data_1xf7_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 1xf7 _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 2' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo . . . . . 0 N--CA 1.493 1.462 0 CA-C-O 121.659 0.608 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -124.46 156.9 36.42 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 113.378 -1.737 . . . . 0.0 108.551 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 71.8 tp60 -133.42 145.19 50.05 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 124.572 1.17 . . . . 0.0 108.481 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.421 ' HA ' HD13 ' A' ' 18' ' ' LEU . 41.6 t -91.29 133.12 35.68 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 104.25 -2.5 . . . . 0.0 104.25 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.52 34.87 2.45 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 124.412 1.07 . . . . 0.0 108.226 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.402 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 34.2 m -128.33 -40.74 1.61 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 113.744 -1.571 . . . . 0.0 109.058 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.4 p -123.37 -41.85 2.27 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.482 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 102.39 64.43 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.16 0 O-C-N 126.452 2.345 . . . . 0.0 109.951 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -120.85 152.75 38.02 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 103.578 -2.749 . . . . 0.0 103.578 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -111.91 163.23 14.46 Favored 'General case' 0 N--CA 1.503 2.176 0 C-N-CA 118.668 -1.213 . . . . 0.0 112.382 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.46 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 92.9 m-85 -142.12 176.86 8.64 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 125.079 1.487 . . . . 0.0 109.079 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.8 p -107.52 -25.76 11.23 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 124.373 1.046 . . . . 0.0 111.273 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.561 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 64.6 mtt85 -123.94 164.67 18.83 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 123.88 0.737 . . . . 0.0 110.24 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.9 p -78.59 -33.63 47.41 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -70.66 -32.82 70.24 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 106.411 -1.699 . . . . 0.0 106.411 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.561 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 29.7 m170 -66.16 -62.16 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 105.532 -2.025 . . . . 0.0 105.532 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 5' ' ' CYS . 43.5 tp -40.53 -56.18 2.13 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 124.34 1.025 . . . . 0.0 110.416 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -51.16 -64.85 0.68 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.247 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.1 m -41.96 -42.53 2.83 Favored 'General case' 0 N--CA 1.504 2.258 0 CA-C-O 121.734 0.778 . . . . 0.0 111.138 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.46 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 40.5 t60 -67.99 -58.01 5.23 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 113.648 -1.615 . . . . 0.0 113.748 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.438 ' C ' ' H ' ' A' ' 24' ' ' THR . 11.9 m -52.1 -38.51 57.55 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.172 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -71.6 24.31 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 117.804 -1.558 . . . . 0.0 114.563 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.438 ' H ' ' C ' ' A' ' 22' ' ' THR . 5.2 t -113.48 -3.72 13.66 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 . . . . . 0 N--CA 1.49 1.574 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.489 179.95 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo . . . . . 0 N--CA 1.48 0.692 0 CA-C-O 122.083 0.785 . . . . 0.0 111.598 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -123.49 160.99 25.75 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 112.805 -1.998 . . . . 0.0 106.355 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -137.31 153.03 50.36 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.507 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.45 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 36.0 t -97.69 133.8 41.73 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -99.19 38.55 1.39 Allowed 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.45 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 39.4 m -131.78 -42.62 1.01 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 113.858 -1.519 . . . . 0.0 109.744 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.0 p -121.4 -26.66 4.96 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 123.872 0.732 . . . . 0.0 111.139 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.2 mm-40 85.17 51.04 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.198 0 O-C-N 125.36 1.663 . . . . 0.0 109.8 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.9 ttt-85 -110.49 156.71 20.49 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 103.189 -2.893 . . . . 0.0 103.189 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -119.13 163.56 16.85 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 119.074 -1.05 . . . . 0.0 112.389 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.441 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 86.5 m-85 -137.65 -174.95 3.91 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 113.793 -1.549 . . . . 0.0 110.054 -179.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.8 p -106.47 -41.84 5.18 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 124.419 1.075 . . . . 0.0 111.559 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.482 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 7.7 mtt180 -113.47 175.96 5.23 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 124.18 0.925 . . . . 0.0 110.114 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.7 p -87.82 -38.28 15.84 Favored 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.036 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -66.57 -29.89 70.06 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.482 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 49.4 m170 -65.07 -59.03 4.57 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.9 tp -45.25 -53.47 8.28 Favored 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -48.68 -61.21 2.15 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.1 m -43.57 -43.76 5.78 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.441 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 72.5 t60 -66.46 -53.32 36.71 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 114.884 -1.053 . . . . 0.0 113.015 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 82.8 p -44.0 -28.93 0.52 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 119.682 1.128 . . . . 0.0 110.604 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.409 ' HD2' ' N ' ' A' ' 23' ' ' ARG . 2.1 mpt_? -80.91 44.9 0.78 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 122.958 1.361 . . . . 0.0 113.715 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 29.8 p -131.3 -26.28 2.11 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 63.3 m-70 . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 103.774 -2.676 . . . . 0.0 103.774 179.93 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo . . . . . 0 N--CA 1.489 1.25 0 N-CA-C 109.72 -0.916 . . . . 0.0 109.72 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.46 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 93.9 m-85 -114.76 143.59 44.83 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 101.908 -3.367 . . . . 0.0 101.908 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -128.54 154.89 45.69 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 119.837 -0.745 . . . . 0.0 111.35 -179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 8.2 t -101.02 136.44 40.86 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 103.572 -2.751 . . . . 0.0 103.572 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.9 mmmm -100.55 41.48 1.17 Allowed 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 122.163 0.982 . . . . 0.0 109.253 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.48 HG23 ' CG ' ' A' ' 25' ' ' HIS . 46.0 m -135.92 -48.38 0.67 Allowed 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.138 -1.846 . . . . 0.0 110.262 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 32.0 p -123.64 -16.81 6.62 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 124.257 0.973 . . . . 0.0 110.006 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 69.7 64.31 0.25 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 124.059 1.885 . . . . 0.0 109.764 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.408 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 28.5 ttt180 -116.1 120.06 37.82 Favored 'General case' 0 C--N 1.304 -1.386 1 N-CA-C 100.019 -4.067 . . . . 0.0 100.019 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.455 ' HD2' ' H ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -93.71 165.49 12.68 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 118.959 -1.096 . . . . 0.0 111.014 -179.662 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -136.48 174.29 10.77 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 113.628 -1.624 . . . . 0.0 109.737 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.4 p -96.85 -39.26 9.5 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 124.926 1.391 . . . . 0.0 107.896 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.437 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 5.5 mtt-85 -111.5 -179.18 3.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 124.921 1.388 . . . . 0.0 108.357 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.46 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 91.4 p -99.28 -21.92 15.84 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.871 -1.513 . . . . 0.0 107.843 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -91.39 26.85 2.12 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 122.419 1.104 . . . . 0.0 108.388 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.437 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 49.1 m170 -125.36 -40.18 2.13 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.6 tp -75.13 -52.0 12.06 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 106.387 -1.709 . . . . 0.0 106.387 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -68.34 -15.75 63.68 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.259 0.349 . . . . 0.0 110.363 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 84.8 m -95.82 -9.01 32.69 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 43.2 t60 -97.35 -55.72 2.75 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.17 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.48 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.3 p -44.02 -21.13 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.081 1.353 . . . . 0.0 113.542 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 20.7 ptt85 -77.07 27.2 0.14 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 124.089 0.868 . . . . 0.0 111.518 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.48 ' H ' ' C ' ' A' ' 22' ' ' THR . 8.9 t -117.08 -22.39 8.42 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.48 ' CG ' HG23 ' A' ' 7' ' ' THR . 66.0 m-70 . . . . . 0 N--CA 1.489 1.516 0 CA-C-N 113.882 -1.508 . . . . 0.0 107.525 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo . . . . . 0 N--CA 1.489 1.226 0 CA-C-O 121.853 0.689 . . . . 0.0 111.857 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.422 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 51.0 m-85 -132.0 112.29 12.26 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 112.458 -2.155 . . . . 0.0 106.386 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -108.39 157.49 18.36 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.492 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 38.0 t -97.07 112.82 24.42 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 103.753 -2.684 . . . . 0.0 103.753 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.1 29.42 0.83 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 124.472 1.108 . . . . 0.0 109.513 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.492 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.7 m -115.34 -41.9 3.23 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 113.597 -1.638 . . . . 0.0 108.518 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.9 p -119.27 -34.62 3.79 Favored 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.592 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 97.2 58.66 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.347 0 O-C-N 126.096 2.122 . . . . 0.0 109.978 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.439 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 48.3 ttt180 -118.94 146.54 44.88 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -112.91 162.51 15.74 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.588 -0.845 . . . . 0.0 112.45 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -138.94 179.61 6.39 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-N 113.219 -1.81 . . . . 0.0 109.51 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.447 ' HG ' HH11 ' A' ' 14' ' ' ARG . 88.6 p -102.44 -33.82 9.39 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 124.379 1.049 . . . . 0.0 108.969 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.536 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.0 mtt85 -119.41 171.66 8.17 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.587 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.422 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 94.3 p -85.16 -35.38 21.74 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.71 -39.77 94.21 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 104.209 -2.515 . . . . 0.0 104.209 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.536 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 37.7 m170 -56.39 -60.15 3.94 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.7 tp -42.82 -56.4 3.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 124.109 0.881 . . . . 0.0 109.74 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -48.57 -60.98 2.27 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.441 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.4 m -41.0 -46.09 2.76 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.712 0.768 . . . . 0.0 110.62 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.439 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 57.2 t60 -66.94 -55.36 14.94 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.668 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.2 p -45.51 -25.64 0.47 Allowed 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 48.8 mtt180 -52.87 -18.05 1.71 Allowed 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.0 t -87.02 -4.68 59.19 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 . . . . . 0 N--CA 1.494 1.727 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.987 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo . . . . . 0 N--CA 1.491 1.36 0 CA-C-O 121.637 0.599 . . . . 0.0 111.327 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.444 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 88.6 m-85 -122.46 152.61 40.1 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 105.176 -2.157 . . . . 0.0 105.176 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -140.2 154.17 46.83 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.496 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.554 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 40.2 t -98.44 117.23 32.38 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -92.26 37.56 0.99 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.554 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 57.2 m -123.39 -43.9 2.16 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 113.339 -1.755 . . . . 0.0 107.31 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 p -118.33 -36.86 3.45 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 123.921 0.763 . . . . 0.0 111.019 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 99.41 55.77 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 126.269 2.23 . . . . 0.0 109.079 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.0 157.42 18.69 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 103.225 -2.88 . . . . 0.0 103.225 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -120.34 158.47 27.05 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.812 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -138.31 171.53 14.25 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.888 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.4 p -96.67 -36.73 10.6 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.108 -1.86 . . . . 0.0 108.273 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.549 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 60.5 mtt85 -116.1 175.99 5.3 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 124.708 1.255 . . . . 0.0 110.96 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.444 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 90.1 p -95.38 -34.25 12.19 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 113.474 -1.694 . . . . 0.0 106.542 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.78 -38.28 90.44 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 104.659 -2.349 . . . . 0.0 104.659 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.549 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 31.5 m170 -59.94 -58.62 7.77 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.6 tp -44.6 -55.52 5.12 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.747 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -51.05 -58.8 5.16 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.193 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.9 m -43.86 -46.17 7.8 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 121.822 0.82 . . . . 0.0 110.159 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -64.32 -56.55 13.7 Favored 'General case' 0 N--CA 1.488 1.438 0 CA-C-N 113.182 -1.827 . . . . 0.0 114.046 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.432 ' C ' ' H ' ' A' ' 24' ' ' THR . 37.9 p -44.07 -30.68 0.78 Allowed 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.253 0.621 . . . . 0.0 110.414 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.04 39.43 0.37 Allowed 'General case' 0 N--CA 1.487 1.42 0 CA-C-N 114.112 -1.404 . . . . 0.0 111.319 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.432 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.5 t -124.37 -27.17 3.81 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 104.687 -2.338 . . . . 0.0 104.687 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 103.363 -2.828 . . . . 0.0 103.363 179.864 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 N--CA 1.492 1.405 0 N-CA-C 110.325 -0.683 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.5 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 81.1 m-85 -127.72 159.45 34.72 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 114.011 -1.449 . . . . 0.0 109.228 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -134.82 151.64 51.1 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 119.545 -0.862 . . . . 0.0 113.282 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.45 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 40.8 t -94.73 133.1 38.77 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 113.337 -1.756 . . . . 0.0 106.448 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -100.05 40.36 1.25 Allowed 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.45 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 53.3 m -134.84 -47.12 0.73 Allowed 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 113.026 -1.897 . . . . 0.0 108.453 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 29.9 p -125.33 4.15 7.75 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 123.891 0.744 . . . . 0.0 111.461 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 53.54 52.78 12.65 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 122.752 1.263 . . . . 0.0 110.328 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.408 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 19.4 ttt180 -105.34 154.39 20.35 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 102.666 -3.087 . . . . 0.0 102.666 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -116.93 158.87 23.34 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.903 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -135.91 -176.07 4.18 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 123.723 0.64 . . . . 0.0 110.075 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.5 p -103.09 -41.13 6.19 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 124.67 1.231 . . . . 0.0 110.255 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.476 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 28.7 mtt180 -114.89 163.83 14.99 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 124.169 0.918 . . . . 0.0 109.942 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.5 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 88.4 p -78.5 -33.65 47.98 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -69.49 -35.03 75.17 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 105.64 -1.985 . . . . 0.0 105.64 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.476 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 33.7 m170 -63.06 -59.01 5.37 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.7 tp -42.88 -53.94 4.43 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.857 0.723 . . . . 0.0 109.667 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -53.79 -57.64 10.15 Favored 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 119.875 -0.73 . . . . 0.0 111.468 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.0 m -41.34 -46.46 3.3 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 121.795 0.807 . . . . 0.0 110.142 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.1 t60 -65.49 -56.7 10.93 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 112.974 -1.921 . . . . 0.0 113.507 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.462 ' C ' ' H ' ' A' ' 24' ' ' THR . 45.4 p -52.26 -29.22 21.94 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.8 ttp180 -82.81 42.19 0.77 Allowed 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 123.032 1.396 . . . . 0.0 110.579 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.462 ' H ' ' C ' ' A' ' 22' ' ' THR . 5.9 t -131.52 -22.36 2.45 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 105.556 -2.016 . . . . 0.0 105.556 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 . . . . . 0 N--CA 1.494 1.732 0 N-CA-C 104.832 -2.284 . . . . 0.0 104.832 179.851 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.498 1.789 0 N-CA-C 114.95 1.096 . . . . 