.49 137.59 55.93 Favored 'General case' 0 C--O 1.253 1.261 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.055 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.402 ' HD3' ' O ' ' A' ' 13' ' ' LYS . 12.6 tmtt? -59.39 -33.86 71.72 Favored 'General case' 0 C--O 1.208 -1.083 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 175.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -51.14 -50.29 59.17 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.6 m -65.32 -45.85 82.67 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.541 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -64.75 -28.12 69.36 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.057 0.456 . . . . 0.0 111.31 -178.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -88.34 -47.49 8.35 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.917 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -93.71 -23.22 18.3 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -172.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -95.79 120.87 36.82 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 121.713 0.768 . . . . 0.0 109.976 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -74.87 -22.48 58.64 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.995 -175.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 p -83.96 3.23 35.07 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 114.775 -1.102 . . . . 0.0 111.885 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 95.4 m . . . . . 0 N--CA 1.443 -0.821 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 176.856 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.482 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 64.6 m . . . . . 0 C--O 1.212 -0.893 0 CA-C-O 121.485 0.659 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.6 m -114.48 41.28 2.35 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.057 0.932 . . . . 0.0 110.157 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -93.59 12.05 26.64 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.279 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 159.6 164.99 15.67 Favored Glycine 0 N--CA 1.432 -1.584 0 N-CA-C 110.044 -1.223 . . . . 0.0 110.044 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -59.54 -18.38 46.65 Favored 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.472 2.782 . . . . 0.0 115.287 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -104.12 13.72 31.87 Favored 'General case' 0 C--O 1.241 0.61 0 O-C-N 121.386 -0.821 . . . . 0.0 111.731 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.13 -39.53 52.87 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.298 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.422 ' HA ' ' HB3' ' A' ' 15' ' ' CYS . 74.0 m -97.21 34.04 1.84 Allowed 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.126 0.488 . . . . 0.0 111.373 -178.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.4 p -72.82 -36.9 67.62 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.6 0.714 . . . . 0.0 109.239 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -69.89 144.7 52.39 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.657 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -57.54 -44.67 85.33 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 123.991 0.916 . . . . 0.0 112.592 -176.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.0 t90 -62.96 -49.95 72.7 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.482 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 68.6 m -57.03 -41.07 77.95 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -60.97 -37.95 84.22 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.774 0.321 . . . . 0.0 111.019 178.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.24 -51.36 11.05 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 177.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 72.1 m-70 -88.88 -17.69 29.13 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 115.05 1.5 . . . . 0.0 115.05 -165.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.94 114.78 23.11 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 44.2 mtm180 -67.73 -24.44 65.37 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.348 0.594 . . . . 0.0 110.131 -176.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -71.39 -12.5 61.45 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.591 176.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.0 m . . . . . 0 N--CA 1.433 -1.325 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 176.312 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.457 ' HB2' ' HB3' ' A' ' 15' ' ' CYS . 97.0 m . . . . . 0 C--O 1.223 -0.324 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 61.0 m -117.2 11.96 14.27 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 122.53 1.157 . . . . 0.0 108.603 171.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -144.57 150.12 36.96 Favored 'General case' 0 N--CA 1.425 -1.691 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 136.02 -164.43 25.01 Favored Glycine 0 C--N 1.292 -1.881 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.34 -42.02 45.17 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.138 2.559 . . . . 0.0 113.46 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -134.45 17.49 3.66 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 120.558 0.218 . . . . 0.0 111.094 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.31 -83.6 0.75 Allowed Glycine 0 N--CA 1.433 -1.526 0 N-CA-C 109.19 -1.564 . . . . 0.0 109.19 -174.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.8 m -101.3 64.12 1.01 Allowed 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.357 0.598 . . . . 0.0 109.515 177.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.2 t -78.04 -32.58 51.02 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -71.26 131.46 43.51 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -54.94 -46.68 74.99 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.256 1.022 . . . . 0.0 112.601 -173.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 91.3 t90 -55.71 -44.21 77.21 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.576 0.703 . . . . 0.0 110.664 178.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.457 ' HB3' ' HB2' ' A' ' 3' ' ' CYS . 60.7 m -67.26 -32.05 72.81 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.707 -176.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -64.71 -32.32 73.94 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -97.09 -20.52 17.95 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -114.9 -18.32 11.32 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 -170.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.13 158.74 31.43 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 118.727 0.694 . . . . 0.0 111.31 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -84.18 -37.95 21.24 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.4 p -69.78 -13.72 62.42 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.899 -1.046 . . . . 0.0 113.249 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 63.2 m . . . . . 0 N--CA 1.437 -1.087 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.165 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 75.1 m . . . . . 0 C--O 1.246 0.891 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 66.6 m -83.69 70.67 10.36 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-O 121.557 0.694 . . . . 0.0 111.037 -176.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 32.5 p-10 -149.28 13.19 0.85 Allowed 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.281 176.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -160.25 163.07 33.69 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.73 -15.63 37.3 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.38 2.72 . . . . 0.0 114.173 -176.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -102.62 1.9 35.32 Favored 'General case' 0 C--N 1.307 -1.253 0 O-C-N 122.088 -0.383 . . . . 0.0 110.225 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.46 -59.95 9.33 Favored Glycine 0 C--O 1.218 -0.897 0 O-C-N 123.717 0.635 . . . . 0.0 113.32 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.9 m -82.49 -3.14 55.32 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.528 0.68 . . . . 0.0 111.146 -177.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.8 m -87.45 -16.01 36.06 Favored 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.315 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.9 m -79.1 134.26 36.74 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.673 ' HE2' ' HA ' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -51.7 -55.28 20.47 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.914 0.886 . . . . 0.0 112.897 -175.093 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.8 t90 -62.0 -49.22 76.92 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -177.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.0 m -61.92 -35.2 77.67 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.47 -175.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -58.54 -38.95 78.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.86 0.362 . . . . 0.0 111.383 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -103.3 -27.15 12.64 Favored 'General case' 0 C--N 1.31 -1.124 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -175.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -102.9 -7.5 21.47 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -172.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.24 119.79 39.94 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 107.216 -1.401 . . . . 0.0 107.216 173.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -66.23 -19.69 65.9 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.982 -173.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 3.4 p -77.61 -4.06 44.02 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.958 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 N--CA 1.441 -0.901 0 CA-C-O 121.403 0.621 . . . . 0.0 110.381 177.702 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 19' ' ' ALA . 70.6 m . . . . . 0 C--O 1.206 -1.189 0 CA-C-O 121.04 0.447 . . . . 0.0 110.382 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.416 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 71.2 m -116.19 11.23 15.12 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.847 0.832 . . . . 0.0 109.658 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -101.06 116.7 33.45 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.436 -177.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 114.9 168.92 15.9 Favored Glycine 0 C--N 1.303 -1.302 0 C-N-CA 121.185 -0.531 . . . . 0.0 112.349 173.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -66.02 -18.03 56.25 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 123.283 2.655 . . . . 0.0 112.424 179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.545 ' HB3' ' HB3' ' A' ' 11' ' ' SER . 10.0 mtmp? -88.88 -60.26 2.01 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.69 -98.69 1.07 Allowed Glycine 0 N--CA 1.424 -2.124 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 79.6 m -90.56 77.25 6.47 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 121.977 0.894 . . . . 0.0 109.47 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.545 ' HB3' ' HB3' ' A' ' 8' ' ' LYS . 4.1 p -94.67 -27.1 16.04 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 114.253 -1.34 . . . . 0.0 109.002 175.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 t -90.06 134.67 34.11 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 174.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -63.79 -37.4 87.24 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 123.642 0.588 . . . . 0.0 111.551 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.5 t90 -59.07 -41.25 87.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.392 0.615 . . . . 0.0 109.753 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.2 m -65.44 -29.41 70.09 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.718 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -71.38 -19.71 62.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.275 0.559 . . . . 0.0 110.876 -176.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -100.61 -13.26 18.65 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 62.0 m-70 -120.6 -22.92 6.2 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.679 1.362 . . . . 0.0 114.679 -171.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.503 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . . . -77.71 140.86 39.57 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -66.38 -17.31 64.7 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -176.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.3 p -87.45 -3.66 59.01 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 122.906 0.482 . . . . 0.0 111.101 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 70.9 m . . . . . 0 N--CA 1.439 -1.004 0 CA-C-O 121.39 0.614 . . . . 0.0 110.075 -179.381 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.712 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 71.3 m . . . . . 0 CA--C 1.506 -0.722 0 CA-C-O 122.173 0.987 . . . . 0.0 109.733 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 73.1 m -84.51 73.14 10.57 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.022 175.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -120.42 2.44 10.76 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 114.16 -1.382 . . . . 0.0 108.96 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.49 -163.12 33.84 Favored Glycine 0 N--CA 1.421 -2.326 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.007 -177.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -86.62 4.9 6.12 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.286 2.657 . . . . 0.0 115.565 -174.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -123.99 5.96 8.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.542 0.61 . . . . 0.0 110.216 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.712 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -79.97 -33.52 32.98 Favored Glycine 0 C--O 1.214 -1.096 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.705 -175.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 67.0 m -92.6 21.92 5.08 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.328 0.585 . . . . 0.0 110.937 -178.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.6 t -76.1 -48.7 19.72 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -178.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.7 m -59.29 137.78 57.86 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.188 176.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -50.72 -48.01 58.98 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.155 0.982 . . . . 0.0 110.864 -178.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.7 t90 -56.43 -40.91 75.