0.0 114.95 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 85.8 m-85 -121.34 157.8 29.62 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 113.384 -1.735 . . . . 0.0 109.64 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.413 HE21 ' HA ' ' A' ' 9' ' ' GLN . 72.8 tp60 -130.73 145.12 51.86 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 124.297 0.998 . . . . 0.0 108.795 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 40.4 t -92.97 138.89 31.08 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.403 ' HA ' HE22 ' A' ' 9' ' ' GLN . 56.3 tttp -105.24 36.1 2.6 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.415 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 31.8 m -131.57 -38.18 1.17 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 114.476 -1.238 . . . . 0.0 109.3 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.3 p -125.25 -39.04 2.24 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.538 -0.865 . . . . 0.0 109.406 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.413 ' HA ' HE21 ' A' ' 4' ' ' GLN . 90.6 mm-40 98.33 60.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 126.587 2.429 . . . . 0.0 109.81 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.2 ttt-85 -112.51 159.43 18.79 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 103.503 -2.777 . . . . 0.0 103.503 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -115.91 158.18 23.39 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.167 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.482 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 93.9 m-85 -139.59 179.65 6.44 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 124.157 0.911 . . . . 0.0 110.051 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.438 ' HG ' ' HD1' ' A' ' 17' ' ' HIS . 47.9 p -107.33 -39.75 5.58 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 124.735 1.272 . . . . 0.0 110.313 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.38 171.11 7.71 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.412 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 65.4 p -84.73 -40.16 17.64 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.407 ' H ' ' HG ' ' A' ' 15' ' ' SER . 1.9 p30 -62.75 -29.71 70.89 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.438 ' HD1' ' HG ' ' A' ' 13' ' ' SER . 37.8 m170 -66.34 -60.84 2.39 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.8 tp -43.6 -47.25 7.46 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 123.752 0.658 . . . . 0.0 111.365 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -58.05 -67.24 0.36 Allowed 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 119.685 -0.806 . . . . 0.0 109.624 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.2 m -35.39 -48.02 0.46 Allowed 'General case' 0 N--CA 1.504 2.231 0 O-C-N 124.641 1.213 . . . . 0.0 110.325 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.482 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 30.1 t60 -57.42 -61.17 2.68 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.654 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.492 ' C ' ' H ' ' A' ' 24' ' ' THR . 56.9 m -52.9 -12.74 0.35 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 124.255 0.972 . . . . 0.0 111.913 -179.648 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -90.46 40.29 1.01 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 123.373 1.559 . . . . 0.0 107.035 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.492 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.3 t -126.09 -26.11 3.45 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 103.585 -2.746 . . . . 0.0 103.585 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 105.287 -2.116 . . . . 0.0 105.287 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo . . . . . 0 N--CA 1.493 1.476 0 CA-C-O 121.88 0.7 . . . . 0.0 113.148 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.415 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 88.8 m-85 -131.31 162.24 30.52 Favored 'General case' 0 N--CA 1.499 2.0 0 CA-C-N 113.013 -1.903 . . . . 0.0 108.937 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.475 HE21 ' NZ ' ' A' ' 11' ' ' LYS . 50.8 tt0 -139.99 152.45 46.3 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.975 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.47 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 35.7 t -99.56 129.71 45.74 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 105.955 -1.868 . . . . 0.0 105.955 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -99.18 34.31 2.18 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 122.011 0.91 . . . . 0.0 109.445 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.47 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 53.5 m -123.17 -39.7 2.46 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.42 -1.718 . . . . 0.0 107.871 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -124.02 -40.78 2.26 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.292 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 104.41 51.74 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.72 0 O-C-N 126.299 2.249 . . . . 0.0 110.799 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 40.9 ttt85 -110.94 148.87 31.57 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 104.592 -2.373 . . . . 0.0 104.592 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.475 ' NZ ' HE21 ' A' ' 4' ' ' GLN . 2.3 mptp? -112.6 165.16 12.51 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.159 -1.016 . . . . 0.0 110.095 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -138.26 178.5 7.09 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.683 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 38.7 p -101.9 -40.25 6.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 125.175 1.547 . . . . 0.0 109.514 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.19 175.37 5.5 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.304 1.003 . . . . 0.0 109.55 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.415 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 74.8 p -89.84 -34.77 16.0 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.298 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.1 p-10 -65.05 -30.75 71.74 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -62.6 -61.54 2.35 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 106.063 -1.829 . . . . 0.0 106.063 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.2 tp -44.75 -50.99 9.78 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 124.115 0.884 . . . . 0.0 109.655 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -53.47 -60.27 3.52 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.802 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -47.55 -42.33 23.3 Favored 'General case' 0 N--CA 1.5 2.07 0 CA-C-O 121.646 0.736 . . . . 0.0 110.626 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -65.41 -57.65 7.81 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 113.781 -1.554 . . . . 0.0 114.233 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.9 p -45.03 -39.2 5.45 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.602 0.761 . . . . 0.0 111.651 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -82.85 39.02 0.6 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 116.939 -1.905 . . . . 0.0 112.98 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.0 t -121.23 -5.92 9.41 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 . . . . . 0 N--CA 1.488 1.429 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 179.854 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 N--CA 1.483 0.902 0 CA-C-O 121.888 0.703 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.478 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 96.6 m-85 -120.72 160.27 23.66 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -147.22 160.61 42.27 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 117.773 -1.571 . . . . 0.0 111.959 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.451 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 43.2 t -93.68 142.41 27.38 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.8 ttpp -107.07 32.76 4.37 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 125.123 1.515 . . . . 0.0 107.606 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.451 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 57.9 m -127.57 -38.31 1.92 Allowed 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 114.514 -1.221 . . . . 0.0 109.378 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.6 p -122.42 -41.03 2.42 Favored 'General case' 0 N--CA 1.499 2.014 0 C-N-CA 119.861 -0.736 . . . . 0.0 111.193 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 101.58 52.36 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 O-C-N 126.53 2.394 . . . . 0.0 109.975 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.22 148.0 33.78 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 103.48 -2.785 . . . . 0.0 103.48 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -112.74 160.68 17.7 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 118.347 -1.341 . . . . 0.0 111.619 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.418 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 83.2 m-85 -131.34 178.89 6.37 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-N 112.615 -2.084 . . . . 0.0 111.131 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 p -103.24 -31.55 10.04 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 125.383 1.677 . . . . 0.0 112.171 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.9 mtp180 -116.5 179.12 4.09 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 124.637 1.211 . . . . 0.0 107.876 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.478 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 89.6 p -108.7 20.74 18.15 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.973 0.892 . . . . 0.0 110.695 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.93 -35.06 3.57 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 55.7 m170 -59.8 -54.25 48.4 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 103.483 -2.784 . . . . 0.0 103.483 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.9 tp -36.83 -55.12 0.91 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 113.267 -1.788 . . . . 0.0 111.561 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.9 tptt -60.28 -59.18 5.83 Favored 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 m -42.68 -31.19 0.44 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 124.511 1.132 . . . . 0.0 111.376 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.418 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 16.2 t60 -82.28 -56.75 3.72 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 113.415 -1.721 . . . . 0.0 112.633 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.443 ' C ' ' H ' ' A' ' 24' ' ' THR . 14.6 m -43.86 -31.53 0.87 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 124.132 0.895 . . . . 0.0 111.522 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.42 43.13 0.53 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 118.5 -1.28 . . . . 0.0 112.453 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.443 ' H ' ' C ' ' A' ' 22' ' ' THR . 8.7 t -120.77 -24.92 5.56 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 103.053 -2.943 . . . . 0.0 103.053 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 103.888 -2.634 . . . . 0.0 103.888 179.867 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.487 1.102 0 CA-C-O 121.897 0.707 . . . . 0.0 111.954 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -120.26 157.11 29.84 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 105.564 -2.013 . . . . 0.0 105.564 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.418 HE21 ' HA ' ' A' ' 9' ' ' GLN . 71.1 tp60 -135.8 148.09 48.59 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 120.122 -0.631 . . . . 0.0 112.35 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 16.7 t -99.15 133.67 43.11 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 101.936 -3.357 . . . . 0.0 101.936 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.482 ' HD3' ' N ' ' A' ' 6' ' ' LYS . 3.3 mppt? -105.9 35.27 2.96 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.247 0.967 . . . . 0.0 109.063 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.8 m -123.67 -40.86 2.29 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 113.158 -1.837 . . . . 0.0 106.699 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 24.8 p -130.2 -10.18 4.22 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 123.889 0.743 . . . . 0.0 111.196 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.418 ' HA ' HE21 ' A' ' 4' ' ' GLN . 17.6 mp0 67.65 60.87 0.45 Allowed 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 123.066 1.412 . . . . 0.0 111.018 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -116.13 145.1 43.33 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 102.04 -3.318 . . . . 0.0 102.04 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -107.77 162.33 14.09 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.865 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -140.74 -179.9 6.32 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.565 1.165 . . . . 0.0 110.158 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 64.6 p -102.75 -36.78 8.16 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.13 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.44 -176.9 3.32 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 124.307 1.004 . . . . 0.0 111.366 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 95.6 p -98.53 -37.01 9.73 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.488 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -61.02 -29.46 69.73 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -66.31 -67.89 0.41 Allowed 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 62.1 tp -38.62 -48.28 1.43 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 123.871 0.732 . . . . 0.0 112.373 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -53.82 -67.83 0.23 Allowed 'General case' 0 N--CA 1.499 2.0 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.882 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.2 m -46.71 -36.33 7.04 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 114.183 -1.372 . . . . 0.0 110.624 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 39.8 t60 -66.91 -60.2 2.85 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-N 114.77 -1.105 . . . . 0.0 112.03 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.5 m -50.7 -25.14 3.94 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 121.203 0.525 . . . . 0.0 112.407 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.409 ' NH2' ' HB3' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -58.69 -8.2 1.22 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.446 179.374 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 t -91.46 -3.83 56.2 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.069 0.462 . . . . 0.0 110.205 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 . . . . . 0 N--CA 1.492 1.658 0 CA-C-N 114.595 -1.184 . . . . 0.0 107.807 -179.88 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 N--CA 1.494 1.537 0 CA-C-O 122.192 0.83 . . . . 0.0 113.756 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -121.92 163.43 19.28 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 112.608 -2.087 . . . . 0.0 106.974 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 73.9 tp60 -136.62 146.96 46.63 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.908 0.755 . . . . 0.0 110.952 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.435 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 12.6 t -104.03 130.91 51.72 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 101.342 -3.577 . . . . 0.0 101.342 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -106.47 42.97 1.19 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 122.316 1.055 . . . . 0.0 108.817 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.435 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 94.7 m -126.71 -40.58 1.9 Allowed 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 p -121.4 -32.19 3.91 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 123.987 0.805 . . . . 0.0 108.845 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 89.35 55.83 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 126.25 2.219 . . . . 0.0 109.448 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 44.4 ttt-85 -115.36 154.66 28.79 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.5 167.65 10.55 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 118.852 -1.139 . . . . 0.0 110.349 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.424 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 88.6 m-85 -139.93 -179.76 6.14 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 114.297 -1.319 . . . . 0.0 109.159 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.8 p -104.06 -44.89 4.88 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 124.475 1.11 . . . . 0.0 110.094 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.538 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 23.7 mtt180 -109.96 -176.33 2.97 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.437 1.085 . . . . 0.0 109.428 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.6 p -95.19 -29.93 14.28 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.008 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -76.65 -4.31 42.4 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.538 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 46.1 m170 -97.16 -10.3 26.19 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 124.973 1.421 . . . . 0.0 107.903 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.7 tp -106.46 -54.22 2.51 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.359 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -66.13 -2.08 3.84 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.5 m -105.55 -39.96 5.93 Favored 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 104.254 -2.498 . . . . 0.0 104.254 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.424 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 50.1 t60 -58.54 -57.16 14.19 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.455 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.453 ' C ' ' H ' ' A' ' 24' ' ' THR . 7.7 p -37.26 -40.86 0.36 Allowed 'General case' 0 C--N 1.308 -1.218 0 O-C-N 125.282 1.614 . . . . 0.0 111.55 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.7 mtt180 -76.93 37.97 0.2 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 125.117 1.511 . . . . 0.0 113.066 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.453 ' H ' ' C ' ' A' ' 22' ' ' THR . 11.2 t -115.96 -24.59 8.04 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 103.585 -2.746 . . . . 0.0 103.585 179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 . . . . . 0 C--N 1.308 -1.2 0 N-CA-C 100.705 -3.813 . . . . 0.0 100.705 179.358 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo . . . . . 0 N--CA 1.493 1.445 0 CA-C-O 121.836 0.682 . . . . 0.0 112.984 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -124.32 163.47 21.63 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-N 113.087 -1.87 . . . . 0.0 108.066 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.0 tp60 -139.7 137.52 35.24 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.884 0.74 . . . . 0.0 109.486 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.427 ' HA ' HD13 ' A' ' 18' ' ' LEU . 44.0 t -84.4 144.21 28.94 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 179.501 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -105.87 32.57 4.27 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 124.743 1.277 . . . . 0.0 108.997 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 97.2 m -135.08 -39.51 0.76 Allowed 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 114.317 -1.31 . . . . 0.0 111.188 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.7 p -119.95 -45.71 2.46 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 119.465 -0.894 . . . . 0.0 109.475 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 103.48 61.51 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 126.942 2.651 . . . . 0.0 110.474 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.6 ttt85 -115.29 158.84 21.79 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 103.273 -2.862 . . . . 0.0 103.273 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.593 ' H ' ' HZ1' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -113.72 163.74 14.62 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 119.231 -0.988 . . . . 0.0 109.759 -179.767 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.488 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 99.2 m-85 -139.98 -179.41 5.94 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 124.553 1.158 . . . . 0.0 110.696 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.3 p -104.43 -37.18 7.29 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 113.637 -1.619 . . . . 0.0 110.57 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.18 -172.32 2.2 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 124.175 0.922 . . . . 0.0 110.567 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 80.2 p -97.4 -33.48 11.39 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -86.54 10.35 15.65 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.465 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -115.87 -18.18 10.81 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 5' ' ' CYS . 36.2 tp -93.46 -57.51 2.57 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.374 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.7 ttmp? -53.1 -64.19 0.9 Allowed 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.2 m -38.93 -43.65 0.98 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.257 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.488 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 22.0 t60 -69.68 -58.5 3.85 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 113.7 -1.591 . . . . 0.0 112.336 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.405 ' N ' ' CD2' ' A' ' 21' ' ' HIS . 21.8 m -45.78 -40.38 9.54 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 121.753 0.787 . . . . 0.0 110.356 -179.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.6 ttp85 -85.11 52.28 2.4 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-O 123.867 1.794 . . . . 0.0 111.865 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.9 t -137.01 -19.78 1.28 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 111.363 -2.653 . . . . 0.0 105.397 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 -179.898 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo . . . . . 0 N--CA 1.496 1.664 0 N-CA-C 116.227 1.587 . . . . 0.0 116.227 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.415 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 79.0 m-85 -128.66 158.89 37.28 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 112.688 -2.051 . . . . 0.0 107.492 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -142.76 155.81 44.9 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.73 0.776 . . . . 0.0 110.857 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.551 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 15.1 t -104.31 107.89 19.02 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.13 33.58 0.68 Allowed 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 122.514 1.15 . . . . 0.0 110.132 -179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.551 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 35.0 m -112.71 -41.67 3.77 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 112.688 -2.051 . . . . 0.0 106.507 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 32.1 p -121.48 -29.34 4.44 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 124.041 0.838 . . . . 0.0 109.66 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 90.03 60.27 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 O-C-N 125.851 1.97 . . . . 0.0 110.831 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.4 ttt180 -121.05 151.68 39.52 Favored 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 104.627 -2.361 . . . . 0.0 104.627 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -116.28 161.14 19.45 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.417 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 90.3 m-85 -138.22 176.54 8.61 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 113.078 -1.874 . . . . 0.0 109.283 -179.62 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.7 p -102.71 -32.71 9.71 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 124.302 1.001 . . . . 0.0 110.573 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.4 ' CD ' ' CE1' ' A' ' 17' ' ' HIS . 32.7 mtp85 -116.54 176.3 5.17 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 124.484 1.115 . . . . 0.0 110.085 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.415 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 81.7 p -90.25 -36.58 14.65 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -66.16 -40.27 90.4 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 104.194 -2.521 . . . . 0.0 104.194 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.4 ' CE1' ' CD ' ' A' ' 14' ' ' ARG . 39.3 m170 -54.94 -58.92 5.66 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.2 tp -45.47 -52.82 9.7 Favored 'General case' 0 N--CA 1.502 2.132 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -52.54 -55.45 22.07 Favored 'General case' 0 N--CA 1.503 2.189 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.508 ' HA ' ' CZ ' ' A' ' 23' ' ' ARG . 52.9 m -42.94 -46.63 5.47 Favored 'General case' 0 N--CA 1.505 2.313 0 CA-C-O 121.612 0.72 . . . . 0.0 109.775 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.417 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 61.2 t60 -64.72 -56.81 11.37 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 113.359 -1.746 . . . . 0.0 114.588 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 48.7 p -43.77 -34.63 1.6 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.508 ' CZ ' ' HA ' ' A' ' 20' ' ' THR . 66.9 mtt85 -42.85 -23.62 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 179.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.2 t -95.29 19.6 10.48 Favored 'General case' 0 N--CA 1.512 2.631 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 31.2 m-70 . . . . . 0 N--CA 1.497 1.889 0 N-CA-C 104.226 -2.509 . . . . 0.0 104.226 179.297 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo . . . . . 0 N--CA 1.49 1.301 0 N-CA-C 110.32 -0.685 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.457 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 57.4 m-85 -123.67 161.25 25.47 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 113.577 -1.647 . . . . 0.0 107.631 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -130.43 149.27 52.18 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 124.188 0.93 . . . . 0.0 111.149 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.483 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 42.1 t -99.16 125.83 44.8 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 103.814 -2.661 . . . . 0.0 103.814 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -97.18 40.47 1.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 122.476 1.131 . . . . 0.0 108.644 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.483 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.7 m -131.6 -46.98 0.97 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 112.534 -2.121 . . . . 0.0 107.045 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 p -129.52 7.18 5.28 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 123.94 0.775 . . . . 0.0 112.731 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.6 mm-40 51.36 57.51 6.53 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-O 122.735 1.255 . . . . 0.0 111.765 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.5 ttt180 -118.08 140.94 49.03 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 103.123 -2.918 . . . . 0.0 103.123 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -105.52 165.97 10.77 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -179.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -140.76 -171.46 3.24 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 113.428 -1.715 . . . . 0.0 110.446 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.6 p -106.38 -39.17 5.98 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 124.438 1.086 . . . . 0.0 110.571 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.7 mtp-105 -119.09 179.94 4.01 Favored 'General case' 0 N--CA 1.5 2.071 0 CA-C-O 121.78 0.8 . . . . 0.0 109.77 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.457 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 80.3 p -94.08 -33.09 13.51 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -76.49 -3.39 37.06 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -95.9 -56.03 2.8 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 101.575 -3.491 . . . . 0.0 101.575 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 69.1 tp -46.47 -50.48 16.87 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -52.06 -64.72 0.72 Allowed 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.5 m -40.22 -43.61 1.72 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.329 0.585 . . . . 0.0 110.68 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 41.0 t60 -64.64 -59.36 4.37 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 114.103 -1.408 . . . . 0.0 112.33 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.8 p -45.35 -34.57 3.08 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -43.07 -25.01 0.09 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.1 t -92.38 9.57 33.61 Favored 'General case' 0 N--CA 1.511 2.586 0 N-CA-C 116.165 1.913 . . . . 0.0 116.165 -179.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 27.5 m-70 . . . . . 0 N--CA 1.497 1.878 0 N-CA-C 104.55 -2.389 . . . . 0.0 104.55 179.395 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 N--CA 1.491 1.357 0 N-CA-C 109.481 -1.007 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.469 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 81.7 m-85 -120.56 155.17 34.24 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -141.0 154.96 46.27 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.19 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.7 t -92.55 140.81 29.18 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 114.149 -1.387 . . . . 0.0 107.806 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.471 ' H ' ' HD3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -100.38 29.1 4.55 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 114.759 -1.109 . . . . 0.0 109.851 -179.727 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.463 HG23 ' CG ' ' A' ' 25' ' ' HIS . 56.0 m -129.6 -43.0 1.27 Allowed 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 114.097 -1.41 . . . . 0.0 110.764 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.1 p -125.25 -0.83 7.68 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 119.568 -0.853 . . . . 0.0 110.027 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 54.35 60.37 3.61 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 122.948 1.356 . . . . 0.0 110.556 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -112.44 149.97 31.83 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 103.302 -2.851 . . . . 0.0 103.302 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -110.99 160.22 17.01 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 119.085 -1.046 . . . . 0.0 112.025 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -137.58 175.41 9.63 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 114.495 -1.229 . . . . 0.0 109.528 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.2 p -98.58 -40.81 8.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 124.708 1.255 . . . . 0.0 110.41 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.454 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 42.6 mtt180 -113.77 167.24 10.79 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 124.258 0.974 . . . . 0.0 110.09 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.469 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 84.3 p -81.64 -36.15 29.2 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.4 ' N ' ' HG ' ' A' ' 15' ' ' SER . 1.1 p30 -64.92 -30.72 71.73 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.454 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.7 m170 -66.97 -60.38 2.68 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 tp -43.29 -52.52 5.71 Favored 'General case' 0 N--CA 1.503 2.191 0 CA-C-O 121.303 0.573 . . . . 0.0 110.603 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -49.45 -65.4 0.57 Allowed 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.832 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 85.8 m -43.82 -44.74 7.0 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.853 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -58.71 -60.29 4.06 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.4 m -45.35 -21.9 0.11 Allowed 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 114.861 -1.063 . . . . 0.0 113.734 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.1 ptt-85 -50.12 -24.6 2.84 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.3 t -82.24 7.17 14.47 Favored 'General case' 0 N--CA 1.505 2.28 0 CA-C-O 121.45 0.643 . . . . 0.0 112.183 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.463 ' CG ' HG23 ' A' ' 7' ' ' THR . 59.8 m-70 . . . . . 0 N--CA 1.493 1.722 0 CA-C-N 114.198 -1.365 . . . . 0.0 109.958 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.486 1.05 0 CA-C-O 122.259 0.858 . . . . 0.0 112.053 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -125.66 155.78 40.3 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 112.238 -2.255 . . . . 0.0 106.19 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -136.2 152.08 50.4 Favored 'General case' 0 N--CA 1.499 1.975 0 C-N-CA 119.221 -0.992 . . . . 0.0 112.212 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.542 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 27.0 t -101.11 109.12 20.97 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.455 ' H ' ' HD2' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -88.06 39.68 0.91 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.542 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 27.6 m -122.76 -39.8 2.49 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 113.195 -1.82 . . . . 0.0 106.808 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.428 ' O ' ' CB ' ' A' ' 9' ' ' GLN . 31.4 p -125.21 -32.74 2.94 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.428 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 1.0 OUTLIER 93.72 57.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 126.358 2.286 . . . . 0.0 110.201 179.693 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.45 155.83 29.0 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -118.71 161.43 20.11 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.497 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 82.5 m-85 -137.94 -175.49 4.11 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.357 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.5 p -105.03 -37.51 6.92 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 124.24 0.963 . . . . 0.0 111.246 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.503 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 54.7 mtt85 -118.69 -175.7 2.94 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 123.804 0.69 . . . . 0.0 110.423 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.416 ' C ' ' H ' ' A' ' 17' ' ' HIS . 88.6 p -93.07 -33.51 14.05 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -76.51 3.21 11.8 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.503 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 39.1 m170 -103.04 -42.22 5.86 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.7 tp -65.56 -49.45 68.8 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.155 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -55.61 -64.43 0.85 Allowed 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 47.3 m -41.07 -38.42 1.02 Allowed 'General case' 0 N--CA 1.503 2.19 0 O-C-N 124.278 0.986 . . . . 0.0 111.968 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 46.5 t60 -73.36 -55.33 6.53 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.5 m -49.48 -23.34 1.52 Allowed 'General case' 0 N--CA 1.508 2.453 0 CA-C-O 120.931 0.396 . . . . 0.0 112.04 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -48.64 -26.95 2.52 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.098 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.0 p -79.66 5.48 13.14 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.92 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo . . . . . 0 N--CA 1.488 1.17 0 N-CA-C 107.521 -1.761 . . . . 0.0 107.521 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.413 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 38.8 m-85 -119.95 157.09 29.53 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -139.89 155.62 47.1 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.958 -0.697 . . . . 0.0 109.887 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.6 t -91.68 142.52 27.52 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.8 mmmp? -104.71 38.4 1.91 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 115.107 -0.951 . . . . 0.0 108.999 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.8 m -136.14 -43.12 0.64 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 113.266 -1.788 . . . . 0.0 110.223 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.1 p -118.34 -40.83 2.89 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 124.123 0.89 . . . . 0.0 110.09 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 93.86 56.61 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.976 0 O-C-N 126.778 2.549 . . . . 0.0 110.57 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.531 ' NH1' ' CE1' ' A' ' 12' ' ' PHE . 41.2 ttt-85 -107.5 157.98 17.58 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 101.034 -3.691 . . . . 0.0 101.034 179.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.66 167.38 10.27 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 118.647 -1.221 . . . . 0.0 113.041 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.531 ' CE1' ' NH1' ' A' ' 10' ' ' ARG . 94.5 m-85 -144.96 177.03 9.04 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 113.612 -1.631 . . . . 0.0 108.12 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 81.8 p -104.61 -34.04 8.31 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.543 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 31.6 mtt180 -119.86 -173.86 2.63 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 113.744 -1.571 . . . . 0.0 111.697 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.413 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 38.3 p -95.71 -33.81 12.17 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.859 -1.519 . . . . 0.0 108.374 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -70.35 -35.18 73.41 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.543 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 36.7 m170 -64.74 -13.77 56.24 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 124.512 1.133 . . . . 0.0 110.742 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.5 tp -100.08 -50.8 3.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 123.973 0.796 . . . . 0.0 109.733 -179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.31 -32.35 64.54 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 119.799 -0.761 . . . . 0.0 112.009 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.0 m -74.63 -42.11 59.18 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.437 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 43.5 t60 -56.2 -58.15 9.17 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.428 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.0 p -42.16 -24.45 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.566 1.547 . . . . 0.0 113.795 -179.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.4 mtt85 -70.84 10.3 0.54 Allowed 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 114.627 -1.169 . . . . 0.0 111.358 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.428 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.3 t -106.95 -2.36 21.29 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.9 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo . . . . . 0 N--CA 1.495 1.579 0 CA-C-O 122.14 0.808 . . . . 0.0 114.078 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -127.31 153.08 46.62 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 112.586 -2.097 . . . . 0.0 106.883 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -130.21 139.46 50.81 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.51 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 44.8 t -91.35 105.12 17.55 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 101.537 -3.505 . . . . 0.0 101.537 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.1 pttt -90.34 42.95 1.12 Allowed 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 123.021 1.391 . . . . 0.0 108.29 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.51 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 26.1 m -124.34 -42.77 2.09 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 111.686 -2.506 . . . . 0.0 105.164 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.4 p -123.32 -35.98 2.88 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 123.838 0.711 . . . . 0.0 109.757 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 94.38 66.0 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 O-C-N 126.307 2.254 . . . . 0.0 111.711 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.4 ttt85 -122.1 153.89 38.08 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 104.029 -2.582 . . . . 0.0 104.029 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -112.51 156.41 22.66 Favored 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 119.647 -0.821 . . . . 0.0 112.671 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -140.94 -179.55 6.14 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 113.919 -1.492 . . . . 0.0 108.417 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 56.3 p -108.28 -37.42 6.01 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 124.147 0.904 . . . . 0.0 110.139 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.481 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 52.9 mtt85 -118.92 179.09 4.25 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 124.606 1.191 . . . . 0.0 111.719 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.435 ' C ' ' H ' ' A' ' 17' ' ' HIS . 92.8 p -94.38 -29.01 15.22 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 113.283 -1.78 . . . . 0.0 107.134 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -83.26 13.52 4.2 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.481 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 35.9 m170 -113.34 -57.58 2.27 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 101.111 -3.662 . . . . 0.0 101.111 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.9 tp -47.65 -46.26 28.75 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -51.26 -65.69 0.51 Allowed 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.3 m -39.74 -46.05 1.83 Allowed 'General case' 0 N--CA 1.502 2.135 0 CA-C-O 121.793 0.806 . . . . 0.0 111.016 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.5 t60 -63.67 -55.47 23.21 Favored 'General case' 0 N--CA 1.495 1.786 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.501 ' C ' ' H ' ' A' ' 24' ' ' THR . 21.6 p -47.77 -16.19 0.07 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -179.534 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -75.01 23.16 0.1 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.542 -1.263 . . . . 0.0 111.68 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.501 ' H ' ' C ' ' A' ' 22' ' ' THR . 25.5 p -114.47 -14.37 12.15 Favored 'General case' 0 N--CA 1.498 1.928 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 . . . . . 0 N--CA 1.492 1.648 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 179.805 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo . . . . . 0 N--CA 1.493 1.449 0 CA-C-O 122.153 0.814 . . . . 0.0 113.948 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -121.79 153.24 38.57 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 112.577 -2.102 . . . . 0.0 106.548 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -135.41 152.94 51.89 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 119.574 -0.85 . . . . 0.0 109.298 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 28.9 t -91.79 146.66 23.59 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 114.656 -1.156 . . . . 0.0 108.57 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -105.48 36.89 2.36 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 121.905 0.859 . . . . 0.0 109.612 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.488 HG23 ' CG ' ' A' ' 25' ' ' HIS . 90.0 m -134.12 -45.15 0.78 Allowed 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 113.491 -1.686 . . . . 0.0 110.149 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.0 p -120.85 -24.34 5.69 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 124.218 0.949 . . . . 0.0 110.272 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.7 mp0 75.79 56.69 0.06 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 125.308 1.63 . . . . 0.0 109.556 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.7 ttt85 -109.63 153.47 24.16 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 101.481 -3.526 . . . . 0.0 101.481 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HZ1' ' HB2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -114.67 163.79 14.95 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 118.708 -1.197 . . . . 0.0 112.624 -179.79 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.448 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 84.4 m-85 -138.17 177.83 7.58 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.801 -1.545 . . . . 0.0 108.01 -179.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 p -101.72 -35.14 9.18 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 124.042 0.839 . . . . 0.0 111.534 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.4 mtp-105 -118.14 179.13 4.19 Favored 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 85.5 p -89.38 -40.42 12.76 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -62.09 -22.85 66.13 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -75.11 -58.8 3.06 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 105.739 -1.948 . . . . 