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.557 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.9 m -70.85 -32.44 69.46 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.526 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.1 ttt85 -72.85 -18.93 61.39 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 121.215 0.531 . . . . 0.0 110.877 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -98.99 -45.27 6.01 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.587 0.708 . . . . 0.0 111.144 176.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 34.1 m-70 -89.88 -23.51 21.62 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -168.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.84 126.68 30.96 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 177.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 20' ' ' ARG . 52.5 mtp180 -72.47 -16.18 61.8 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.509 0.671 . . . . 0.0 110.948 -174.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -94.82 0.12 54.59 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 114.755 -1.112 . . . . 0.0 111.314 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 84.4 m . . . . . 0 C--N 1.321 -0.64 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.056 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 89.9 m . . . . . 0 C--O 1.209 -1.034 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 58.5 m -113.28 17.18 18.77 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.18 0.99 . . . . 0.0 108.751 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -89.81 -22.11 22.27 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.59 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.69 154.79 26.05 Favored Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.72 -28.94 82.72 Favored 'Trans proline' 0 C--O 1.244 0.812 0 C-N-CA 123.224 2.616 . . . . 0.0 113.597 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -90.27 -1.72 57.95 Favored 'General case' 0 N--CA 1.438 -1.039 0 O-C-N 121.866 -0.521 . . . . 0.0 111.345 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.05 -42.04 78.79 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.3 m -72.26 12.73 0.4 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.6 m -82.69 -22.53 34.5 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 m -72.81 123.08 22.65 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -62.59 -33.78 75.67 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.243 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -60.4 -36.71 78.76 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.758 0.79 . . . . 0.0 109.435 178.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 91.7 m -80.11 -11.86 59.72 Favored 'General case' 0 C--O 1.2 -1.528 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.262 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -77.71 -32.98 53.25 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -90.9 -34.48 15.21 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.26 178.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -93.12 -38.81 11.39 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -175.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.76 107.08 18.96 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.43 ' HA ' ' HD3' ' A' ' 20' ' ' ARG . 23.4 mmt180 -78.45 3.72 15.11 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.852 0.834 . . . . 0.0 111.905 -176.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 p -89.63 -9.32 50.08 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.261 171.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 80.6 m . . . . . 0 C--O 1.247 0.958 0 CA-C-O 121.172 0.51 . . . . 0.0 110.119 176.843 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.57 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 55.7 m . . . . . 0 N--CA 1.439 -0.991 0 CA-C-O 122.156 0.979 . . . . 0.0 110.361 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 58.9 m -90.44 72.2 6.98 Favored 'General case' 0 C--N 1.268 -2.964 0 CA-C-N 114.92 -1.036 . . . . 0.0 112.63 -173.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -147.54 12.51 1.03 Allowed 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 122.274 1.035 . . . . 0.0 108.234 173.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.44 164.79 35.81 Favored Glycine 0 N--CA 1.434 -1.478 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 -178.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -69.79 -20.51 34.6 Favored 'Trans proline' 0 C--O 1.223 -0.246 0 C-N-CA 122.944 2.429 . . . . 0.0 113.855 -176.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -112.62 33.98 4.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.977 0.418 . . . . 0.0 111.158 -177.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.57 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -92.75 -7.41 62.97 Favored Glycine 0 N--CA 1.438 -1.185 0 C-N-CA 120.447 -0.883 . . . . 0.0 113.745 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.5 m -115.71 24.84 11.21 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 117.651 0.725 . . . . 0.0 111.588 -176.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 p -84.13 -14.72 49.54 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.866 -177.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.1 p -98.24 153.41 18.51 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 121.025 0.44 . . . . 0.0 111.444 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -62.4 -40.14 95.55 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.242 177.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 71.4 t90 -59.49 -50.95 71.93 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.635 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.402 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 81.5 m -68.58 -37.9 80.23 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.197 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -64.3 -39.64 94.33 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.955 0.407 . . . . 0.0 111.433 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.15 -47.99 12.72 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -176.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -93.44 -12.14 30.48 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -168.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.421 ' HB1' ' SG ' ' A' ' 21' ' ' CYS . . . -111.0 124.19 51.67 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 176.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -76.83 -20.36 56.45 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.86 0.362 . . . . 0.0 110.977 -177.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.421 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 5.9 p -66.79 -20.75 66.01 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.999 173.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.4 m . . . . . 0 N--CA 1.437 -1.089 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.236 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 62.1 m . . . . . 0 N--CA 1.447 -0.61 0 CA-C-O 121.595 0.712 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 38.9 m -93.95 -18.84 21.49 Favored 'General case' 0 C--N 1.292 -1.907 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.439 -177.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -97.22 79.75 2.85 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 122.623 1.202 . . . . 0.0 111.405 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 149.52 145.23 4.09 Favored Glycine 0 N--CA 1.432 -1.624 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.843 176.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -59.97 -35.63 92.61 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.035 2.49 . . . . 0.0 111.968 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -96.97 17.88 15.93 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.358 -178.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -67.15 -32.12 79.4 Favored Glycine 0 N--CA 1.433 -1.563 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 50.7 m -93.96 15.67 16.27 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 122.846 0.458 . . . . 0.0 111.897 -176.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.5 m -66.14 -44.59 83.76 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.735 0.302 . . . . 0.0 111.05 -177.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.1 m -74.66 134.38 42.01 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.7 -32.78 70.84 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 123.008 0.193 . . . . 0.0 110.86 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -55.13 -49.64 71.28 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 176.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 98.9 m -64.57 -43.2 94.66 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.259 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -65.65 -41.01 93.07 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 120.984 0.421 . . . . 0.0 111.81 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -78.58 -46.19 19.94 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.104 -176.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -92.03 -24.76 19.09 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -170.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 15' ' ' CYS . . . -95.88 113.61 25.25 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 175.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -77.35 4.15 11.48 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 124.469 1.108 . . . . 0.0 111.931 -172.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.9 p -83.49 -20.13 34.52 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 173.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.8 m . . . . . 0 N--CA 1.43 -1.427 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.504 179.452 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 70.2 m . . . . . 0 C--O 1.209 -1.04 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.53 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 70.8 m -106.02 24.8 11.81 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 122.548 1.166 . . . . 0.0 108.689 -177.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.3 p-10 -88.89 -15.26 34.85 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.756 -1.565 . . . . 0.0 109.716 -178.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -169.03 165.83 39.23 Favored Glycine 0 N--CA 1.431 -1.635 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -62.93 -27.21 74.47 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 123.163 2.575 . . . . 0.0 112.991 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.453 ' HA ' ' HB2' ' A' ' 11' ' ' SER . 53.2 mtpt -89.44 -11.94 41.63 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.732 -179.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.92 -46.29 91.92 Favored Glycine 0 CA--C 1.499 -0.918 0 N-CA-C 107.814 -2.115 . . . . 0.0 107.814 172.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.2 m -79.33 0.33 29.39 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.649 -0.776 . . . . 0.0 112.425 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.453 ' HB2' ' HA ' ' A' ' 8' ' ' LYS . 22.1 t -76.64 -33.08 58.35 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.177 0.513 . . . . 0.0 109.851 -178.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.6 m -75.28 130.32 38.89 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -50.64 -45.64 57.88 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.37 1.068 . . . . 0.0 112.245 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.0 t90 -53.22 -46.65 69.17 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.603 0.716 . . . . 0.0 110.174 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 91.0 m -69.47 -43.76 72.58 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.962 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -61.77 -31.88 72.12 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.591 0.71 . . . . 0.0 110.461 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.01 -41.32 51.39 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.834 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -94.03 -37.07 11.83 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -174.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.53 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -86.81 113.75 22.89 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -88.07 -3.63 58.87 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.802 -174.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.4 p -88.58 5.8 41.12 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.575 175.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 84.3 m . . . . . 0 N--CA 1.437 -1.1 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.808 176.529 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 22.3 m . . . . . 0 CA--C 1.498 -1.023 0 CA-C-O 122.156 0.979 . . . . 0.0 111.02 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.6 m -92.78 25.21 3.23 Favored 'General case' 0 C--N 1.273 -2.742 0 CA-C-N 114.583 -1.189 . . . . 0.0 112.004 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 35.7 p30 -89.32 -11.61 42.89 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 153.88 -174.03 32.45 Favored Glycine 0 N--CA 1.425 -2.035 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.96 -23.37 72.58 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.523 2.815 . . . . 0.0 113.288 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -89.04 -5.4 57.92 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 122.138 -0.351 . . . . 0.0 111.169 -177.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -82.27 -25.0 53.07 Favored Glycine 0 N--CA 1.435 -1.388 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.119 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.3 m -86.77 20.6 2.5 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 123.535 0.734 . . . . 0.0 111.062 -178.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.6 p -69.86 -33.14 71.86 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.643 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.1 p -83.97 159.94 21.14 Favored 'General case' 0 C--O 1.253 1.283 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -72.51 -34.62 67.76 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.1 t90 -55.37 -55.22 34.09 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.262 179.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.1 m -65.42 -41.52 93.46 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.912 179.451 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -65.33 -28.08 69.05 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.777 0.322 . . . . 0.0 111.724 -177.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -91.89 -44.82 8.7 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 120.872 0.368 . . . . 0.0 111.677 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 65.7 m-70 -92.48 -19.33 22.11 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -171.