0.0 105.739 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.5 tp -43.98 -48.74 8.72 Favored 'General case' 0 N--CA 1.504 2.236 0 CA-C-O 121.312 0.577 . . . . 0.0 110.019 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -54.82 -59.49 4.65 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 73.1 m -45.43 -43.56 11.46 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-O 121.285 0.564 . . . . 0.0 110.649 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.448 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 68.1 t60 -63.3 -61.68 2.2 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 114.108 -1.405 . . . . 0.0 113.38 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.9 p -43.82 -31.91 0.94 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.451 ' CZ ' ' HA ' ' A' ' 23' ' ' ARG . 0.2 OUTLIER -44.35 -29.01 0.61 Allowed 'General case' 0 N--CA 1.489 1.48 0 CA-C-N 114.396 -1.275 . . . . 0.0 113.631 179.429 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.4 t -86.22 9.51 17.39 Favored 'General case' 0 N--CA 1.507 2.412 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.488 ' CG ' HG23 ' A' ' 7' ' ' THR . 39.8 m-70 . . . . . 0 N--CA 1.492 1.662 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo . . . . . 0 N--CA 1.49 1.285 0 N-CA-C 109.978 -0.816 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.416 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 70.8 m-85 -128.95 161.41 29.97 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-N 112.963 -1.926 . . . . 0.0 108.138 179.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -138.08 156.76 47.46 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 123.717 0.636 . . . . 0.0 111.017 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 44.3 t -97.34 136.04 38.37 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 179.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -100.89 36.93 1.83 Allowed 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 122.03 0.919 . . . . 0.0 109.191 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.415 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 59.6 m -131.72 -43.57 1.0 Allowed 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.594 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.7 p -118.98 -26.42 6.0 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 123.92 0.763 . . . . 0.0 110.188 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 78.87 56.68 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 125.359 1.662 . . . . 0.0 109.278 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.06 157.82 22.04 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 103.286 -2.857 . . . . 0.0 103.286 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -117.27 163.2 16.68 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 118.924 -1.11 . . . . 0.0 113.042 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.42 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 81.6 m-85 -140.01 -177.61 5.07 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 113.522 -1.672 . . . . 0.0 108.824 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.423 ' HG ' ' HD1' ' A' ' 17' ' ' HIS . 39.1 p -107.59 -24.02 11.92 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.188 0.93 . . . . 0.0 111.721 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.8 mtp180 -125.18 170.08 11.59 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 123.569 0.543 . . . . 0.0 110.182 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.416 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 82.8 p -96.93 15.79 21.27 Favored 'General case' 0 N--CA 1.503 2.182 0 CA-C-O 121.667 0.746 . . . . 0.0 110.066 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.76 -29.41 4.34 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.423 ' HD1' ' HG ' ' A' ' 13' ' ' SER . 35.6 m170 -67.79 -50.74 55.29 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 100.223 -3.991 . . . . 0.0 100.223 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.9 tp -57.26 -46.17 83.32 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 113.873 -1.512 . . . . 0.0 109.144 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 ttmm -64.69 -9.81 22.55 Favored 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.4 m -99.31 -41.58 7.38 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 103.567 -2.753 . . . . 0.0 103.567 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.42 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 55.1 t60 -54.67 -57.66 10.58 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 113.975 -1.466 . . . . 0.0 111.27 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.492 ' C ' ' H ' ' A' ' 24' ' ' THR . 9.9 p -42.33 -24.56 0.05 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 125.426 1.49 . . . . 0.0 113.185 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.4 mtt180 -81.36 34.21 0.37 Allowed 'General case' 0 N--CA 1.486 1.37 0 O-C-N 124.459 1.1 . . . . 0.0 110.536 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.492 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.7 t -124.54 -10.47 7.38 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 . . . . . 0 N--CA 1.492 1.658 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.484 -179.906 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 N--CA 1.503 2.068 0 CA-C-O 122.202 0.834 . . . . 0.0 112.906 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.427 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 61.8 m-85 -122.41 164.02 18.77 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 113.695 -1.593 . . . . 0.0 109.367 -179.829 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -135.25 151.07 50.24 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 124.495 1.122 . . . . 0.0 108.334 179.458 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.518 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 42.9 t -98.99 130.57 45.34 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -102.37 40.34 1.37 Allowed 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 122.731 1.253 . . . . 0.0 108.856 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.518 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 32.8 m -126.69 -41.07 1.87 Allowed 'General case' 0 N--CA 1.485 1.325 0 CA-C-N 112.32 -2.218 . . . . 0.0 105.727 179.481 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 28.4 p -122.93 -44.95 2.17 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 123.904 0.752 . . . . 0.0 111.375 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 104.22 57.67 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 127.523 2.329 . . . . 0.0 107.794 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.465 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 33.2 ttt180 -112.48 162.66 15.36 Favored 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 179.796 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -122.44 159.83 26.77 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.598 -0.841 . . . . 0.0 112.423 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.1 m-85 -140.63 -173.89 3.82 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 124.405 1.065 . . . . 0.0 109.596 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.4 p -108.39 -40.26 5.19 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.575 -179.803 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.573 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.2 mtt180 -112.41 179.54 3.96 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 124.142 0.901 . . . . 0.0 110.112 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.427 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 87.7 p -100.38 0.56 40.16 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 114.411 -1.268 . . . . 0.0 107.658 179.791 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -112.03 7.86 19.94 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 179.485 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.573 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 39.5 m170 -114.44 -14.8 12.14 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.4 tp -92.27 -34.67 14.15 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 179.852 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.474 ' HB3' ' HZ1' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -80.2 -40.96 26.12 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.85 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.8 m -66.27 -8.78 26.94 Favored 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 179.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.543 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 13.0 t60 -98.34 -56.07 2.58 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.377 179.38 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 94.2 m -54.06 -17.81 3.03 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -179.458 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.8 ptt180 -66.34 4.78 0.66 Allowed 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 119.299 -0.96 . . . . 0.0 113.323 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 72.9 p -105.42 0.14 26.57 Favored 'General case' 0 N--CA 1.505 2.299 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.569 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 179.964 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.453 0 CA-C-O 121.712 0.63 . . . . 0.0 111.971 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -125.69 164.29 20.94 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 113.501 -1.681 . . . . 0.0 107.54 179.784 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.43 HE21 ' HA ' ' A' ' 9' ' ' GLN . 70.0 tp60 -135.27 152.08 51.17 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 123.818 0.699 . . . . 0.0 110.118 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.42 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 32.0 t -100.33 136.54 40.06 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 179.511 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -105.33 36.97 2.32 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 124.908 1.38 . . . . 0.0 108.25 -179.939 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.42 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 14.3 m -130.25 -42.23 1.22 Allowed 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 113.358 -1.747 . . . . 0.0 108.947 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.9 p -120.28 -45.9 2.42 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.953 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.43 ' HA ' HE21 ' A' ' 4' ' ' GLN . 97.7 mm-40 105.55 60.75 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 126.983 2.677 . . . . 0.0 110.51 179.933 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.415 ' NH1' ' CE1' ' A' ' 12' ' ' PHE . 45.9 ttt-85 -114.16 154.45 27.82 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 102.878 -3.008 . . . . 0.0 102.878 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -111.29 163.44 13.95 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.299 -0.961 . . . . 0.0 110.421 -179.758 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.498 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 92.9 m-85 -141.24 -173.72 3.82 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 124.532 1.145 . . . . 0.0 109.639 -179.725 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.491 ' HG ' ' HD1' ' A' ' 17' ' ' HIS . 21.4 p -108.87 -38.86 5.49 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 124.604 1.19 . . . . 0.0 109.702 -179.965 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.423 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 46.9 mtt180 -119.16 -176.95 3.23 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 124.102 0.876 . . . . 0.0 110.67 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 81.1 p -95.0 -36.97 11.35 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.182 -179.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -64.84 -33.97 77.27 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 104.036 -2.579 . . . . 0.0 104.036 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.491 ' HD1' ' HG ' ' A' ' 13' ' ' SER . 47.6 m170 -59.83 -57.22 13.85 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 106.279 -1.749 . . . . 0.0 106.279 179.491 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.1 tp -47.03 -47.81 22.23 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.037 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.6 mttp -60.21 -50.66 72.8 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 118.354 -1.338 . . . . 0.0 110.834 179.473 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.5 m -47.59 -46.25 28.08 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 179.545 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.498 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 62.7 t60 -60.58 -56.44 21.29 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 113.221 -1.809 . . . . 0.0 114.406 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.494 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.1 p -50.46 -14.44 0.18 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -89.52 39.59 0.95 Allowed 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 179.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.494 ' H ' ' C ' ' A' ' 22' ' ' THR . 95.5 m -131.75 -11.72 3.42 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 112.487 -2.142 . . . . 0.0 107.481 179.839 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 50.4 m-70 . . . . . 0 N--CA 1.494 1.76 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 179.843 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo . . . . . 0 N--CA 1.496 1.618 0 CA-C-O 121.735 0.64 . . . . 0.0 113.226 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -127.23 161.17 29.19 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 112.942 -1.935 . . . . 0.0 107.257 179.738 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -140.08 149.57 43.26 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.427 179.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.508 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 37.0 t -98.36 121.37 40.21 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 103.785 -2.672 . . . . 0.0 103.785 179.439 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -95.57 41.27 1.1 Allowed 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.508 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 22.4 m -128.95 -42.13 1.41 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 113.406 -1.725 . . . . 0.0 108.55 -179.935 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.3 p -120.25 -42.32 2.58 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 123.96 0.788 . . . . 0.0 109.119 -179.957 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 102.75 57.66 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.975 0 O-C-N 126.888 2.617 . . . . 0.0 111.163 179.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.07 155.34 26.13 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 103.171 -2.9 . . . . 0.0 103.171 179.45 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -113.47 163.08 15.35 Favored 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.8 -179.737 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.412 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.2 m-85 -140.97 -178.09 5.4 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 124.264 0.978 . . . . 0.0 109.135 -179.802 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.0 p -105.85 -37.19 6.77 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 124.955 1.409 . . . . 0.0 111.002 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.8 mtp-105 -118.66 -178.85 3.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 124.424 1.078 . . . . 0.0 109.942 179.975 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 74.1 p -93.6 -34.82 13.17 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.14 179.905 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -74.96 0.54 15.45 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -97.61 -52.82 3.63 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 102.051 -3.315 . . . . 0.0 102.051 179.493 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.8 tp -52.26 -47.52 65.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 124.157 0.911 . . . . 0.0 108.917 179.547 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -59.5 -55.75 30.68 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.585 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 65.8 m -52.87 -25.25 11.04 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.025 0.441 . . . . 0.0 111.173 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.412 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 66.4 t60 -82.98 -55.87 4.13 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.341 179.677 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.432 ' C ' ' H ' ' A' ' 24' ' ' THR . 8.1 p -45.95 -37.28 6.27 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.174 0.99 . . . . 0.0 112.602 -179.544 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -64.02 10.95 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 118.693 -1.203 . . . . 0.0 114.013 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.432 ' H ' ' C ' ' A' ' 22' ' ' THR . 11.8 t -105.06 -7.14 19.37 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.682 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.994 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo . . . . . 0 N--CA 1.491 1.346 0 CA-C-O 121.675 0.615 . . . . 0.0 112.472 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -129.05 149.95 50.65 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.665 -1.607 . . . . 0.0 107.159 179.907 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.4 HE21 ' HA ' ' A' ' 9' ' ' GLN . 71.5 tp60 -124.54 141.82 51.81 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 123.971 0.794 . . . . 0.0 109.415 179.97 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.46 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 49.6 t -91.73 119.71 31.82 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 101.82 -3.4 . . . . 0.0 101.82 179.49 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -95.05 39.27 1.11 Allowed 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 -179.688 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.46 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 24.0 m -128.7 -44.62 1.34 Allowed 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 113.106 -1.861 . . . . 0.0 108.234 179.963 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.9 p -119.65 -34.05 3.87 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 119.759 -0.777 . . . . 0.0 109.403 -179.838 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.4 ' HA ' HE21 ' A' ' 4' ' ' GLN . 4.3 mp0 91.77 64.33 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 126.38 2.3 . . . . 0.0 111.359 179.712 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.56 152.84 36.34 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 104.058 -2.571 . . . . 0.0 104.058 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -113.56 155.07 26.07 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 119.187 -1.005 . . . . 0.0 110.553 -179.691 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -135.4 -172.03 2.97 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.184 -179.694 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.1 p -108.98 -42.8 4.35 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 113.605 -1.634 . . . . 0.0 111.458 -179.84 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.534 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 55.5 mtt180 -114.6 170.28 8.43 Favored 'General case' 0 N--CA 1.506 2.342 0 CA-C-O 121.839 0.828 . . . . 0.0 111.815 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.439 ' HG ' ' H ' ' A' ' 16' ' ' ASP . 69.3 p -82.39 -39.16 23.08 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 179.939 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.439 ' H ' ' HG ' ' A' ' 15' ' ' SER . 1.0 OUTLIER -67.47 -27.55 67.12 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 179.864 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.534 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 45.7 m170 -71.16 -60.29 2.31 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 104.418 -2.438 . . . . 0.0 104.418 179.491 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.5 tp -41.44 -52.05 3.68 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 123.801 0.688 . . . . 0.0 109.431 179.41 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -47.04 -69.02 0.14 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.713 0.633 . . . . 0.0 110.796 179.471 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.442 ' HA ' ' NH1' ' A' ' 23' ' ' ARG . 56.0 m -42.66 -42.03 3.32 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.936 -179.91 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -66.46 -61.81 1.8 Allowed 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 113.915 -1.493 . . . . 0.0 113.611 179.983 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.3 m -41.85 -45.69 3.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 124.382 1.051 . . . . 0.0 111.605 -178.925 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.442 ' NH1' ' HA ' ' A' ' 20' ' ' THR . 37.6 ttp180 -34.7 -31.9 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 O-C-N 125.97 2.044 . . . . 0.0 114.792 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.3 t -77.18 14.39 0.92 Allowed 'General case' 0 N--CA 1.506 2.329 0 CA-C-O 121.765 0.793 . . . . 0.0 112.667 -179.659 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.0 m-70 . . . . . 0 N--CA 1.492 1.66 0 CA-C-N 114.039 -1.437 . . . . 0.0 107.784 179.562 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo . . . . . 0 N--CA 1.49 1.277 0 N-CA-C 109.554 -0.979 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -121.9 159.9 25.9 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 113.05 -1.886 . . . . 0.0 107.055 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -140.31 150.49 44.07 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.489 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 31.9 t -87.25 144.59 26.74 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 179.596 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -102.54 32.16 3.73 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.162 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 39.9 m -131.57 -40.88 1.08 Allowed 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 114.124 -1.398 . . . . 0.0 110.178 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.9 p -121.34 -42.13 2.47 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 124.011 0.819 . . . . 0.0 111.259 -179.671 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 99.62 58.5 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 126.811 2.569 . . . . 0.0 108.955 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.431 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 16.8 ttt180 -104.6 159.31 15.86 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 101.373 -3.566 . . . . 0.0 101.373 179.477 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -114.49 161.18 18.34 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 119.197 -1.001 . . . . 0.0 112.165 -179.41 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.429 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.9 m-85 -144.04 176.26 9.43 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 124.44 1.087 . . . . 0.0 109.348 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 43.5 p -106.19 -40.52 5.61 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.653 1.221 . . . . 0.0 110.598 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.546 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 58.2 mtt85 -112.27 171.57 7.43 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 124.579 1.174 . . . . 0.0 110.053 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.444 ' HG ' ' N ' ' A' ' 16' ' ' ASP . 88.8 p -85.51 -36.63 20.4 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 179.864 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.444 ' N ' ' HG ' ' A' ' 15' ' ' SER . 0.8 OUTLIER -63.26 -32.78 74.28 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 179.978 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.546 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 41.6 m170 -67.1 -60.78 2.33 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 179.666 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.6 tp -40.14 -51.77 2.61 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 123.758 0.661 . . . . 0.0 110.721 179.451 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -54.81 -60.37 3.46 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.644 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.5 m -42.35 -40.81 2.63 Favored 'General case' 0 N--CA 1.501 2.103 0 CA-C-O 121.489 0.661 . . . . 0.0 111.767 179.723 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.431 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 53.3 t60 -71.57 -57.37 4.46 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 113.92 -1.491 . . . . 0.0 114.191 179.666 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.7 p -44.01 -35.92 2.28 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.591 0.757 . . . . 0.0 112.306 -179.127 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -81.73 44.88 0.85 Allowed 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 118.457 -1.297 . . . . 0.0 111.766 179.765 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.0 t -124.14 -21.78 4.95 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 179.495 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 . . . . . 0 N--CA 1.486 1.374 0 CA-C-N 114.107 -1.406 . . . . 0.0 110.249 -179.6 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo . . . . . 0 N--CA 1.493 1.459 0 CA-C-O 121.842 0.684 . . . . 0.0 113.335 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -127.74 167.6 16.25 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 113.005 -1.907 . . . . 0.0 107.746 179.982 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -148.06 153.18 38.58 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.846 179.493 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.507 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 34.7 t -94.79 127.75 41.02 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 179.819 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.42 38.78 1.14 Allowed 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 -179.585 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.507 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 29.2 m -130.68 -44.59 1.08 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 113.887 -1.506 . . . . 0.0 109.89 179.932 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 32.0 p -120.71 -26.58 5.25 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 123.75 0.656 . . . . 0.0 110.789 -179.858 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 85.82 57.91 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 125.93 2.018 . . . . 0.0 112.304 179.732 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.68 151.86 34.26 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 179.35 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -113.96 162.88 15.86 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.149 -1.02 . . . . 0.0 112.216 -179.799 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -137.11 -173.81 3.56 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.699 -1.591 . . . . 0.0 109.485 -179.575 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 80.7 p -111.24 -37.58 5.26 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 124.313 1.008 . . . . 0.0 108.452 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.498 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.4 mtt85 -116.09 -178.16 3.34 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.913 -179.939 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.415 ' C ' ' H ' ' A' ' 17' ' ' HIS . 87.1 p -97.17 -24.19 15.85 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 113.689 -1.596 . . . . 0.0 107.418 179.95 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -90.29 19.01 5.42 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 122.483 1.135 . . . . 0.0 108.549 179.808 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.498 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 22.7 m170 -120.27 -19.71 7.58 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 112.275 -2.239 . . . . 0.0 105.147 179.514 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.8 tp -101.12 -48.77 4.3 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 114.405 -1.271 . . . . 0.0 109.405 -179.809 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -71.81 3.8 3.87 Favored 'General case' 0 N--CA 1.504 2.25 0 CA-C-O 121.121 0.486 . . . . 0.0 111.412 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.4 m -105.51 -43.17 5.02 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 103.781 -2.674 . . . . 0.0 103.781 179.536 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -61.71 -56.92 14.51 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 113.484 -1.689 . . . . 0.0 111.73 179.832 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.48 ' C ' ' H ' ' A' ' 24' ' ' THR . 17.1 p -45.06 -23.63 0.17 Allowed 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 124.686 1.194 . . . . 0.0 112.6 -179.872 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.8 mmm-85 -78.85 32.83 0.21 Allowed 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.75 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.48 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.0 t -124.58 -23.48 4.39 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 179.746 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.1 m-70 . . . . . 0 N--CA 1.491 1.605 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.169 -179.748 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo . . . . . 0 N--CA 1.494 1.545 0 N-CA-C 115.346 1.248 . . . . 0.0 115.346 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -125.49 155.67 40.17 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 112.02 -2.355 . . . . 0.0 108.018 -179.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -135.45 152.37 51.3 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.226 179.415 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.438 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 44.5 t -91.17 128.8 37.14 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 179.624 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.3 pttm -99.59 38.89 1.37 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.375 -179.72 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.438 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 54.7 m -130.88 -42.73 1.11 Allowed 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 112.251 -2.25 . . . . 0.0 107.353 179.62 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.3 p -124.91 -30.79 3.21 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 124.06 0.85 . . . . 0.0 111.806 -179.875 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 88.0 62.81 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.325 0 O-C-N 125.64 1.838 . . . . 0.0 110.443 179.839 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -115.68 154.19 29.96 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 102.725 -3.065 . . . . 0.0 102.725 179.696 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -114.51 155.66 26.02 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 119.153 -1.019 . . . . 0.0 112.535 -179.47 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.428 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 85.2 m-85 -136.56 -179.63 5.8 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 114.393 -1.276 . . . . 0.0 109.059 -179.733 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.432 ' HG ' HH11 ' A' ' 14' ' ' ARG . 76.3 p -106.37 -34.69 7.36 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 124.417 1.073 . . . . 0.0 110.122 -179.861 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.558 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 52.5 mtt85 -117.41 169.73 9.28 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 124.838 1.337 . . . . 0.0 111.413 -179.796 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 96.7 p -85.99 -37.04 19.4 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 179.913 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -64.27 -30.01 71.07 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 179.782 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.558 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 21.7 m170 -71.48 -60.62 2.14 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 105.858 -1.904 . . . . 0.0 105.858 179.685 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 5' ' ' CYS . 62.9 tp -40.61 -52.4 2.88 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 124.073 0.858 . . . . 0.0 111.175 179.608 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -55.06 -64.39 0.85 Allowed 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 118.922 -0.561 . . . . 0.0 110.306 179.626 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.0 m -39.2 -45.47 1.35 Allowed 'General case' 0 N--CA 1.504 2.246 0 O-C-N 124.231 0.957 . . . . 0.0 110.292 179.763 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.428 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 44.9 t60 -60.33 -60.99 2.94 Favored 'General case' 0 N--CA 1.489 1.502 0 CA-C-N 113.878 -1.51 . . . . 0.0 111.24 179.591 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.5 m -47.53 -23.32 0.61 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 123.751 0.657 . . . . 0.0 112.735 -179.581 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 mmm180 -53.57 -21.47 6.64 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.196 179.484 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.7 t -88.21 17.16 5.35 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-O 121.778 0.799 . . . . 0.0 110.81 -179.884 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 36.3 m-70 . . . . . 0 N--CA 1.492 1.651 0 CA-C-N 113.652 -1.613 . . . . 0.0 108.731 179.705 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo . . . . . 0 N--CA 1.492 1.385 0 CA-C-O 121.573 0.572 . . . . 0.0 112.865 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.44 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 50.1 m-85 -129.17 168.04 16.73 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 113.635 -1.621 . . . . 0.0 108.93 179.826 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.482 HE21 ' HA ' ' A' ' 9' ' ' GLN . 72.2 tp60 -133.82 149.37 51.39 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 124.165 0.915 . . . . 0.0 111.752 -179.806 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.425 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 41.7 t -99.34 141.4 32.17 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 104.616 -2.364 . . . . 0.0 104.616 179.304 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.32 19.31 20.8 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 124.748 1.28 . . . . 0.0 109.183 -179.843 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.425 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 40.9 m -114.81 -42.86 3.19 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 114.09 -1.414 . . . . 0.0 108.214 179.919 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.476 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 22.4 p -130.9 10.28 5.02 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 119.576 -0.85 . . . . 0.0 112.355 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.482 ' HA ' HE21 ' A' ' 4' ' ' GLN . 96.2 mm-40 47.16 59.39 4.08 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 122.747 1.26 . . . . 0.0 111.226 -179.825 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.476 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 15.4 ttt180 -117.04 157.42 25.87 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 103.934 -2.617 . . . . 0.0 103.934 179.812 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 pttp -114.91 165.39 12.9 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 118.32 -1.352 . . . . 0.0 112.149 -179.938 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.497 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 98.9 m-85 -140.84 -170.67 3.08 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 113.896 -1.502 . . . . 0.0 110.448 -179.768 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.8 p -108.36 -35.41 6.52 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 124.737 1.273 . . . . 0.0 109.495 179.923 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.41 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 5.6 mtp85 -127.12 174.61 8.77 Favored 'General case' 0 N--CA 1.504 2.227 0 CA-C-O 121.658 0.742 . . . . 0.0 110.371 179.497 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.44 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 90.3 p -82.55 -41.87 19.08 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.447 -1.251 . . . . 0.0 108.549 -179.891 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -67.86 -28.52 67.61 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 -179.992 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.41 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 53.9 m170 -69.16 -61.53 1.75 Allowed 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 104.625 -2.361 . . . . 0.0 104.625 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.0 tp -39.21 -52.63 1.94 Allowed 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 121.808 0.813 . . . . 0.0 110.179 179.318 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -49.07 -68.43 0.18 Allowed 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.151 179.584 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.4 m -39.83 -45.2 1.74 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 124.635 1.21 . . . . 0.0 110.284 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 8.2 t60 -57.06 -61.18 2.63 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.174 -1.376 . . . . 0.0 111.265 179.797 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.501 ' C ' ' H ' ' A' ' 24' ' ' THR . 12.5 m -41.54 -26.49 0.07 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.985 1.428 . . . . 0.0 111.238 -179.68 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -79.42 36.65 0.31 Allowed 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 114.849 -1.068 . . . . 0.0 110.47 179.797 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.501 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.7 t -125.77 -12.08 6.59 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 104.882 -2.266 . . . . 0.0 104.882 179.496 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 . . . . . 0 N--CA 1.487 1.389 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.801 -179.895 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo . . . . . 0 N--CA 1.485 1.015 0 N-CA-C 110.564 -0.591 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -114.92 145.14 42.52 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 105.172 -2.158 . . . . 0.0 105.172 179.669 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -127.61 151.13 49.32 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.25 0.969 . . . . 0.0 109.768 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.418 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 32.2 t -99.59 136.25 39.8 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 103.254 -2.869 . . . . 0.0 103.254 179.587 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -99.11 23.6 8.88 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.408 -0.917 . . . . 0.0 111.714 -179.422 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.486 HG23 ' CG ' ' A' ' 25' ' ' HIS . 18.7 m -119.84 -44.56 2.52 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 179.296 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.517 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 27.2 p -127.25 10.32 6.82 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 48.57 57.7 6.01 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-O 123.372 1.558 . . . . 0.0 109.71 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.517 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 55.7 ttm-85 -116.22 130.04 56.59 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 111.101 -2.772 . . . . 0.0 103.909 -179.929 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -103.68 163.09 12.55 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.062 -1.055 . . . . 0.0 113.576 -179.352 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -138.49 175.3 9.68 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 112.932 -1.94 . . . . 0.0 110.345 -179.385 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.486 ' HG ' HH11 ' A' ' 14' ' ' ARG . 84.9 p -101.7 -27.35 13.1 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.57 1.169 . . . . 0.0 110.719 -179.875 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.488 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 57.1 mtt85 -118.2 165.85 13.31 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 124.546 1.153 . . . . 0.0 111.007 -179.936 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 61.8 p -85.16 -38.98 18.38 Favored 'General case' 0 N--CA 1.492 1.631 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.432 -179.953 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.4 -36.42 82.26 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 179.921 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.488 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 28.6 m170 -66.37 -62.23 1.58 Allowed 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 179.708 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 39.2 tp -40.1 -55.18 2.15 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.087 0.867 . . . . 0.0 111.478 179.613 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -54.01 -62.0 1.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 124.045 0.841 . . . . 0.0 112.376 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.8 m -45.26 -43.43 10.46 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 123.893 0.746 . . . . 0.0 111.014 179.889 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.443 ' CE1' ' HD2' ' A' ' 10' ' ' ARG . 63.6 t60 -61.82 -63.62 1.2 Allowed 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.535 179.842 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -51.25 -42.47 61.07 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -179.439 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -34.12 -31.57 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 125.453 1.721 . . . . 0.0 112.992 179.454 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.5 t -78.73 -47.95 15.87 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.364 -179.72 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.486 ' CG ' HG23 ' A' ' 7' ' ' THR . 0.8 OUTLIER . . . . . 0 N--CA 1.494 1.76 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 179.866 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo . . . . . 0 N--CA 1.489 1.207 0 CA-C-O 122.174 0.822 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -122.44 154.56 37.61 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 112.258 -2.246 . . . . 0.0 105.964 179.76 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.47 HE21 ' HA ' ' A' ' 9' ' ' GLN . 72.0 tp60 -132.14 147.9 52.45 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 123.847 0.717 . . . . 0.0 110.592 -179.864 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.401 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 18.3 t -95.46 135.36 37.2 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 103.169 -2.9 . . . . 0.0 103.169 179.491 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.8 mptt -99.76 33.44 2.54 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 125.124 1.515 . . . . 0.0 108.539 -179.576 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.437 HG23 ' CG ' ' A' ' 25' ' ' HIS . 69.9 m -131.76 -46.48 0.96 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.393 179.946 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.2 p -125.58 5.97 7.55 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.674 -179.75 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.47 ' HA ' HE21 ' A' ' 4' ' ' GLN . 86.5 mm-40 53.1 58.71 5.03 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-O 122.941 1.353 . . . . 0.0 111.062 179.878 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.458 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 20.6 ttt180 -111.79 148.94 32.47 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 102.613 -3.106 . . . . 0.0 102.613 179.67 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -115.58 162.53 17.09 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 119.088 -1.045 . . . . 0.0 112.22 -179.8 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -140.98 177.47 8.03 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-N 114.085 -1.416 . . . . 0.0 108.599 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.448 ' HG ' HH11 ' A' ' 14' ' ' ARG . 80.5 p -106.83 -30.48 8.89 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 124.29 0.994 . . . . 0.0 110.642 -179.86 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.495 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 51.9 mtt85 -119.96 -178.85 3.75 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.901 -179.757 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 99.8 p -98.19 -33.57 11.07 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -64.17 -22.71 67.04 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.495 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 32.4 m170 -80.25 -42.68 22.72 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 179.731 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.86 -47.42 83.41 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 179.763 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.37 -61.25 2.43 Favored 'General case' 0 N--CA 1.503 2.214 0 CA-C-N 118.928 0.785 . . . . 0.0 110.388 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.5 m -48.11 -26.22 1.77 Allowed 'General case' 0 N--CA 1.502 2.17 0 CA-C-O 120.959 0.409 . . . . 0.0 112.088 179.73 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.458 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 71.3 t60 -84.61 -56.13 3.76 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.633 179.612 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.492 ' C ' ' H ' ' A' ' 24' ' ' THR . 