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.516 ' HB1' ' SG ' ' A' ' 21' ' ' CYS . . . -99.53 139.22 35.51 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-O 121.321 0.582 . . . . 0.0 109.934 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -90.64 -4.49 56.76 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 121.857 0.837 . . . . 0.0 110.105 -175.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.516 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 9.2 p -86.52 3.82 42.51 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.571 177.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.1 m . . . . . 0 N--CA 1.421 -1.894 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.451 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.526 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 30.6 m . . . . . 0 N--CA 1.444 -0.754 0 CA-C-O 121.427 0.632 . . . . 0.0 111.877 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.4 m -95.93 9.3 41.09 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-O 121.535 0.683 . . . . 0.0 110.939 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -108.13 15.9 23.8 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.818 0.818 . . . . 0.0 108.926 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -145.48 148.5 20.27 Favored Glycine 0 N--CA 1.429 -1.769 0 CA-C-O 118.755 -1.025 . . . . 0.0 110.542 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -52.04 -41.89 61.84 Favored 'Trans proline' 0 C--O 1.245 0.843 0 C-N-CA 123.162 2.575 . . . . 0.0 112.298 177.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.7 mttp -122.66 74.57 1.2 Allowed 'General case' 0 N--CA 1.433 -1.307 0 CA-C-O 121.469 0.652 . . . . 0.0 110.81 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.526 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -102.35 -52.37 1.0 Allowed Glycine 0 N--CA 1.432 -1.572 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 173.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.535 ' HA ' ' HB2' ' A' ' 15' ' ' CYS . 75.9 m -81.92 15.35 2.3 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.194 0.521 . . . . 0.0 111.903 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.1 p -71.99 -27.86 63.03 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-O 121.926 0.869 . . . . 0.0 109.068 175.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.6 t -86.52 138.59 31.6 Favored 'General case' 0 N--CA 1.418 -2.025 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -59.55 -24.22 63.53 Favored 'General case' 0 C--N 1.315 -0.923 0 O-C-N 123.621 0.576 . . . . 0.0 111.675 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -64.39 -54.31 34.78 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.535 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 97.5 m -68.9 -36.89 78.57 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.032 178.396 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.9 ttt180 -60.18 -33.02 71.63 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 120.83 0.348 . . . . 0.0 110.541 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -92.1 -49.73 6.05 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.654 -0.418 . . . . 0.0 112.071 179.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -89.95 -11.51 41.5 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -167.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.45 142.33 35.98 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 119.286 -0.965 . . . . 0.0 108.54 176.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -84.45 -21.82 30.56 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 -177.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.6 p -81.86 -16.85 49.37 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.258 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.1 m . . . . . 0 C--N 1.314 -0.954 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 176.137 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.455 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 58.3 m . . . . . 0 C--O 1.219 -0.546 0 CA-C-O 121.367 0.604 . . . . 0.0 111.667 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.5 m -95.65 13.05 27.6 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-O 121.156 0.503 . . . . 0.0 112.238 -170.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -90.05 -11.34 41.74 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.959 0.409 . . . . 0.0 111.505 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -154.33 162.66 30.74 Favored Glycine 0 N--CA 1.433 -1.554 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.332 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -69.22 -13.21 35.63 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.966 2.444 . . . . 0.0 113.192 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -87.23 -28.3 22.45 Favored 'General case' 0 C--O 1.244 0.815 0 O-C-N 121.876 -0.515 . . . . 0.0 109.841 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -61.37 -51.96 54.6 Favored Glycine 0 N--CA 1.432 -1.588 0 N-CA-C 110.009 -1.236 . . . . 0.0 110.009 175.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.3 m -75.38 -9.95 59.02 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.3 t -80.95 -19.75 43.49 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 m -76.5 126.66 31.37 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 176.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -56.74 -37.82 71.54 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -174.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 91.1 t90 -62.27 -43.73 98.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.451 0.643 . . . . 0.0 109.326 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 62.2 m -73.99 -38.08 64.23 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.035 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -60.56 -36.21 77.93 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.132 0.492 . . . . 0.0 110.573 176.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -81.14 -52.67 7.12 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.273 -178.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -94.54 -32.4 13.48 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -169.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.32 120.92 23.02 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.5 mmm180 -78.84 -9.5 59.49 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.118 -170.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.6 p -97.87 3.99 49.69 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 121.764 0.792 . . . . 0.0 110.203 174.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 86.9 m . . . . . 0 N--CA 1.435 -1.198 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.634 174.255 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 78.5 m . . . . . 0 N--CA 1.463 0.218 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 46.8 m -98.54 4.56 48.2 Favored 'General case' 0 C--N 1.271 -2.837 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.664 -175.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -102.58 13.95 33.2 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 121.347 0.594 . . . . 0.0 110.671 -179.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.403 ' HA2' ' HD3' ' A' ' 7' ' ' PRO . . . -164.76 147.06 12.0 Favored Glycine 0 N--CA 1.426 -1.972 0 C-N-CA 120.144 -1.026 . . . . 0.0 111.44 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.403 ' HD3' ' HA2' ' A' ' 6' ' ' GLY . 33.3 Cg_exo -60.69 -27.95 85.69 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.219 2.612 . . . . 0.0 113.104 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -88.71 -1.89 58.31 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 122.104 -0.373 . . . . 0.0 110.195 -178.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -70.07 -69.18 1.44 Allowed Glycine 0 N--CA 1.439 -1.142 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.263 -178.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.5 m -80.84 10.74 4.59 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.4 t -69.86 -38.8 76.55 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 171.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 m -68.28 130.39 42.77 Favored 'General case' 0 N--CA 1.426 -1.669 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -60.62 -31.03 70.23 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 123.07 0.548 . . . . 0.0 111.22 -175.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -61.81 -48.4 80.75 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 176.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 54.2 m -70.27 -23.69 62.93 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 116.116 -0.493 . . . . 0.0 112.303 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -70.49 -42.77 70.94 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 120.019 -0.672 . . . . 0.0 110.432 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -87.81 -43.72 11.64 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -89.03 5.06 46.1 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -168.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -116.47 114.71 24.59 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 173.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -64.78 -22.51 67.0 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.71 -173.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.2 p -74.88 -13.52 60.56 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 82.9 m . . . . . 0 C--N 1.316 -0.874 0 CA-C-O 121.28 0.562 . . . . 0.0 110.546 176.19 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HA ' ' HA3' ' A' ' 9' ' ' GLY . 2.6 m . . . . . 0 N--CA 1.444 -0.728 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.445 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 60.6 m -105.86 -11.85 16.07 Favored 'General case' 0 C--N 1.285 -2.216 0 CA-C-O 121.468 0.651 . . . . 0.0 110.787 -176.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -91.99 -34.17 14.55 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.637 0.732 . . . . 0.0 109.516 179.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.406 ' HA2' ' HD3' ' A' ' 7' ' ' PRO . . . -96.18 132.07 10.9 Favored Glycine 0 N--CA 1.433 -1.556 0 N-CA-C 109.031 -1.627 . . . . 0.0 109.031 179.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.406 ' HD3' ' HA2' ' A' ' 6' ' ' GLY . 49.0 Cg_exo -54.73 -36.02 89.19 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.875 2.384 . . . . 0.0 114.359 -176.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -105.22 27.95 7.76 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.09 0.472 . . . . 0.0 110.381 178.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.535 ' HA3' ' HA ' ' A' ' 3' ' ' CYS . . . -60.72 -36.16 91.19 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.896 -179.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.2 m -84.79 28.32 0.69 Allowed 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 117.119 0.46 . . . . 0.0 112.096 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.5 t -72.76 -34.97 67.34 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.7 p -80.37 150.58 29.81 Favored 'General case' 0 C--O 1.259 1.565 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.174 178.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.759 ' HE2' ' HA ' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -58.61 -40.09 82.29 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.064 -179.914 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -57.74 -56.93 15.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 123.991 0.807 . . . . 0.0 109.965 177.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.501 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 78.6 m -61.57 -38.75 88.65 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -177.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -65.5 -23.16 66.82 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.481 -0.488 . . . . 0.0 111.396 -177.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -102.22 -49.33 3.93 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 120.971 0.415 . . . . 0.0 111.903 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -89.43 -24.88 21.77 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -168.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.445 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -70.83 136.04 48.47 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -70.55 -11.85 61.19 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -170.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.0 p -84.55 -18.67 34.93 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.186 0.517 . . . . 0.0 110.381 176.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.9 m . . . . . 0 N--CA 1.432 -1.333 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -177.541 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 35.3 m . . . . . 0 N--CA 1.439 -1.02 0 CA-C-O 121.753 0.787 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 50.0 m -104.71 17.06 24.83 Favored 'General case' 0 C--N 1.279 -2.496 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.089 -176.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -89.43 0.22 57.01 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.442 0.639 . . . . 0.0 110.495 -176.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 157.71 177.32 30.71 Favored Glycine 0 N--CA 1.433 -1.515 0 C-N-CA 120.512 -0.851 . . . . 0.0 111.624 178.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -52.82 -35.46 69.9 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.857 3.038 . . . . 0.0 113.313 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -89.03 17.92 5.37 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.088 0.47 . . . . 0.0 110.985 -177.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -91.79 -28.77 13.12 Favored Glycine 0 N--CA 1.414 -2.772 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 171.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 70.1 m -95.86 11.86 32.22 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 123.234 0.613 . . . . 0.0 111.67 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.4 p -74.46 -28.71 61.15 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 123.394 0.677 . . . . 0.0 111.348 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.5 p -88.11 141.26 28.71 Favored 'General case' 0 N--CA 1.424 -1.757 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.889 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -61.14 -35.18 76.37 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -54.38 -52.55 61.31 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.971 177.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 82.8 m -70.15 -34.96 73.68 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.695 177.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -61.61 -37.07 82.6 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.318 0.58 . . . . 0.0 109.739 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -78.09 -44.23 26.8 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.451 179.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -89.48 -34.49 16.41 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -170.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.487 ' HB1' ' SG ' ' A' ' 21' ' ' CYS . . . -92.84 122.77 35.56 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-O 121.417 0.627 . . . . 0.0 111.077 -175.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -82.42 -3.94 56.52 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.55 0.69 . . . . 0.0 110.312 -178.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.487 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 27.6 p -79.4 -9.28 59.56 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.46 -0.791 . . . . 0.0 108.954 173.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.7 m . . . . . 0 N--CA 1.434 -1.255 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.136 179.561 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.576 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 30.5 m . . . . . 0 N--CA 1.451 -0.386 0 CA-C-O 121.439 0.638 . . . . 0.0 112.365 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.649 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 81.4 m -84.61 -10.69 57.12 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.356 179.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -101.03 0.6 38.35 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -175.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.39 147.11 18.26 Favored Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -178.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -58.56 -41.59 63.05 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 123.392 2.728 . . . . 0.0 114.127 -177.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.426 ' HD3' ' HA ' ' A' ' 8' ' ' LYS . 73.3 mmtt -111.92 27.89 9.25 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.913 0.387 . . . . 0.0 110.25 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.576 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -58.2 -37.95 88.3 Favored Glycine 0 C--O 1.22 -0.725 0 CA-C-N 115.109 -0.95 . . . . 0.0 113.342 -178.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 82.6 m -80.05 -3.18 47.48 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.7 t -85.34 66.39 9.68 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-O 122.135 0.969 . . . . 0.0 108.712 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.0 t -174.33 138.94 0.58 Allowed 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.661 1.585 . . . . 0.0 106.842 -178.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -71.89 -34.96 69.58 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -178.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.8 t90 -60.7 -43.82 97.31 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.764 0.792 . . . . 0.0 109.216 178.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.2 m -71.62 -37.7 70.87 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.618 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.512 ' HA ' ' CB ' ' A' ' 22' ' ' CYS . 1.7 tmt_? -64.71 -36.89 85.73 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -68.68 -42.45 77.8 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.866 179.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -98.23 -44.03 6.74 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 -172.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.649 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -75.85 131.98 40.06 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.318 0.58 . . . . 0.0 111.521 -172.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -74.09 -12.26 60.55 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.225 -174.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 20.2 p -89.03 -10.48 47.35 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.572 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.512 ' CB ' ' HA ' ' A' ' 16' ' ' ARG . 59.8 m . . . . . 0 C--N 1.309 -1.156 0 CA-C-O 121.024 0.44 . . . . 0.0 110.931 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.494 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 57.1 m . . . . . 0 N--CA 1.437 -1.075 0 CA-C-O 121.927 0.87 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.466 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 73.5 m -97.05 24.84 5.88 Favored 'General case' 0 C--N 1.275 -2.651 0 CA-C-N 114.671 -1.149 . . . . 0.0 111.225 -177.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.4 p-10 -89.72 -11.2 42.99 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-O 121.195 0.521 . . . . 0.0 110.132 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 151.07 -164.1 29.95 Favored Glycine 0 N--CA 1.424 -2.163 0 C-N-CA 120.417 -0.897 . . . . 0.0 111.846 178.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -60.96 -15.3 37.93 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.97 3.114 . . . . 0.0 114.997 -175.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -89.1 -11.78 43.02 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.431 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -77.35 -50.32 6.78 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 119.982 -1.104 . . . . 0.0 111.775 -178.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -67.27 -2.65 6.27 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.2 m -71.12 -30.26 66.28 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-O 120.674 0.273 . . . . 0.0 110.86 178.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.4 t -83.98 137.09 33.8 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 176.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -60.91 -32.87 72.34 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.875 0.734 . . . . 0.0 109.675 178.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -61.94 -53.49 54.95 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.184 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.494 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.2 m -66.46 -39.31 88.75 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.598 178.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -60.28 -33.32 72.17 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 122.736 0.414 . . . . 0.0 111.252 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -86.91 -38.25 16.88 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.844 0.354 . . . . 0.0 111.729 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -92.71 -26.3 17.83 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -172.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.466 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -96.75 138.46 34.28 Favored 'General case' 0 C--N 1.295 -1.789 0 C-N-CA 120.426 -0.509 . . . . 0.0 110.731 -177.327 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -88.04 0.97 55.3 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-O 121.105 0.479 . . . . 0.0 111.532 -177.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.42 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 8.3 p -83.06 -13.24 56.18 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-O 121.73 0.776 . . . . 0.0 109.107 174.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 61.3 m . . . . . 0 N--CA 1.426 -1.673 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.879 179.678 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . 0.254 . . . . . . . 0 N--CA 1.433 -1.284 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 96.34 -52.37 1.58 Allowed Glycine 0 CA--C 1.499 -0.919 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -178.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.657 ' HA ' ' HA3' ' A' ' 9' ' ' GLY . 60.2 m -53.68 -41.68 67.13 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 121.99 0.9 . . . . 0.0 112.284 -179.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 63.7 m -108.46 16.18 23.26 Favored 'General case' 0 C--N 1.262 -3.202 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.706 -175.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -117.18 -23.23 7.98 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.569 -178.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.59 163.75 13.56 Favored Glycine 0 N--CA 1.434 -1.494 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -70.75 -19.12 31.79 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.156 2.571 . . . . 0.0 114.493 -175.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -104.67 -4.42 22.48 Favored 'General case' 0 C--N 1.311 -1.086 0 O-C-N 122.013 -0.43 . . . . 0.0 111.852 -175.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.657 ' HA3' ' HA ' ' A' ' 3' ' ' CYS . . . -63.54 -52.77 43.59 Favored Glycine 0 C--O 1.219 -0.836 0 C-N-CA 121.116 -0.564 . . . . 0.0 112.995 -176.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -84.41 5.53 26.82 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.688 0.756 . . . . 0.0 110.688 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.1 t -91.75 -15.39 28.41 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 31.3 m -86.7 127.12 34.95 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -61.59 -33.94 74.76 Favored 'General case' 0 C--O 1.198 -1.616 0 CA-C-O 118.923 -0.56 . . . . 0.0 112.351 -174.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.6 t90 -57.37 -44.49 84.47 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.29 0.567 . . . . 0.0 110.262 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.478 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 68.1 m -70.23 -34.89 73.42 Favored 'General case' 0 C--O 1.207 -1.145 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.097 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.8 tpt180 -66.15 -39.4 89.8 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.802 0.334 . . . . 0.0 110.334 175.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -70.25 -52.14 25.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.299 0.571 . . . . 0.0 111.471 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -93.36 -38.19 11.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -170.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.13 124.69 34.06 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.365 0.602 . . . . 0.0 110.789 -174.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -69.44 -21.92 63.7 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.535 -177.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.2 p -77.46 -13.82 59.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.076 0.465 . . . . 0.0 111.685 178.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.8 m -92.97 90.63 7.03 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.258 0.551 . . . . 0.0 110.206 176.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.582 0 CA-C-N 116.418 -0.356 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . 0.253 . . . . . . . 0 N--CA 1.421 -1.922 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 101.75 -0.75 52.34 Favored Glycine 0 CA--C 1.5 -0.906 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 -178.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.402 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 34.2 m -90.69 -15.29 30.58 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 121.496 0.665 . . . . 0.0 111.264 -175.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 18.9 m -93.93 25.72 3.53 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.324 -176.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -88.13 -24.53 23.34 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.001 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -175.52 176.88 47.45 Favored Glycine 0 N--CA 1.435 -1.402 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.085 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -62.85 -21.87 73.43 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.676 2.918 . . . . 0.0 114.219 -177.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -89.15 -6.35 57.05 Favored 'General case' 0 C--O 1.24 0.567 0 O-C-N 121.927 -0.483 . . . . 0.0 110.158 -178.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.402 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -70.43 -32.71 68.03 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.151 -1.58 . . . . 0.0 109.151 175.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.1 m -80.18 2.08 25.69 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.661 -0.769 . . . . 0.0 112.243 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.9 m -90.87 25.0 2.53 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.832 0.825 . . . . 0.0 109.79 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.513 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 12.4 m -127.52 131.7 50.04 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -64.4 -39.9 94.75 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.479 -175.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -54.19 -39.25 66.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.703 0.763 . . . . 0.0 110.296 177.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.513 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 55.9 m -74.24 -31.89 62.77 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.57 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 74.8 ttt180 -72.39 -37.0 68.82 Favored 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -75.74 -47.46 25.9 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.234 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -100.01 -30.73 11.82 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 114.714 1.376 . . . . 0.0 114.714 -168.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -89.94 131.73 35.69 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.823 -175.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.7 mtm180 -66.96 -31.09 71.43 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.097 -176.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.7 p -69.21 -23.79 63.94 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.056 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 15' ' ' CYS . 56.3 m -109.12 -76.73 0.61 Allowed 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.484 0 O-C-N 122.024 -0.423 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . 0.42 ' HA ' ' HB2' ' A' ' 5' ' ' ASN . . . . . . . . 0 N--CA 1.416 -2.126 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.13 -89.42 1.03 Allowed Glycine 0 N--CA 1.427 -1.932 0 N-CA-C 110.1 -1.2 . . . . 0.0 110.1 -177.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.3 m -93.25 -38.43 11.53 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-O 122.105 0.955 . . . . 0.0 110.223 -178.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 45.5 m -88.09 8.78 25.12 Favored 'General case' 0 C--N 1.275 -2.64 0 CA-C-N 114.96 -1.018 . . . . 0.0 113.739 -172.