19.2 p -50.26 -33.59 20.32 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.417 1.087 . . . . 0.0 113.383 -179.464 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -65.63 14.28 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.643 -1.223 . . . . 0.0 113.888 179.744 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.492 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.4 t -109.75 -10.51 14.79 Favored 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 179.554 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.437 ' CG ' HG23 ' A' ' 7' ' ' THR . 40.7 m-70 . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 104.731 -2.322 . . . . 0.0 104.731 179.857 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo . . . . . 0 N--CA 1.487 1.131 0 CA-C-O 121.952 0.73 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -124.95 154.82 40.58 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 112.678 -2.055 . . . . 0.0 106.571 179.798 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -135.87 145.04 45.94 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 124.084 0.865 . . . . 0.0 109.394 179.93 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.2 t -93.56 140.52 29.51 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 104.891 -2.262 . . . . 0.0 104.891 179.619 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -104.63 37.62 2.09 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -179.672 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.9 m -131.93 -44.31 0.96 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 113.7 -1.591 . . . . 0.0 109.059 179.992 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.0 p -118.93 -34.22 3.97 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 123.896 0.747 . . . . 0.0 109.832 -179.933 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.5 mp0 88.77 56.68 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.196 0 O-C-N 126.342 2.276 . . . . 0.0 108.98 179.706 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.65 138.54 49.29 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 102.946 -2.983 . . . . 0.0 102.946 179.747 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -102.64 164.98 11.33 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.949 -1.101 . . . . 0.0 112.15 -179.53 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -139.42 -178.08 5.22 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 113.52 -1.673 . . . . 0.0 109.293 -179.704 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.5 p -105.06 -39.53 6.19 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 124.883 1.365 . . . . 0.0 108.818 -179.909 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.484 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 55.9 mtt180 -109.7 -177.69 3.34 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 124.438 1.086 . . . . 0.0 111.369 179.965 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 17' ' ' HIS . 50.5 p -97.67 -30.44 12.82 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 113.671 -1.604 . . . . 0.0 109.461 -179.879 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -88.41 19.42 3.84 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 122.162 0.982 . . . . 0.0 108.475 179.906 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.484 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.5 m170 -119.45 -24.39 6.34 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 179.529 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.5 tp -93.76 -54.3 3.68 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 114.322 -1.308 . . . . 0.0 110.154 -179.968 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -0.86 12.71 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.821 -179.846 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.0 m -104.5 -36.01 7.68 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 105.299 -2.111 . . . . 0.0 105.299 179.921 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 25.3 t60 -70.33 -53.37 16.98 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 124.041 0.838 . . . . 0.0 108.801 179.727 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 p -37.94 -46.01 0.93 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.129 0.972 . . . . 0.0 111.135 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.3 mmt-85 -43.32 -21.38 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 179.921 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.9 t -73.91 -21.54 60.02 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 123.099 0.249 . . . . 0.0 111.335 -179.548 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 56.6 m-70 . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 179.705 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_exo . . . . . 0 N--CA 1.491 1.351 0 CA-C-O 121.613 0.589 . . . . 0.0 111.906 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.453 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 56.7 m-85 -128.28 163.14 25.42 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 113.586 -1.643 . . . . 0.0 108.783 179.936 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -136.29 153.71 51.09 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 124.148 0.905 . . . . 0.0 110.489 179.775 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.508 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 34.6 t -99.54 124.74 45.01 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 179.664 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -97.88 40.48 1.17 Allowed 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 122.376 1.084 . . . . 0.0 109.101 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.508 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.3 m -124.42 -41.59 2.16 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 112.84 -1.982 . . . . 0.0 105.668 179.633 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.8 p -122.31 -36.86 2.89 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 124.097 0.873 . . . . 0.0 110.684 180.0 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 92.26 56.81 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.456 0 O-C-N 126.143 2.152 . . . . 0.0 111.434 179.791 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.4 ttt-85 -116.65 161.11 19.71 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 103.897 -2.631 . . . . 0.0 103.897 179.529 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -117.2 163.52 16.18 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 119.773 -0.771 . . . . 0.0 112.951 -179.898 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.605 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 72.2 m-85 -138.35 -175.61 4.17 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 112.711 -2.041 . . . . 0.0 107.935 -179.825 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.0 p -106.2 -33.04 7.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 124.142 0.901 . . . . 0.0 110.609 -179.986 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.462 ' CD ' ' CE1' ' A' ' 17' ' ' HIS . 35.5 mtp180 -120.06 171.08 8.71 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 123.793 0.683 . . . . 0.0 110.623 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.453 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 92.1 p -80.84 -29.07 35.91 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.562 -179.898 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -82.55 -28.23 31.12 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 179.78 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.462 ' CE1' ' CD ' ' A' ' 14' ' ' ARG . 42.9 m170 -68.85 -52.18 32.56 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 101.867 -3.383 . . . . 0.0 101.867 179.275 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 52.6 tp -43.04 -49.04 6.19 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.115 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.81 -58.74 6.79 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 179.415 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.7 m -40.18 -38.51 0.77 Allowed 'General case' 0 N--CA 1.503 2.213 0 CA-C-O 121.116 0.484 . . . . 0.0 110.849 179.612 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.605 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 51.3 t60 -75.16 -51.78 12.56 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 113.835 -1.53 . . . . 0.0 114.078 179.592 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.7 p -43.13 -37.26 1.97 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 118.899 0.772 . . . . 0.0 110.459 -179.769 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -43.44 -21.25 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 179.31 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 68.1 p -80.33 -18.87 47.93 Favored 'General case' 0 N--CA 1.509 2.509 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -179.733 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 47.7 m-70 . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 106.117 -1.809 . . . . 0.0 106.117 179.969 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo . . . . . 0 N--CA 1.494 1.534 0 CA-C-O 122.123 0.801 . . . . 0.0 112.911 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -123.15 166.09 15.78 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 112.611 -2.086 . . . . 0.0 107.973 -179.992 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -142.17 152.83 43.54 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 123.954 0.784 . . . . 0.0 109.759 179.558 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.427 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 46.2 t -93.24 136.37 33.57 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 179.574 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -104.44 35.32 2.76 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.649 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.427 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 58.7 m -127.52 -40.57 1.76 Allowed 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 113.287 -1.779 . . . . 0.0 107.763 179.861 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.4 p -122.52 -38.39 2.67 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 124.14 0.9 . . . . 0.0 110.5 -179.942 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 91.54 62.3 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 126.22 2.2 . . . . 0.0 110.63 179.793 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -118.73 155.84 30.39 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 102.692 -3.077 . . . . 0.0 102.692 179.624 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.6 mtpt -113.8 163.98 14.33 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 118.841 -1.144 . . . . 0.0 113.169 -179.657 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.437 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 88.7 m-85 -139.96 -178.15 5.31 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 114.348 -1.297 . . . . 0.0 108.28 -179.586 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 55.1 p -103.76 -38.95 6.85 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -179.974 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.453 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 58.8 mtt85 -115.64 178.07 4.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 124.508 1.13 . . . . 0.0 110.4 179.905 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 94.7 p -89.43 -36.61 15.35 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 113.907 -1.497 . . . . 0.0 109.363 -179.759 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -65.69 -34.1 77.43 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 179.953 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.453 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 50.1 m170 -61.5 -61.77 2.29 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 179.587 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 5' ' ' CYS . 50.1 tp -42.43 -54.97 3.61 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 124.025 0.828 . . . . 0.0 110.999 179.688 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -50.29 -63.66 1.05 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.801 179.701 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.1 m -41.57 -45.22 3.25 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 124.162 0.913 . . . . 0.0 110.333 179.928 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.437 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 36.9 t60 -63.4 -59.64 4.42 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.366 -1.743 . . . . 0.0 113.204 179.9 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.511 ' C ' ' H ' ' A' ' 24' ' ' THR . 25.0 m -52.71 -25.81 12.17 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 123.784 0.678 . . . . 0.0 112.192 -179.325 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -79.81 38.81 0.4 Allowed 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 122.578 1.18 . . . . 0.0 110.49 179.789 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.511 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.8 t -126.28 -27.44 3.21 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 179.23 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 79.4 m-70 . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 179.956 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.488 1.202 0 CA-C-O 122.47 0.946 . . . . 0.0 114.317 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.403 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 58.0 m-85 -134.45 154.88 51.17 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 112.027 -2.351 . . . . 0.0 105.888 179.652 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -142.61 154.92 44.84 Favored 'General case' 0 N--CA 1.501 2.101 0 C-N-CA 118.991 -1.084 . . . . 0.0 111.381 179.715 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 36.6 t -90.92 139.6 30.61 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 179.745 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -102.01 38.21 1.7 Allowed 'General case' 0 N--CA 1.5 2.075 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.478 -179.674 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 56.6 m -135.77 -45.93 0.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 113.808 -1.542 . . . . 0.0 110.302 -179.975 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.8 p -121.79 -20.25 6.49 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 124.124 0.89 . . . . 0.0 111.195 -179.601 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.3 mp0 75.57 57.73 0.06 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 125.406 1.691 . . . . 0.0 111.307 179.702 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -107.79 148.21 29.81 Favored 'General case' 0 N--CA 1.487 1.414 1 N-CA-C 100.104 -4.036 . . . . 0.0 100.104 179.394 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -112.01 157.18 21.03 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.378 -0.929 . . . . 0.0 110.907 -179.615 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -134.55 -177.51 4.64 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 113.634 -1.621 . . . . 0.0 109.512 -179.622 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 57.9 p -110.85 -34.1 6.34 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 124.631 1.207 . . . . 0.0 109.939 -179.965 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.433 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.9 mtt180 -118.02 -176.54 3.07 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.535 179.731 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.405 ' C ' ' H ' ' A' ' 17' ' ' HIS . 79.8 p -97.85 -25.31 15.07 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 114.278 -1.328 . . . . 0.0 107.963 -179.986 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 53.9 p30 -91.87 25.62 2.71 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.571 1.177 . . . . 0.0 108.862 179.94 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.433 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 33.1 m170 -122.14 -42.63 2.36 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 102.568 -3.123 . . . . 0.0 102.568 179.688 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -77.53 -50.78 11.89 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 113.353 -1.749 . . . . 0.0 109.705 179.877 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -72.05 5.72 2.55 Favored 'General case' 0 N--CA 1.502 2.139 0 CA-C-O 121.169 0.509 . . . . 0.0 112.136 -179.861 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 79.5 m -106.53 -43.78 4.65 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 102.896 -3.001 . . . . 0.0 102.896 179.582 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 54.4 t60 -60.35 -58.26 9.28 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.477 -1.692 . . . . 0.0 111.256 179.7 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 20.0 p -46.83 -18.87 0.08 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -179.639 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 mtp-105 -67.61 -8.6 35.82 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.239 -179.905 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.3 t -89.95 -7.24 54.54 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.992 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 CA--C 1.542 0.876 0 CA-C-O 121.685 0.619 . . . . 0.0 112.253 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -126.93 163.39 23.77 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 113.653 -1.612 . . . . 0.0 106.907 179.671 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -133.05 149.48 52.17 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 123.711 0.632 . . . . 0.0 111.923 -179.778 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.6 t -99.59 139.85 34.65 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 179.444 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -106.46 40.99 1.51 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 122.416 1.103 . . . . 0.0 109.557 179.948 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 62.6 m -135.99 -39.02 0.7 Allowed 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 113.05 -1.886 . . . . 0.0 108.434 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.3 p -123.21 -43.09 2.22 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 119.135 -1.026 . . . . 0.0 108.871 -179.876 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 98.3 mm-40 100.19 59.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 O-C-N 126.726 2.516 . . . . 0.0 108.94 179.831 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 ttt-85 -115.82 157.04 25.01 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 179.741 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -112.77 164.4 13.43 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.113 179.977 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.545 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 95.7 m-85 -139.2 -173.8 3.69 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.61 -2.087 . . . . 0.0 109.771 -179.893 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.1 p -106.72 -35.79 6.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 124.477 1.111 . . . . 0.0 110.187 -179.959 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.474 ' HB2' ' CG ' ' A' ' 17' ' ' HIS . 46.2 mtt85 -121.46 -179.71 4.17 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 123.808 0.692 . . . . 0.0 112.173 179.8 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.4 ' HG ' ' H ' ' A' ' 16' ' ' ASP . 64.5 p -90.48 -40.05 12.24 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 114.47 -1.241 . . . . 0.0 107.886 -179.932 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.4 ' H ' ' HG ' ' A' ' 15' ' ' SER . 0.8 OUTLIER -67.35 -33.21 74.76 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 104.682 -2.34 . . . . 0.0 104.682 179.786 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.474 ' CG ' ' HB2' ' A' ' 14' ' ' ARG . 49.7 m170 -66.61 -56.65 9.75 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 179.433 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.9 tp -46.02 -55.62 6.63 Favored 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.9 tttm -46.56 -59.44 3.0 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 122.049 0.14 . . . . 0.0 110.899 179.582 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.9 m -45.14 -44.65 10.84 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.616 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.545 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 61.1 t60 -67.42 -52.9 34.12 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 114.162 -1.381 . . . . 0.0 114.705 179.716 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.413 ' C ' ' H ' ' A' ' 24' ' ' THR . 44.2 p -49.1 -39.8 29.56 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 118.908 0.776 . . . . 0.0 109.945 -179.602 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.5 mtt-85 -68.61 19.76 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 179.94 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.413 ' H ' ' C ' ' A' ' 22' ' ' THR . 77.2 p -108.39 -6.99 15.96 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.223 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 61.3 m-70 . . . . . 0 C--N 1.302 -1.481 1 N-CA-C 100.036 -4.061 . . . . 0.0 100.036 179.203 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.491 1.334 0 CA-C-O 121.689 0.62 . . . . 0.0 113.26 . . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -128.92 157.37 41.79 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 113.283 -1.78 . . . . 0.0 107.025 179.596 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -139.95 154.61 47.24 Favored 'General case' 0 N--CA 1.5 2.075 0 C-N-CA 119.956 -0.698 . . . . 0.0 111.78 179.649 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.494 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 15.7 t -104.31 122.74 46.06 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 105.029 -2.212 . . . . 0.0 105.029 179.44 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -97.86 46.41 1.02 Allowed 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 122.999 1.38 . . . . 0.0 109.045 -179.851 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.494 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.4 m -129.3 -43.88 1.28 Allowed 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 111.77 -2.468 . . . . 0.0 105.682 179.693 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.4 p -122.49 -24.29 5.0 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.292 0.995 . . . . 0.0 112.166 -179.932 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 84.43 53.92 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 O-C-N 124.871 1.357 . . . . 0.0 108.66 179.866 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.458 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 17.7 ttm180 -113.97 156.38 24.15 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 104.496 -2.409 . . . . 0.0 104.496 179.968 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.429 ' H ' ' HD3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -120.75 161.54 21.27 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 119.073 -1.051 . . . . 0.0 111.488 -179.829 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.449 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 75.7 m-85 -136.68 179.29 6.46 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.316 -1.765 . . . . 