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.42 ' HB2' ' HA ' ' A' ' 1' ' ' PCA . 10.4 t30 -111.25 42.36 1.67 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 122.48 1.133 . . . . 0.0 108.368 179.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 170.86 144.12 4.24 Favored Glycine 0 N--CA 1.424 -2.102 0 CA-C-N 114.5 -1.227 . . . . 0.0 110.146 177.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_exo -62.38 -28.06 78.06 Favored 'Trans proline' 0 C--O 1.214 -0.709 0 C-N-CA 122.619 2.213 . . . . 0.0 112.109 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -103.86 11.27 35.86 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 121.115 0.483 . . . . 0.0 109.804 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.28 -32.22 52.56 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 177.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.4 m -91.61 29.09 1.58 Allowed 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 122.799 0.44 . . . . 0.0 111.408 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.5 p -62.5 -45.79 91.4 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 123.799 0.839 . . . . 0.0 110.969 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.0 m -67.49 137.59 55.93 Favored 'General case' 0 C--O 1.253 1.261 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.055 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.402 ' HD3' ' O ' ' A' ' 13' ' ' LYS . 12.6 tmtt? -59.39 -33.86 71.72 Favored 'General case' 0 C--O 1.208 -1.083 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 175.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -51.14 -50.29 59.17 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.6 m -65.32 -45.85 82.67 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.541 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -64.75 -28.12 69.36 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.057 0.456 . . . . 0.0 111.31 -178.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -88.34 -47.49 8.35 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.917 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -93.71 -23.22 18.3 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -172.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -95.79 120.87 36.82 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 121.713 0.768 . . . . 0.0 109.976 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -74.87 -22.48 58.64 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.995 -175.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 p -83.96 3.23 35.07 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 114.775 -1.102 . . . . 0.0 111.885 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 95.4 m -98.83 92.89 5.77 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 176.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.327 0 CA-C-N 116.628 -0.26 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.417 -2.102 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -74.71 -22.42 77.13 Favored Glycine 0 C--N 1.311 -0.822 0 C-N-CA 121.56 -0.352 . . . . 0.0 112.82 -175.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.482 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 64.6 m -90.44 1.92 56.17 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.485 0.659 . . . . 0.0 111.241 -179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.6 m -114.48 41.28 2.35 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.057 0.932 . . . . 0.0 110.157 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -93.59 12.05 26.64 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.279 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 159.6 164.99 15.67 Favored Glycine 0 N--CA 1.432 -1.584 0 N-CA-C 110.044 -1.223 . . . . 0.0 110.044 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -59.54 -18.38 46.65 Favored 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.472 2.782 . . . . 0.0 115.287 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -104.12 13.72 31.87 Favored 'General case' 0 C--O 1.241 0.61 0 O-C-N 121.386 -0.821 . . . . 0.0 111.731 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.13 -39.53 52.87 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.298 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.422 ' HA ' ' HB3' ' A' ' 15' ' ' CYS . 74.0 m -97.21 34.04 1.84 Allowed 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.126 0.488 . . . . 0.0 111.373 -178.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.4 p -72.82 -36.9 67.62 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.6 0.714 . . . . 0.0 109.239 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -69.89 144.7 52.39 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.657 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -57.54 -44.67 85.33 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 123.991 0.916 . . . . 0.0 112.592 -176.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.0 t90 -62.96 -49.95 72.7 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.482 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 68.6 m -57.03 -41.07 77.95 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -60.97 -37.95 84.22 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.774 0.321 . . . . 0.0 111.019 178.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.24 -51.36 11.05 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 177.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 72.1 m-70 -88.88 -17.69 29.13 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 115.05 1.5 . . . . 0.0 115.05 -165.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.94 114.78 23.11 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 175.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 44.2 mtm180 -67.73 -24.44 65.37 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.348 0.594 . . . . 0.0 110.131 -176.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -71.39 -12.5 61.45 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.591 176.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.0 m -118.62 -94.26 0.5 Allowed 'General case' 0 N--CA 1.433 -1.325 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 176.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.381 0 O-C-N 121.86 -0.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.42 -1.93 0 CA-C-O 120.959 0.409 . . . . 0.0 110.536 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 102.79 -103.0 2.34 Favored Glycine 0 N--CA 1.419 -2.436 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.44 178.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.457 ' HB2' ' HB3' ' A' ' 15' ' ' CYS . 97.0 m -90.28 49.84 1.76 Allowed 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -173.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 61.0 m -117.2 11.96 14.27 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 122.53 1.157 . . . . 0.0 108.603 171.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -144.57 150.12 36.96 Favored 'General case' 0 N--CA 1.425 -1.691 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 136.02 -164.43 25.01 Favored Glycine 0 C--N 1.292 -1.881 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.34 -42.02 45.17 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.138 2.559 . . . . 0.0 113.46 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -134.45 17.49 3.66 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 120.558 0.218 . . . . 0.0 111.094 -178.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.31 -83.6 0.75 Allowed Glycine 0 N--CA 1.433 -1.526 0 N-CA-C 109.19 -1.564 . . . . 0.0 109.19 -174.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.8 m -101.3 64.12 1.01 Allowed 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.357 0.598 . . . . 0.0 109.515 177.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.2 t -78.04 -32.58 51.02 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -71.26 131.46 43.51 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -54.94 -46.68 74.99 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.256 1.022 . . . . 0.0 112.601 -173.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 91.3 t90 -55.71 -44.21 77.21 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.576 0.703 . . . . 0.0 110.664 178.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.457 ' HB3' ' HB2' ' A' ' 3' ' ' CYS . 60.7 m -67.26 -32.05 72.81 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.707 -176.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -64.71 -32.32 73.94 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -97.09 -20.52 17.95 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -114.9 -18.32 11.32 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 -170.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.13 158.74 31.43 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 118.727 0.694 . . . . 0.0 111.31 -177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -84.18 -37.95 21.24 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.4 p -69.78 -13.72 62.42 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.899 -1.046 . . . . 0.0 113.249 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 63.2 m -120.84 99.55 6.58 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.308 -1.226 0 CA-C-N 116.379 -0.373 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . 0.252 . . . . . . . 0 N--CA 1.432 -1.372 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -75.76 81.02 1.02 Allowed Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.778 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 75.1 m -76.35 -24.91 54.24 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 123.595 0.758 . . . . 0.0 112.533 -177.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 66.6 m -83.69 70.67 10.36 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-O 121.557 0.694 . . . . 0.0 111.037 -176.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 32.5 p-10 -149.28 13.19 0.85 Allowed 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.281 176.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -160.25 163.07 33.69 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.73 -15.63 37.3 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.38 2.72 . . . . 0.0 114.173 -176.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -102.62 1.9 35.32 Favored 'General case' 0 C--N 1.307 -1.253 0 O-C-N 122.088 -0.383 . . . . 0.0 110.225 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.46 -59.95 9.33 Favored Glycine 0 C--O 1.218 -0.897 0 O-C-N 123.717 0.635 . . . . 0.0 113.32 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.9 m -82.49 -3.14 55.32 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.528 0.68 . . . . 0.0 111.146 -177.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.8 m -87.45 -16.01 36.06 Favored 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.315 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.9 m -79.1 134.26 36.74 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.673 ' HE2' ' HA ' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -51.7 -55.28 20.47 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.914 0.886 . . . . 0.0 112.897 -175.093 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.8 t90 -62.0 -49.22 76.92 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -177.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.0 m -61.92 -35.2 77.67 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.47 -175.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -58.54 -38.95 78.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.86 0.362 . . . . 0.0 111.383 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -103.3 -27.15 12.64 Favored 'General case' 0 C--N 1.31 -1.124 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -175.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -102.9 -7.5 21.47 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -172.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.24 119.79 39.94 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 107.216 -1.401 . . . . 0.0 107.216 173.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -66.23 -19.69 65.9 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.982 -173.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 3.4 p -77.61 -4.06 44.02 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.958 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 73.7 m -105.05 85.75 2.33 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 121.403 0.621 . . . . 0.0 110.381 177.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.946 0 CA-C-N 116.148 -0.478 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.42 -1.963 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.56 -42.44 88.38 Favored Glycine 0 C--O 1.228 -0.256 0 N-CA-C 111.399 -0.68 . . . . 0.0 111.399 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 19' ' ' ALA . 70.6 m -90.52 19.85 5.0 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-O 121.04 0.447 . . . . 0.0 110.382 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.416 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 71.2 m -116.19 11.23 15.12 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.847 0.832 . . . . 0.0 109.658 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -101.06 116.7 33.45 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.436 -177.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 114.9 168.92 15.9 Favored Glycine 0 C--N 1.303 -1.302 0 C-N-CA 121.185 -0.531 . . . . 0.0 112.349 173.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -66.02 -18.03 56.25 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 123.283 2.655 . . . . 0.0 112.424 179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.545 ' HB3' ' HB3' ' A' ' 11' ' ' SER . 10.0 mtmp? -88.88 -60.26 2.01 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.69 -98.69 1.07 Allowed Glycine 0 N--CA 1.424 -2.124 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 79.6 m -90.56 77.25 6.47 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 121.977 0.894 . . . . 0.0 109.47 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.545 ' HB3' ' HB3' ' A' ' 8' ' ' LYS . 4.1 p -94.67 -27.1 16.04 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 114.253 -1.34 . . . . 0.0 109.002 175.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 t -90.06 134.67 34.11 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 174.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -63.79 -37.4 87.24 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 123.642 0.588 . . . . 0.0 111.551 -175.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 92.5 t90 -59.07 -41.25 87.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.392 0.615 . . . . 0.0 109.753 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.2 m -65.44 -29.41 70.09 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.718 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -71.38 -19.71 62.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.275 0.559 . . . . 0.0 110.876 -176.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -100.61 -13.26 18.65 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 62.0 m-70 -120.6 -22.92 6.2 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.679 1.362 . . . . 0.0 114.679 -171.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.503 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . . . -77.71 140.86 39.57 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -66.38 -17.31 64.7 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -176.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.3 p -87.45 -3.66 59.01 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 122.906 0.482 . . . . 0.0 111.101 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 70.9 m -133.61 95.01 3.39 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.39 0.614 . . . . 0.0 110.075 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.297 -1.696 0 CA-C-N 116.256 -0.429 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.418 -2.056 0 CA-C-O 121.002 0.43 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 126.15 82.07 0.43 Allowed Glycine 0 N--CA 1.425 -2.092 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.712 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 71.3 m -81.58 -28.75 33.67 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 122.173 0.987 . . . . 0.0 109.733 -178.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 73.1 m -84.51 73.14 10.57 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.022 175.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -120.42 2.44 10.76 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 114.16 -1.382 . . . . 0.0 108.96 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.49 -163.12 33.84 Favored Glycine 0 N--CA 1.421 -2.326 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.007 -177.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -86.62 4.9 6.12 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.286 2.657 . . . . 0.0 115.565 -174.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -123.99 5.96 8.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.542 0.61 . . . . 0.0 110.216 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.712 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -79.97 -33.52 32.98 Favored Glycine 0 C--O 1.214 -1.096 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.705 -175.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 67.0 m -92.6 21.92 5.08 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 121.328 0.585 . . . . 0.0 110.937 -178.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.6 t -76.1 -48.7 19.72 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -178.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.7 m -59.29 137.78 57.86 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.188 176.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -50.72 -48.01 58.98 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.155 0.982 . . . . 0.0 110.864 -178.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.7 t90 -56.43 -40.91 75.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.557 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.9 m -70.85 -32.44 69.46 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.526 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.1 ttt85 -72.85 -18.93 61.39 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 121.215 0.531 . . . . 0.0 110.877 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -98.99 -45.27 6.01 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.587 0.708 . . . . 0.0 111.144 176.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 34.1 m-70 -89.88 -23.51 21.62 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -168.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.84 126.68 30.96 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 177.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 20' ' ' ARG . 52.5 mtp180 -72.47 -16.18 61.8 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.509 0.671 . . . . 0.0 110.948 -174.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -94.82 0.12 54.59 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 114.755 -1.112 . . . . 0.0 111.314 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 84.4 m -141.14 -86.06 0.18 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.296 -1.741 0 O-C-N 121.747 -0.595 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . 0.708 ' HB2' ' HB2' ' A' ' 19' ' ' ALA . . . . . . . . 0 N--CA 1.416 -2.132 0 CA-C-O 120.791 0.329 . . . . 0.0 110.128 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -94.45 67.87 1.36 Allowed Glycine 0 N--CA 1.434 -1.446 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 89.9 m -128.82 1.25 5.4 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 58.5 m -113.28 17.18 18.77 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.18 0.99 . . . . 0.0 108.751 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -89.81 -22.11 22.27 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.59 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.69 154.79 26.05 Favored Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.72 -28.94 82.72 Favored 'Trans proline' 0 C--O 1.244 0.812 0 C-N-CA 123.224 2.616 . . . . 0.0 113.597 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -90.27 -1.72 57.95 Favored 'General case' 0 N--CA 1.438 -1.039 0 O-C-N 121.866 -0.521 . . . . 0.0 111.345 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.05 -42.04 78.79 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.3 m -72.26 12.73 0.4 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.6 m -82.69 -22.53 34.5 Favored 'General case' 0 N--CA 1.436 -1.162 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 m -72.81 123.08 22.65 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -62.59 -33.78 75.67 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.243 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -60.4 -36.71 78.76 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.758 0.79 . . . . 0.0 109.435 178.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 91.7 m -80.11 -11.86 59.72 Favored 'General case' 0 C--O 1.2 -1.528 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.262 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -77.71 -32.98 53.25 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -90.9 -34.48 15.21 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.26 178.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -93.12 -38.81 11.39 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -175.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.708 ' HB2' ' HB2' ' A' ' 1' ' ' PCA . . . -91.76 107.08 18.96 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.43 ' HA ' ' HD3' ' A' ' 20' ' ' ARG . 23.4 mmt180 -78.45 3.72 15.11 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.852 0.834 . . . . 0.0 111.905 -176.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 p -89.63 -9.32 50.08 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.261 171.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 80.6 m -99.66 88.82 3.93 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-O 121.172 0.51 . . . . 0.0 110.119 176.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.379 0 O-C-N 122.159 -0.338 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.419 -1.988 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.59 -46.98 44.25 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.991 -0.624 . . . . 0.0 112.732 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.57 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 55.7 m -93.66 -51.96 4.68 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 122.156 0.979 . . . . 0.0 110.361 -177.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 58.9 m -90.44 72.2 6.98 Favored 'General case' 0 C--N 1.268 -2.964 0 CA-C-N 114.92 -1.036 . . . . 0.0 112.63 -173.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -147.54 12.51 1.03 Allowed 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 122.274 1.035 . . . . 0.0 108.234 173.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.44 164.79 35.81 Favored Glycine 0 N--CA 1.434 -1.478 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 -178.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -69.79 -20.51 34.6 Favored 'Trans proline' 0 C--O 1.223 -0.246 0 C-N-CA 122.944 2.429 . . . . 0.0 113.855 -176.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -112.62 33.98 4.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.977 0.418 . . . . 0.0 111.158 -177.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.57 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -92.75 -7.41 62.97 Favored Glycine 0 N--CA 1.438 -1.185 0 C-N-CA 120.447 -0.883 . . . . 0.0 113.745 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.5 m -115.71 24.84 11.21 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 117.651 0.725 . . . . 0.0 111.588 -176.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 p -84.13 -14.72 49.54 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.866 -177.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.1 p -98.24 153.41 18.51 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 121.025 0.44 . . . . 0.0 111.444 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -62.4 -40.14 95.55 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.242 177.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 71.4 t90 -59.49 -50.95 71.93 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.635 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.402 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 81.5 m -68.58 -37.9 80.23 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.197 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -64.3 -39.64 94.33 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.955 0.407 . . . . 0.0 111.433 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.15 -47.99 12.72 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -176.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -93.44 -12.14 30.48 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -168.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.421 ' HB1' ' SG ' ' A' ' 21' ' ' CYS . . . -111.0 124.19 51.67 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 176.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -76.83 -20.36 56.45 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.86 0.362 . . . . 0.0 110.977 -177.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.421 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 5.9 p -66.79 -20.75 66.01 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.999 173.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.4 m -97.85 -82.48 0.42 Allowed 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.147 0 O-C-N 122.039 -0.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . 0.282 . . . . . . . 0 N--CA 1.426 -1.64 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -103.61 69.38 0.29 Allowed Glycine 0 N--CA 1.429 -1.809 0 CA-C-N 115.969 -0.56 . . . . 0.0 113.224 -174.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 62.1 m -105.36 -13.8 15.54 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.595 0.712 . . . . 0.0 110.212 176.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 38.9 m -93.95 -18.84 21.49 Favored 'General case' 0 C--N 1.292 -1.907 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.439 -177.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -97.22 79.75 2.85 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 122.623 1.202 . . . . 0.0 111.405 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 149.52 145.23 4.09 Favored Glycine 0 N--CA 1.432 -1.624 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.843 176.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -59.97 -35.63 92.61 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.035 2.49 . . . . 0.0 111.968 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -96.97 17.88 15.93 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.358 -178.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -67.15 -32.12 79.4 Favored Glycine 0 N--CA 1.433 -1.563 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 50.7 m -93.96 15.67 16.27 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 122.846 0.458 . . . . 0.0 111.897 -176.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.5 m -66.14 -44.59 83.76 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.735 0.302 . . . . 0.0 111.05 -177.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.1 m -74.66 134.38 42.01 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.7 -32.78 70.84 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 123.008 0.193 . . . . 0.0 110.86 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -55.13 -49.64 71.28 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 176.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 98.9 m -64.57 -43.2 94.66 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.259 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -65.65 -41.01 93.07 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 120.984 0.421 . . . . 0.0 111.81 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -78.58 -46.19 19.94 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.104 -176.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -92.03 -24.76 19.09 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -170.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 15' ' ' CYS . . . -95.88 113.61 25.25 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 175.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -77.35 4.15 11.48 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 124.469 1.108 . . . . 0.0 111.931 -172.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.9 p -83.49 -20.13 34.52 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 173.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.8 m -93.73 -78.62 0.43 Allowed 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.504 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.942 0 O-C-N 122.098 -0.376 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.413 -2.3 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 83.58 -59.99 4.91 Favored Glycine 0 C--N 1.304 -1.195 0 CA-C-N 116.023 -0.535 . . . . 0.0 113.455 176.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 70.2 m -126.83 17.97 7.32 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -174.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.53 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 70.8 m -106.02 24.8 11.81 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 122.548 1.166 . . . . 0.0 108.689 -177.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.3 p-10 -88.89 -15.26 34.85 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.756 -1.565 . . . . 0.0 109.716 -178.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -169.03 165.83 39.23 Favored Glycine 0 N--CA 1.431 -1.635 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -62.93 -27.21 74.47 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 123.163 2.575 . . . . 