0.0 110.442 -179.58 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.2 p -104.9 -30.33 9.9 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 124.907 1.38 . . . . 0.0 110.731 -179.847 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.524 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 65.6 mtt85 -124.09 177.79 5.64 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 123.992 0.808 . . . . 0.0 111.314 179.974 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.404 ' HG ' ' N ' ' A' ' 16' ' ' ASP . 84.4 p -94.15 -35.28 12.59 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 114.288 -1.324 . . . . 0.0 108.43 179.996 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.404 ' N ' ' HG ' ' A' ' 15' ' ' SER . 8.8 p-10 -65.44 -34.61 78.69 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 104.03 -2.581 . . . . 0.0 104.03 179.805 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.524 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 36.5 m170 -62.77 -64.0 1.05 Allowed 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.418 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.2 tp -42.59 -52.56 4.76 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 123.534 0.521 . . . . 0.0 110.927 179.515 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -50.84 -48.35 59.94 Favored 'General case' 0 N--CA 1.508 2.442 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 179.69 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 87.2 m -65.73 -37.53 86.64 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.236 179.738 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.458 ' CE1' ' HD2' ' A' ' 10' ' ' ARG . 68.9 t60 -62.95 -53.71 49.85 Favored 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.799 179.743 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.474 ' C ' ' H ' ' A' ' 24' ' ' THR . 25.1 p -61.02 -7.43 2.49 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.086 179.687 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.411 ' H ' ' C ' ' A' ' 21' ' ' HIS . 0.0 OUTLIER -91.4 32.02 1.1 Allowed 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 105.555 -2.017 . . . . 0.0 105.555 179.858 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.474 ' H ' ' C ' ' A' ' 22' ' ' THR . 92.9 m -127.0 -27.37 3.02 Favored 'General case' 0 N--CA 1.491 1.625 0 CA-C-N 113.287 -1.779 . . . . 0.0 106.896 -179.947 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 . . . . . 0 N--CA 1.493 1.69 0 CA-C-N 114.715 -1.13 . . . . 0.0 111.79 -179.695 . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo . . . . . 0 N--CA 1.49 1.306 0 CA-C-O 122.503 0.96 . . . . 0.0 113.935 . . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -127.78 145.73 50.82 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-N 111.819 -2.446 . . . . 0.0 105.168 179.658 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -132.27 150.09 52.23 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.371 179.811 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.55 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 13.4 t -100.93 102.8 13.9 Favored 'General case' 0 C--N 1.305 -1.342 1 N-CA-C 99.989 -4.078 . . . . 0.0 99.989 179.533 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -87.88 39.58 0.9 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 -179.404 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.55 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 40.8 m -116.19 -42.34 3.06 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 104.49 -2.411 . . . . 0.0 104.49 179.713 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.9 p -124.68 -24.6 4.13 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 124.053 0.846 . . . . 0.0 111.172 179.89 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 86.44 59.21 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 126.548 1.939 . . . . 0.0 111.924 179.952 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -118.29 152.35 35.94 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 102.971 -2.974 . . . . 0.0 102.971 179.52 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.13 160.81 20.91 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 119.107 -1.037 . . . . 0.0 112.594 -179.681 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -139.98 175.77 9.31 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 112.818 -1.992 . . . . 0.0 107.512 -179.753 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.7 p -110.83 -19.89 12.67 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 124.219 0.949 . . . . 0.0 109.803 -179.862 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.3 mtp-105 -125.79 178.55 5.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 124.082 0.864 . . . . 0.0 109.193 179.838 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.407 ' C ' ' H ' ' A' ' 17' ' ' HIS . 89.1 p -94.89 -28.15 15.34 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 114.051 -1.432 . . . . 0.0 108.174 -179.978 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -84.15 14.31 4.37 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 121.78 0.8 . . . . 0.0 109.367 -179.949 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.407 ' H ' ' C ' ' A' ' 15' ' ' SER . 34.6 m170 -114.96 -62.09 1.65 Allowed 'General case' 0 C--N 1.307 -1.252 1 N-CA-C 99.759 -4.163 . . . . 0.0 99.759 179.362 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.5 tp -44.24 -53.02 6.99 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.424 179.528 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -57.69 -66.78 0.41 Allowed 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 119.735 -0.786 . . . . 0.0 110.103 179.953 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.7 m -33.63 -47.9 0.25 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 124.649 1.218 . . . . 0.0 110.769 179.634 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -64.59 -58.5 6.17 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 112.909 -1.95 . . . . 0.0 113.043 179.727 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.522 ' C ' ' H ' ' A' ' 24' ' ' THR . 87.4 m -52.76 -20.35 3.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 123.782 0.676 . . . . 0.0 111.718 -179.376 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.469 ' HA ' ' HE ' ' A' ' 23' ' ' ARG . 4.8 mmp_? -82.32 38.68 0.56 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 122.422 1.106 . . . . 0.0 109.129 179.411 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.522 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.8 t -128.23 -10.03 5.28 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 104.887 -2.264 . . . . 0.0 104.887 179.36 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 57.4 m-70 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 103.698 -2.704 . . . . 0.0 103.698 179.894 . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo . . . . . 0 N--CA 1.488 1.19 0 CA-C-O 122.597 0.999 . . . . 0.0 113.301 . . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.535 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 76.0 m-85 -128.15 141.92 51.34 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 179.561 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -129.29 152.95 48.3 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 119.089 -1.044 . . . . 0.0 110.353 179.935 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.413 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 22.8 t -90.64 140.21 29.98 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 179.599 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -102.2 39.33 1.51 Allowed 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 122.049 0.928 . . . . 0.0 108.948 -179.805 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.413 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 32.5 m -133.27 -44.27 0.85 Allowed 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 113.419 -1.719 . . . . 0.0 110.2 179.913 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.0 p -118.65 -35.34 3.74 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 124.056 0.848 . . . . 0.0 110.407 -179.71 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 88.24 55.93 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.052 0 O-C-N 126.522 2.389 . . . . 0.0 109.458 179.845 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -107.74 151.22 25.98 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 100.706 -3.813 . . . . 0.0 100.706 179.466 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -116.33 159.79 21.42 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 118.743 -1.183 . . . . 0.0 110.428 -179.559 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.4 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 75.7 m-85 -133.71 -177.06 4.38 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.842 -1.526 . . . . 0.0 110.253 -179.653 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.5 p -98.35 -41.29 7.9 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.023 -179.814 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.489 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.0 mtt85 -117.56 179.41 4.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 124.395 1.06 . . . . 0.0 111.093 179.877 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.535 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 88.6 p -91.73 -36.21 13.71 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.391 -179.974 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 41.8 p-10 -68.74 -24.71 64.49 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.902 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.489 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 48.3 m170 -71.34 -58.96 3.04 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 179.665 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -48.06 -46.27 33.27 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 121.449 0.642 . . . . 0.0 109.907 179.489 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -54.85 -52.67 62.05 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.887 -0.508 . . . . 0.0 110.453 179.603 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 84.9 m -56.17 -42.09 76.53 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.698 -0.801 . . . . 0.0 108.845 179.609 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.4 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 62.4 t60 -58.12 -61.79 2.29 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.885 179.912 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.444 ' C ' ' H ' ' A' ' 24' ' ' THR . 13.3 p -42.3 -27.15 0.13 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.675 1.19 . . . . 0.0 112.052 -179.649 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.61 43.48 1.03 Allowed 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 123.257 1.503 . . . . 0.0 110.158 179.708 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.444 ' H ' ' C ' ' A' ' 22' ' ' THR . 12.4 t -126.47 -26.83 3.24 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 111.936 -2.393 . . . . 0.0 105.044 179.637 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 105.48 -2.045 . . . . 0.0 105.48 179.89 . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.498 1.778 0 N-CA-C 117.594 2.113 . . . . 0.0 117.594 . . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.448 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 77.6 m-85 -123.42 162.76 22.18 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.285 -2.234 . . . . 0.0 108.843 -179.795 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -142.74 156.72 45.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 123.914 0.759 . . . . 0.0 110.093 179.576 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.542 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 29.4 t -100.49 125.69 46.84 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 179.617 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.516 ' H ' ' HD2' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -97.83 40.58 1.16 Allowed 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 122.492 1.139 . . . . 0.0 108.629 -179.846 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.542 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 23.4 m -127.25 -42.48 1.69 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 112.671 -2.059 . . . . 0.0 107.662 179.836 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.4 p -122.61 -39.91 2.5 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 123.788 0.68 . . . . 0.0 109.833 179.986 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 99.78 58.12 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 126.722 2.514 . . . . 0.0 111.538 179.781 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.8 ttt85 -112.72 158.11 20.46 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 103.188 -2.893 . . . . 0.0 103.188 179.437 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -117.04 160.62 20.69 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 119.472 -0.891 . . . . 0.0 112.39 -179.668 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.434 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 84.3 m-85 -137.9 176.04 9.05 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 113.841 -1.527 . . . . 0.0 107.314 -179.935 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.0 p -120.59 -22.56 6.34 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 116.64 2.089 . . . . 0.0 116.64 -179.495 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.41 ' O ' ' HB3' ' A' ' 15' ' ' SER . 40.0 mtp180 -101.48 -54.6 2.72 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 -179.071 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.448 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 95.0 p 130.23 -40.41 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 128.551 2.74 . . . . 0.0 108.364 -179.879 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -63.27 -33.85 76.39 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 103.75 -2.685 . . . . 0.0 103.75 179.688 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -58.26 -60.88 3.08 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 104.524 -2.399 . . . . 0.0 104.524 179.348 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.1 tp -45.43 -56.61 4.82 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.086 179.577 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -49.79 -56.61 9.68 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 179.871 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.1 m -51.08 -44.95 61.29 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 122.019 0.914 . . . . 0.0 109.117 179.64 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.434 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 70.9 t60 -63.1 -47.28 83.5 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-N 113.769 -1.56 . . . . 0.0 112.656 -179.886 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 p -67.56 -11.27 57.66 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.351 -0.843 . . . . 0.0 110.993 179.773 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 50.4 mmt-85 -106.07 45.14 0.99 Allowed 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 179.353 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.413 ' HB ' ' O ' ' A' ' 21' ' ' HIS . 89.8 m -127.79 -46.69 1.41 Allowed 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 110.299 -3.137 . . . . 0.0 102.674 179.759 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 . . . . . 0 N--CA 1.493 1.708 0 N-CA-C 104.4 -2.444 . . . . 0.0 104.4 179.562 . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo . . . . . 0 N--CA 1.499 1.805 0 N-CA-C 114.324 0.855 . . . . 0.0 114.324 . . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.451 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 79.9 m-85 -116.79 104.18 11.08 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 112.976 -1.92 . . . . 0.0 107.529 -179.934 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.403 ' HA ' ' HA ' ' A' ' 11' ' ' LYS . 21.6 tt0 -102.65 159.66 15.26 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 122.871 1.319 . . . . 0.0 113.635 -179.444 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.558 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 26.3 t -105.0 109.32 21.28 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 111.569 -2.56 . . . . 0.0 105.119 -179.989 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -94.83 48.43 1.19 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 123.386 1.565 . . . . 0.0 107.165 -179.812 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.558 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 23.8 m -123.45 -41.62 2.27 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 102.735 -3.061 . . . . 0.0 102.735 179.591 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.6 p -123.49 -35.7 2.89 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 124.187 0.929 . . . . 0.0 111.593 179.797 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 100.52 57.11 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.576 0 O-C-N 126.055 2.097 . . . . 0.0 109.011 -179.916 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.449 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 22.1 ttt180 -119.28 144.92 46.53 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 179.978 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 4' ' ' GLN . 63.8 pttt -111.86 165.87 11.7 Favored 'General case' 0 N--CA 1.502 2.158 0 C-N-CA 119.189 -1.005 . . . . 0.0 111.274 -179.777 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -139.35 176.15 8.96 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 124.22 0.95 . . . . 0.0 111.162 -179.563 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.0 p -97.34 -36.47 10.38 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 125.409 1.693 . . . . 0.0 109.785 -179.751 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.552 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 59.1 mtt85 -114.32 174.02 6.16 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 124.377 1.048 . . . . 0.0 109.871 179.858 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.451 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 97.7 p -102.15 11.36 38.43 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.726 -179.978 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.04 -32.53 6.01 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 105.497 -2.038 . . . . 0.0 105.497 179.607 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.552 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.7 m170 -67.97 -28.14 67.19 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 179.373 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.5 tp -76.69 -48.13 19.86 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 114.264 -1.334 . . . . 0.0 108.542 179.837 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -52.92 -62.92 1.34 Allowed 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.5 m -43.49 -43.26 5.3 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 124.716 1.26 . . . . 0.0 110.665 179.887 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.449 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 56.1 t60 -64.37 -56.53 13.76 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 113.712 -1.585 . . . . 0.0 114.23 179.992 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.492 ' C ' ' H ' ' A' ' 24' ' ' THR . 33.8 m -58.37 -10.91 2.33 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 112.297 0.481 . . . . 0.0 112.297 -179.446 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -90.2 38.8 0.94 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 179.537 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.492 ' H ' ' C ' ' A' ' 22' ' ' THR . 87.7 m -131.03 -13.65 3.54 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-N 111.831 -2.44 . . . . 0.0 105.538 179.72 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 104.323 -2.473 . . . . 0.0 104.323 179.744 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm . . . . . 0 N--CA 1.492 1.664 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -76.46 143.77 24.93 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 122.912 2.408 . . . . 0.0 111.069 -174.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -124.46 156.9 36.42 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 113.378 -1.737 . . . . 0.0 108.551 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 71.8 tp60 -133.42 145.19 50.05 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 124.572 1.17 . . . . 0.0 108.481 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.421 ' HA ' HD13 ' A' ' 18' ' ' LEU . 41.6 t -91.29 133.12 35.68 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 104.25 -2.5 . . . . 0.0 104.25 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.52 34.87 2.45 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 124.412 1.07 . . . . 0.0 108.226 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.402 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 34.2 m -128.33 -40.74 1.61 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 113.744 -1.571 . . . . 0.0 109.058 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.4 p -123.37 -41.85 2.27 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.482 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 102.39 64.43 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.16 0 O-C-N 126.452 2.345 . . . . 0.0 109.951 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -120.85 152.75 38.02 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 103.578 -2.749 . . . . 0.0 103.578 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -111.91 163.23 14.46 Favored 'General case' 0 N--CA 1.503 2.176 0 C-N-CA 118.668 -1.213 . . . . 0.0 112.382 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.46 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 92.9 m-85 -142.12 176.86 8.64 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 125.079 1.487 . . . . 0.0 109.079 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.8 p -107.52 -25.76 11.23 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 124.373 1.046 . . . . 0.0 111.273 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.561 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 64.6 mtt85 -123.94 164.67 18.83 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 123.88 0.737 . . . . 0.0 110.24 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.9 p -78.59 -33.63 47.41 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -70.66 -32.82 70.24 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 106.411 -1.699 . . . . 0.0 106.411 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.561 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 29.7 m170 -66.16 -62.16 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 105.532 -2.025 . . . . 0.0 105.532 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 5' ' ' CYS . 43.5 tp -40.53 -56.18 2.13 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 124.34 1.025 . . . . 0.0 110.416 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -51.16 -64.85 0.68 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.247 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.1 m -41.96 -42.53 2.83 Favored 'General case' 0 N--CA 1.504 2.258 0 CA-C-O 121.734 0.778 . . . . 0.0 111.138 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.46 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 40.5 t60 -67.99 -58.01 5.23 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 113.648 -1.615 . . . . 