0.0 112.991 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.453 ' HA ' ' HB2' ' A' ' 11' ' ' SER . 53.2 mtpt -89.44 -11.94 41.63 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.732 -179.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.92 -46.29 91.92 Favored Glycine 0 CA--C 1.499 -0.918 0 N-CA-C 107.814 -2.115 . . . . 0.0 107.814 172.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.2 m -79.33 0.33 29.39 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.649 -0.776 . . . . 0.0 112.425 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.453 ' HB2' ' HA ' ' A' ' 8' ' ' LYS . 22.1 t -76.64 -33.08 58.35 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.177 0.513 . . . . 0.0 109.851 -178.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.6 m -75.28 130.32 38.89 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 178.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -50.64 -45.64 57.88 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.37 1.068 . . . . 0.0 112.245 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 88.0 t90 -53.22 -46.65 69.17 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.603 0.716 . . . . 0.0 110.174 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 91.0 m -69.47 -43.76 72.58 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.962 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -61.77 -31.88 72.12 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.591 0.71 . . . . 0.0 110.461 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.01 -41.32 51.39 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.834 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -94.03 -37.07 11.83 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -174.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.53 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -86.81 113.75 22.89 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -88.07 -3.63 58.87 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.802 -174.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.4 p -88.58 5.8 41.12 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.575 175.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 84.3 m -92.29 -84.06 0.28 Allowed 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.808 176.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.572 0 O-C-N 122.268 -0.27 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.415 -2.184 0 CA-C-O 121.159 0.504 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -126.52 116.15 2.45 Favored Glycine 0 N--CA 1.421 -2.312 0 N-CA-C 107.479 -2.248 . . . . 0.0 107.479 176.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 22.3 m -98.45 -44.67 6.41 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-O 122.156 0.979 . . . . 0.0 111.02 -174.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.6 m -92.78 25.21 3.23 Favored 'General case' 0 C--N 1.273 -2.742 0 CA-C-N 114.583 -1.189 . . . . 0.0 112.004 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 35.7 p30 -89.32 -11.61 42.89 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 153.88 -174.03 32.45 Favored Glycine 0 N--CA 1.425 -2.035 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.96 -23.37 72.58 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.523 2.815 . . . . 0.0 113.288 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -89.04 -5.4 57.92 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 122.138 -0.351 . . . . 0.0 111.169 -177.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -82.27 -25.0 53.07 Favored Glycine 0 N--CA 1.435 -1.388 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.119 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.3 m -86.77 20.6 2.5 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 123.535 0.734 . . . . 0.0 111.062 -178.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.6 p -69.86 -33.14 71.86 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.643 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.1 p -83.97 159.94 21.14 Favored 'General case' 0 C--O 1.253 1.283 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -72.51 -34.62 67.76 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.1 t90 -55.37 -55.22 34.09 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.262 179.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.448 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.1 m -65.42 -41.52 93.46 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.912 179.451 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -65.33 -28.08 69.05 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.777 0.322 . . . . 0.0 111.724 -177.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -91.89 -44.82 8.7 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 120.872 0.368 . . . . 0.0 111.677 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 65.7 m-70 -92.48 -19.33 22.11 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -171.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.516 ' HB1' ' SG ' ' A' ' 21' ' ' CYS . . . -99.53 139.22 35.51 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-O 121.321 0.582 . . . . 0.0 109.934 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -90.64 -4.49 56.76 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 121.857 0.837 . . . . 0.0 110.105 -175.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.516 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 9.2 p -86.52 3.82 42.51 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.571 177.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.1 m -115.03 98.55 6.87 Favored 'General case' 0 N--CA 1.421 -1.894 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.472 0 CA-C-N 116.595 -0.275 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.417 -2.117 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -68.35 -11.97 62.73 Favored Glycine 0 CA--C 1.509 -0.306 0 O-C-N 123.134 0.271 . . . . 0.0 113.086 -178.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.526 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 30.6 m -65.2 -26.59 68.2 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-O 121.427 0.632 . . . . 0.0 111.877 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.4 m -95.93 9.3 41.09 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-O 121.535 0.683 . . . . 0.0 110.939 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -108.13 15.9 23.8 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.818 0.818 . . . . 0.0 108.926 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -145.48 148.5 20.27 Favored Glycine 0 N--CA 1.429 -1.769 0 CA-C-O 118.755 -1.025 . . . . 0.0 110.542 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -52.04 -41.89 61.84 Favored 'Trans proline' 0 C--O 1.245 0.843 0 C-N-CA 123.162 2.575 . . . . 0.0 112.298 177.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.7 mttp -122.66 74.57 1.2 Allowed 'General case' 0 N--CA 1.433 -1.307 0 CA-C-O 121.469 0.652 . . . . 0.0 110.81 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.526 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -102.35 -52.37 1.0 Allowed Glycine 0 N--CA 1.432 -1.572 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 173.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.535 ' HA ' ' HB2' ' A' ' 15' ' ' CYS . 75.9 m -81.92 15.35 2.3 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.194 0.521 . . . . 0.0 111.903 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.1 p -71.99 -27.86 63.03 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-O 121.926 0.869 . . . . 0.0 109.068 175.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.6 t -86.52 138.59 31.6 Favored 'General case' 0 N--CA 1.418 -2.025 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -59.55 -24.22 63.53 Favored 'General case' 0 C--N 1.315 -0.923 0 O-C-N 123.621 0.576 . . . . 0.0 111.675 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -64.39 -54.31 34.78 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.535 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 97.5 m -68.9 -36.89 78.57 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.032 178.396 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.9 ttt180 -60.18 -33.02 71.63 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 120.83 0.348 . . . . 0.0 110.541 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -92.1 -49.73 6.05 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.654 -0.418 . . . . 0.0 112.071 179.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -89.95 -11.51 41.5 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -167.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.45 142.33 35.98 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 119.286 -0.965 . . . . 0.0 108.54 176.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -84.45 -21.82 30.56 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 -177.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.6 p -81.86 -16.85 49.37 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.258 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.1 m -116.37 -79.53 0.59 Allowed 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 176.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.14 0 O-C-N 122.255 -0.278 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.417 -2.121 0 N-CA-C 110.129 -0.322 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 89.62 -72.65 2.11 Favored Glycine 0 N--CA 1.433 -1.536 0 CA-C-N 115.929 -0.578 . . . . 0.0 113.286 174.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.455 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 58.3 m -98.12 -1.87 41.31 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-O 121.367 0.604 . . . . 0.0 111.667 -173.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.5 m -95.65 13.05 27.6 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-O 121.156 0.503 . . . . 0.0 112.238 -170.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -90.05 -11.34 41.74 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.959 0.409 . . . . 0.0 111.505 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -154.33 162.66 30.74 Favored Glycine 0 N--CA 1.433 -1.554 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.332 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -69.22 -13.21 35.63 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.966 2.444 . . . . 0.0 113.192 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -87.23 -28.3 22.45 Favored 'General case' 0 C--O 1.244 0.815 0 O-C-N 121.876 -0.515 . . . . 0.0 109.841 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -61.37 -51.96 54.6 Favored Glycine 0 N--CA 1.432 -1.588 0 N-CA-C 110.009 -1.236 . . . . 0.0 110.009 175.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.3 m -75.38 -9.95 59.02 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.3 t -80.95 -19.75 43.49 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 m -76.5 126.66 31.37 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 176.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -56.74 -37.82 71.54 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -174.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 91.1 t90 -62.27 -43.73 98.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.451 0.643 . . . . 0.0 109.326 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 62.2 m -73.99 -38.08 64.23 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.035 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -60.56 -36.21 77.93 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.132 0.492 . . . . 0.0 110.573 176.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -81.14 -52.67 7.12 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.273 -178.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -94.54 -32.4 13.48 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -169.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.32 120.92 23.02 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.5 mmm180 -78.84 -9.5 59.49 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.118 -170.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.6 p -97.87 3.99 49.69 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 121.764 0.792 . . . . 0.0 110.203 174.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 86.9 m -111.9 -76.69 0.59 Allowed 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.634 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.28 0 O-C-N 121.991 -0.443 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.42 -1.933 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 82.11 -55.38 4.93 Favored Glycine 0 C--N 1.306 -1.091 0 N-CA-C 114.431 0.532 . . . . 0.0 114.431 175.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 78.5 m -51.7 -42.67 62.38 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -173.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 46.8 m -98.54 4.56 48.2 Favored 'General case' 0 C--N 1.271 -2.837 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.664 -175.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -102.58 13.95 33.2 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 121.347 0.594 . . . . 0.0 110.671 -179.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.403 ' HA2' ' HD3' ' A' ' 7' ' ' PRO . . . -164.76 147.06 12.0 Favored Glycine 0 N--CA 1.426 -1.972 0 C-N-CA 120.144 -1.026 . . . . 0.0 111.44 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.403 ' HD3' ' HA2' ' A' ' 6' ' ' GLY . 33.3 Cg_exo -60.69 -27.95 85.69 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.219 2.612 . . . . 0.0 113.104 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -88.71 -1.89 58.31 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 122.104 -0.373 . . . . 0.0 110.195 -178.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -70.07 -69.18 1.44 Allowed Glycine 0 N--CA 1.439 -1.142 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.263 -178.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.5 m -80.84 10.74 4.59 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.4 t -69.86 -38.8 76.55 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 171.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.0 m -68.28 130.39 42.77 Favored 'General case' 0 N--CA 1.426 -1.669 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -60.62 -31.03 70.23 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 123.07 0.548 . . . . 0.0 111.22 -175.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -61.81 -48.4 80.75 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 176.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 54.2 m -70.27 -23.69 62.93 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 116.116 -0.493 . . . . 0.0 112.303 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -70.49 -42.77 70.94 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 120.019 -0.672 . . . . 0.0 110.432 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -87.81 -43.72 11.64 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -89.03 5.06 46.1 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -168.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -116.47 114.71 24.59 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 173.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -64.78 -22.51 67.0 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.71 -173.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.2 p -74.88 -13.52 60.56 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 82.9 m -109.05 87.65 2.54 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.28 0.562 . . . . 0.0 110.546 176.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.313 -1.007 0 CA-C-N 116.303 -0.408 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.604 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -90.75 53.21 3.34 Favored Glycine 0 C--O 1.241 0.533 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HA ' ' HA3' ' A' ' 9' ' ' GLY . 2.6 m -73.9 -14.41 61.06 Favored 'General case' 0 C--N 1.306 -1.303 0 C-N-CA 123.66 0.784 . . . . 0.0 112.472 -171.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.445 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 60.6 m -105.86 -11.85 16.07 Favored 'General case' 0 C--N 1.285 -2.216 0 CA-C-O 121.468 0.651 . . . . 0.0 110.787 -176.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -91.99 -34.17 14.55 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.637 0.732 . . . . 0.0 109.516 179.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.406 ' HA2' ' HD3' ' A' ' 7' ' ' PRO . . . -96.18 132.07 10.9 Favored Glycine 0 N--CA 1.433 -1.556 0 N-CA-C 109.031 -1.627 . . . . 0.0 109.031 179.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.406 ' HD3' ' HA2' ' A' ' 6' ' ' GLY . 49.0 Cg_exo -54.73 -36.02 89.19 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.875 2.384 . . . . 0.0 114.359 -176.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -105.22 27.95 7.76 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.09 0.472 . . . . 0.0 110.381 178.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.535 ' HA3' ' HA ' ' A' ' 3' ' ' CYS . . . -60.72 -36.16 91.19 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.896 -179.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.2 m -84.79 28.32 0.69 Allowed 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 117.119 0.46 . . . . 0.0 112.096 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.5 t -72.76 -34.97 67.34 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.7 p -80.37 150.58 29.81 Favored 'General case' 0 C--O 1.259 1.565 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.174 178.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.759 ' HE2' ' HA ' ' A' ' 13' ' ' LYS . 0.6 OUTLIER -58.61 -40.09 82.29 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.064 -179.914 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -57.74 -56.93 15.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 123.991 0.807 . . . . 0.0 109.965 177.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.501 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 78.6 m -61.57 -38.75 88.65 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -177.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -65.5 -23.16 66.82 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.481 -0.488 . . . . 0.0 111.396 -177.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -102.22 -49.33 3.93 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 120.971 0.415 . . . . 0.0 111.903 -178.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -89.43 -24.88 21.77 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -168.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.445 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -70.83 136.04 48.47 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -70.55 -11.85 61.19 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -170.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.0 p -84.55 -18.67 34.93 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.186 0.517 . . . . 0.0 110.381 176.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.9 m -124.73 -81.97 0.64 Allowed 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -177.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.473 0 O-C-N 121.971 -0.456 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.424 -1.725 0 CA-C-O 121.01 0.433 . . . . 0.0 110.439 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -82.24 55.1 4.93 Favored Glycine 0 C--O 1.237 0.338 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 176.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 35.3 m -78.33 -21.93 48.84 Favored 'General case' 0 C--N 1.299 -1.629 0 C-N-CA 123.815 0.846 . . . . 0.0 111.065 -174.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 50.0 m -104.71 17.06 24.83 Favored 'General case' 0 C--N 1.279 -2.496 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.089 -176.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -89.43 0.22 57.01 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.442 0.639 . . . . 0.0 110.495 -176.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 157.71 177.32 30.71 Favored Glycine 0 N--CA 1.433 -1.515 0 C-N-CA 120.512 -0.851 . . . . 0.0 111.624 178.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -52.82 -35.46 69.9 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.857 3.038 . . . . 0.0 113.313 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -89.03 17.92 5.37 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.088 0.47 . . . . 0.0 110.985 -177.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -91.79 -28.77 13.12 Favored Glycine 0 N--CA 1.414 -2.772 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 171.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 70.1 m -95.86 11.86 32.22 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 123.234 0.613 . . . . 0.0 111.67 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.4 p -74.46 -28.71 61.15 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 123.394 0.677 . . . . 0.0 111.348 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.5 p -88.11 141.26 28.71 Favored 'General case' 0 N--CA 1.424 -1.757 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.889 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -61.14 -35.18 76.37 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -54.38 -52.55 61.31 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.971 177.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 82.8 m -70.15 -34.96 73.68 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.695 177.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -61.61 -37.07 82.6 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.318 0.58 . . . . 0.0 109.739 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -78.09 -44.23 26.8 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.451 179.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -89.48 -34.49 16.41 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -170.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.487 ' HB1' ' SG ' ' A' ' 21' ' ' CYS . . . -92.84 122.77 35.56 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-O 121.417 0.627 . . . . 0.0 111.077 -175.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -82.42 -3.94 56.52 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.55 0.69 . . . . 0.0 110.312 -178.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.487 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 27.6 p -79.4 -9.28 59.56 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.46 -0.791 . . . . 0.0 108.954 173.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 62.7 m -104.4 90.74 3.64 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.136 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.377 0 CA-C-N 116.554 -0.294 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -1.708 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 112.55 -14.35 24.98 Favored Glycine 0 N--CA 1.446 -0.688 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.656 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.576 ' O ' ' HA3' ' A' ' 9' ' ' GLY . 30.5 m -75.99 -17.36 59.73 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-O 121.439 0.638 . . . . 0.0 112.365 -174.067 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.649 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 81.4 m -84.61 -10.69 57.12 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.356 179.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -101.03 0.6 38.35 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -175.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.39 147.11 18.26 Favored Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -178.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -58.56 -41.59 63.05 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 123.392 2.728 . . . . 0.0 114.127 -177.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.426 ' HD3' ' HA ' ' A' ' 8' ' ' LYS . 73.3 mmtt -111.92 27.89 9.25 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.913 0.387 . . . . 0.0 110.25 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.576 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -58.2 -37.95 88.3 Favored Glycine 0 C--O 1.22 -0.725 0 CA-C-N 115.109 -0.95 . . . . 0.0 113.342 -178.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 82.6 m -80.05 -3.18 47.48 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.7 t -85.34 66.39 9.68 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-O 122.135 0.969 . . . . 0.0 108.712 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.0 t -174.33 138.94 0.58 Allowed 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.661 1.585 . . . . 0.0 106.842 -178.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -71.89 -34.96 69.58 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -178.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 86.8 t90 -60.7 -43.82 97.31 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.764 0.792 . . . . 0.0 109.216 178.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.2 m -71.62 -37.7 70.87 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.618 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.512 ' HA ' ' CB ' ' A' ' 22' ' ' CYS . 1.7 tmt_? -64.71 -36.89 85.73 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -68.68 -42.45 77.8 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.866 179.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -98.23 -44.03 6.74 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 -172.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.649 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -75.85 131.98 40.06 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.318 0.58 . . . . 0.0 111.521 -172.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -74.09 -12.26 60.55 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.225 -174.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 20.2 p -89.03 -10.48 47.35 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.572 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.512 ' CB ' ' HA ' ' A' ' 16' ' ' ARG . 59.8 m -98.33 91.89 5.43 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.024 0.44 . . . . 0.0 110.931 -175.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.326 0 O-C-N 122.279 -0.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -1.796 0 CA-C-O 120.931 0.396 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -123.69 68.42 0.48 Allowed Glycine 0 N--CA 1.429 -1.811 0 N-CA-C 109.214 -1.555 . . . . 0.0 109.214 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.494 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 57.1 m -101.12 -45.13 5.48 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 121.927 0.87 . . . . 0.0 110.11 -177.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.466 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 73.5 m -97.05 24.84 5.88 Favored 'General case' 0 C--N 1.275 -2.651 0 CA-C-N 114.671 -1.149 . . . . 0.0 111.225 -177.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.4 p-10 -89.72 -11.2 42.99 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-O 121.195 0.521 . . . . 0.0 110.132 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 151.07 -164.1 29.95 Favored Glycine 0 N--CA 1.424 -2.163 0 C-N-CA 120.417 -0.897 . . . . 0.0 111.846 178.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -60.96 -15.3 37.93 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.97 3.114 . . . . 0.0 114.997 -175.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -89.1 -11.78 43.02 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.431 ' HA3' ' O ' ' A' ' 3' ' ' CYS . . . -77.35 -50.32 6.78 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 119.982 -1.104 . . . . 0.0 111.775 -178.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -67.27 -2.65 6.27 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.2 m -71.12 -30.26 66.28 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-O 120.674 0.273 . . . . 0.0 110.86 178.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.4 t -83.98 137.09 33.8 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 176.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -60.91 -32.87 72.34 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.875 0.734 . . . . 0.0 109.675 178.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -61.94 -53.49 54.95 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.184 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.494 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 96.2 m -66.46 -39.31 88.75 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.598 178.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -60.28 -33.32 72.17 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 122.736 0.414 . . . . 0.0 111.252 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -86.91 -38.25 16.88 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.844 0.354 . . . . 0.0 111.729 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -92.71 -26.3 17.83 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -172.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.466 ' HB1' ' SG ' ' A' ' 4' ' ' CYS . . . -96.75 138.46 34.28 Favored 'General case' 0 C--N 1.295 -1.789 0 C-N-CA 120.426 -0.509 . . . . 0.0 110.731 -177.327 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -88.04 0.97 55.3 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-O 121.105 0.479 . . . . 0.0 111.532 -177.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.42 ' SG ' ' HB1' ' A' ' 19' ' ' ALA . 8.3 p -83.06 -13.24 56.18 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-O 121.73 0.776 . . . . 0.0 109.107 174.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 61.3 m -101.67 88.24 3.36 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.879 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.16 0 CA-C-N 116.092 -0.503 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_