0.0 113.748 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.438 ' C ' ' H ' ' A' ' 24' ' ' THR . 11.9 m -52.1 -38.51 57.55 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.172 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -71.6 24.31 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 117.804 -1.558 . . . . 0.0 114.563 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.438 ' H ' ' C ' ' A' ' 22' ' ' THR . 5.2 t -113.48 -3.72 13.66 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -91.35 -48.68 6.77 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.489 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.6 m -117.08 -37.13 3.62 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 114.424 -1.262 . . . . 0.0 110.24 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 33.26 37.36 0.06 OUTLIER Glycine 0 N--CA 1.503 3.112 0 O-C-N 125.677 1.861 . . . . 0.0 114.316 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.443 ' N ' ' CD ' ' A' ' 28' ' ' GLU . 0.5 OUTLIER -18.67 -62.22 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 125.932 1.693 . . . . 0.0 114.047 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 56.3 pttt . . . . . 0 N--CA 1.494 1.774 0 CA-C-N 112.53 -2.123 . . . . 0.0 110.64 -179.824 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 95.1 mttt . . . . . 0 N--CA 1.493 1.724 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -95.33 166.79 1.51 Allowed 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 122.931 2.42 . . . . 0.0 111.598 165.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -123.49 160.99 25.75 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 112.805 -1.998 . . . . 0.0 106.355 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -137.31 153.03 50.36 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.507 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.45 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 36.0 t -97.69 133.8 41.73 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -99.19 38.55 1.39 Allowed 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.45 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 39.4 m -131.78 -42.62 1.01 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 113.858 -1.519 . . . . 0.0 109.744 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.0 p -121.4 -26.66 4.96 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 123.872 0.732 . . . . 0.0 111.139 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.2 mm-40 85.17 51.04 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.198 0 O-C-N 125.36 1.663 . . . . 0.0 109.8 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.9 ttt-85 -110.49 156.71 20.49 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 103.189 -2.893 . . . . 0.0 103.189 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -119.13 163.56 16.85 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 119.074 -1.05 . . . . 0.0 112.389 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.441 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 86.5 m-85 -137.65 -174.95 3.91 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 113.793 -1.549 . . . . 0.0 110.054 -179.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.8 p -106.47 -41.84 5.18 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 124.419 1.075 . . . . 0.0 111.559 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.482 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 7.7 mtt180 -113.47 175.96 5.23 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 124.18 0.925 . . . . 0.0 110.114 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.7 p -87.82 -38.28 15.84 Favored 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.036 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -66.57 -29.89 70.06 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.482 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 49.4 m170 -65.07 -59.03 4.57 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.9 tp -45.25 -53.47 8.28 Favored 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -48.68 -61.21 2.15 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.1 m -43.57 -43.76 5.78 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.441 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 72.5 t60 -66.46 -53.32 36.71 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 114.884 -1.053 . . . . 0.0 113.015 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 82.8 p -44.0 -28.93 0.52 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 119.682 1.128 . . . . 0.0 110.604 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.409 ' HD2' ' N ' ' A' ' 23' ' ' ARG . 2.1 mpt_? -80.91 44.9 0.78 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 122.958 1.361 . . . . 0.0 113.715 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 29.8 p -131.3 -26.28 2.11 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 63.3 m-70 -100.12 -49.07 4.41 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 103.774 -2.676 . . . . 0.0 103.774 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 56.6 p -108.21 44.97 1.05 Allowed 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -122.04 67.79 0.45 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 106.778 -2.529 . . . . 0.0 106.778 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -100.31 -54.3 2.9 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? . . . . . 0 N--CA 1.502 2.167 0 O-C-N 126.319 2.262 . . . . 0.0 115.013 179.914 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 68.0 mttm . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -63.22 159.71 38.09 Favored 'Trans proline' 0 N--CA 1.489 1.25 0 C-N-CA 122.821 2.348 . . . . 0.0 109.72 149.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.46 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 93.9 m-85 -114.76 143.59 44.83 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 101.908 -3.367 . . . . 0.0 101.908 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -128.54 154.89 45.69 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 119.837 -0.745 . . . . 0.0 111.35 -179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 8.2 t -101.02 136.44 40.86 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 103.572 -2.751 . . . . 0.0 103.572 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.9 mmmm -100.55 41.48 1.17 Allowed 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 122.163 0.982 . . . . 0.0 109.253 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.48 HG23 ' CG ' ' A' ' 25' ' ' HIS . 46.0 m -135.92 -48.38 0.67 Allowed 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.138 -1.846 . . . . 0.0 110.262 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 32.0 p -123.64 -16.81 6.62 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 124.257 0.973 . . . . 0.0 110.006 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 69.7 64.31 0.25 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 124.059 1.885 . . . . 0.0 109.764 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.408 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 28.5 ttt180 -116.1 120.06 37.82 Favored 'General case' 0 C--N 1.304 -1.386 1 N-CA-C 100.019 -4.067 . . . . 0.0 100.019 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.455 ' HD2' ' H ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -93.71 165.49 12.68 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 118.959 -1.096 . . . . 0.0 111.014 -179.662 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -136.48 174.29 10.77 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 113.628 -1.624 . . . . 0.0 109.737 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.4 p -96.85 -39.26 9.5 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 124.926 1.391 . . . . 0.0 107.896 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.437 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 5.5 mtt-85 -111.5 -179.18 3.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 124.921 1.388 . . . . 0.0 108.357 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.46 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 91.4 p -99.28 -21.92 15.84 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.871 -1.513 . . . . 0.0 107.843 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -91.39 26.85 2.12 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 122.419 1.104 . . . . 0.0 108.388 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.437 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 49.1 m170 -125.36 -40.18 2.13 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.6 tp -75.13 -52.0 12.06 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 106.387 -1.709 . . . . 0.0 106.387 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -68.34 -15.75 63.68 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.259 0.349 . . . . 0.0 110.363 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 84.8 m -95.82 -9.01 32.69 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 43.2 t60 -97.35 -55.72 2.75 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.17 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.48 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.3 p -44.02 -21.13 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.081 1.353 . . . . 0.0 113.542 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 20.7 ptt85 -77.07 27.2 0.14 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 124.089 0.868 . . . . 0.0 111.518 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.48 ' H ' ' C ' ' A' ' 22' ' ' THR . 8.9 t -117.08 -22.39 8.42 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.48 ' CG ' HG23 ' A' ' 7' ' ' THR . 66.0 m-70 -104.62 -45.97 4.47 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 113.882 -1.508 . . . . 0.0 107.525 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.3 m -112.77 46.16 1.24 Allowed 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -128.16 -49.29 0.15 Allowed Glycine 0 N--CA 1.49 2.286 0 CA-C-N 112.887 -1.961 . . . . 0.0 109.277 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -123.29 -58.36 1.63 Allowed 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 114.396 -0.902 . . . . 0.0 111.676 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp . . . . . 0 N--CA 1.501 2.083 0 CA-C-N 114.288 -1.324 . . . . 0.0 110.67 -179.891 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 29.1 tptp . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -64.55 168.79 12.38 Favored 'Trans proline' 0 C--N 1.314 -1.258 0 C-N-CA 122.201 1.934 . . . . 0.0 111.857 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.422 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 51.0 m-85 -132.0 112.29 12.26 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 112.458 -2.155 . . . . 0.0 106.386 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -108.39 157.49 18.36 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.492 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 38.0 t -97.07 112.82 24.42 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 103.753 -2.684 . . . . 0.0 103.753 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.1 29.42 0.83 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 124.472 1.108 . . . . 0.0 109.513 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.492 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.7 m -115.34 -41.9 3.23 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 113.597 -1.638 . . . . 0.0 108.518 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.9 p -119.27 -34.62 3.79 Favored 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.592 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 97.2 58.66 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.347 0 O-C-N 126.096 2.122 . . . . 0.0 109.978 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.439 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 48.3 ttt180 -118.94 146.54 44.88 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -112.91 162.51 15.74 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.588 -0.845 . . . . 0.0 112.45 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -138.94 179.61 6.39 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-N 113.219 -1.81 . . . . 0.0 109.51 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.447 ' HG ' HH11 ' A' ' 14' ' ' ARG . 88.6 p -102.44 -33.82 9.39 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 124.379 1.049 . . . . 0.0 108.969 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.536 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.0 mtt85 -119.41 171.66 8.17 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.587 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.422 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 94.3 p -85.16 -35.38 21.74 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.71 -39.77 94.21 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 104.209 -2.515 . . . . 0.0 104.209 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.536 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 37.7 m170 -56.39 -60.15 3.94 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.7 tp -42.82 -56.4 3.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 124.109 0.881 . . . . 0.0 109.74 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -48.57 -60.98 2.27 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.441 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.4 m -41.0 -46.09 2.76 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.712 0.768 . . . . 0.0 110.62 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.439 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 57.2 t60 -66.94 -55.36 14.94 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.668 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.2 p -45.51 -25.64 0.47 Allowed 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 48.8 mtt180 -52.87 -18.05 1.71 Allowed 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.0 t -87.02 -4.68 59.19 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -114.29 -40.97 3.55 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 30.9 m -109.78 39.84 2.03 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-N 114.519 -1.219 . . . . 0.0 110.227 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -123.53 51.33 0.81 Allowed Glycine 0 N--CA 1.498 2.795 0 N-CA-C 108.184 -1.967 . . . . 0.0 108.184 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -114.81 177.28 4.71 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 115.01 -0.595 . . . . 0.0 109.908 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 122.638 1.209 . . . . 0.0 110.001 -179.947 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.3 pttm . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 119.865 -0.112 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -69.22 150.04 71.04 Favored 'Trans proline' 0 N--CA 1.491 1.36 0 C-N-CA 123.17 2.58 . . . . 0.0 111.327 167.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.444 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 88.6 m-85 -122.46 152.61 40.1 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 105.176 -2.157 . . . . 0.0 105.176 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -140.2 154.17 46.83 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.496 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.554 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 40.2 t -98.44 117.23 32.38 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -92.26 37.56 0.99 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.554 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 57.2 m -123.39 -43.9 2.16 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 113.339 -1.755 . . . . 0.0 107.31 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 p -118.33 -36.86 3.45 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 123.921 0.763 . . . . 0.0 111.019 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 99.41 55.77 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 126.269 2.23 . . . . 0.0 109.079 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.0 157.42 18.69 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 103.225 -2.88 . . . . 0.0 103.225 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -120.34 158.47 27.05 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.812 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -138.31 171.53 14.25 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.888 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.4 p -96.67 -36.73 10.6 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.108 -1.86 . . . . 0.0 108.273 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.549 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 60.5 mtt85 -116.1 175.99 5.3 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 124.708 1.255 . . . . 0.0 110.96 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.444 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 90.1 p -95.38 -34.25 12.19 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 113.474 -1.694 . . . . 0.0 106.542 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.78 -38.28 90.44 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 104.659 -2.349 . . . . 0.0 104.659 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.549 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 31.5 m170 -59.94 -58.62 7.77 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.6 tp -44.6 -55.52 5.12 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.747 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -51.05 -58.8 5.16 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.193 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.9 m -43.86 -46.17 7.8 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 121.822 0.82 . . . . 0.0 110.159 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -64.32 -56.55 13.7 Favored 'General case' 0 N--CA 1.488 1.438 0 CA-C-N 113.182 -1.827 . . . . 0.0 114.046 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.432 ' C ' ' H ' ' A' ' 24' ' ' THR . 37.9 p -44.07 -30.68 0.78 Allowed 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.253 0.621 . . . . 0.0 110.414 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.04 39.43 0.37 Allowed 'General case' 0 N--CA 1.487 1.42 0 CA-C-N 114.112 -1.404 . . . . 0.0 111.319 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.432 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.5 t -124.37 -27.17 3.81 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 104.687 -2.338 . . . . 0.0 104.687 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 -97.85 -47.53 5.53 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 103.363 -2.828 . . . . 0.0 103.363 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.5 m -111.36 59.2 0.62 Allowed 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -109.92 73.6 0.21 Allowed Glycine 0 N--CA 1.494 2.546 0 N-CA-C 106.594 -2.602 . . . . 0.0 106.594 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -1.1 130.59 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 128.064 2.545 . . . . 0.0 117.554 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.9 mmtm . . . . . 0 N--CA 1.497 1.917 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.309 -179.633 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 120.841 0.353 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -65.01 172.95 6.51 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 123.21 2.607 . . . . 0.0 110.325 148.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.5 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 81.1 m-85 -127.72 159.45 34.72 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 114.011 -1.449 . . . . 0.0 109.228 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -134.82 151.64 51.1 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 119.545 -0.862 . . . . 0.0 113.282 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.45 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 40.8 t -94.73 133.1 38.77 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 113.337 -1.756 . . . . 0.0 106.448 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -100.05 40.36 1.25 Allowed 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.45 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 53.3 m -134.84 -47.12 0.73 Allowed 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 113.026 -1.897 . . . . 0.0 108.453 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 29.9 p -125.33 4.15 7.75 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 123.891 0.744 . . . . 0.0 111.461 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 53.54 52.78 12.65 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 122.752 1.263 . . . . 0.0 110.328 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.408 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 19.4 ttt180 -105.34 154.39 20.35 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 102.666 -3.087 . . . . 0.0 102.666 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -116.93 158.87 23.34 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.903 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -135.91 -176.07 4.18 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 123.723 0.64 . . . . 0.0 110.075 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.5 p -103.09 -41.13 6.19 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 124.67 1.231 . . . . 0.0 110.255 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.476 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 28.7 mtt180 -114.89 163.83 14.99 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 124.169 0.918 . . . . 0.0 109.942 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.5 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 88.4 p -78.5 -33.65 47.98 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -69.49 -35.03 75.17 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 105.64 -1.985 . . . . 0.0 105.64 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.476 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 33.7 m170 -63.06 -59.01 5.37 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.7 tp -42.88 -53.94 4.43 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.857 0.723 . . . . 0.0 109.667 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -53.79 -57.64 10.15 Favored 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 119.875 -0.73 . . . . 0.0 111.468 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.0 m -41.34 -46.46 3.3 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 121.795 0.807 . . . . 0.0 110.142 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.1 t60 -65.49 -56.7 10.93 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 112.974 -1.921 . . . . 0.0 113.507 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.462 ' C ' ' H ' ' A' ' 24' ' ' THR . 45.4 p -52.26 -29.22 21.94 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.8 ttp180 -82.81 42.19 0.77 Allowed 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 123.032 1.396 . . . . 0.0 110.579 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.462 ' H ' ' C ' ' A' ' 22' ' ' THR . 5.9 t -131.52 -22.36 2.45 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 105.556 -2.016 . . . . 0.0 105.556 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -99.23 -48.19 4.92 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 104.832 -2.284 . . . . 0.0 104.832 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 40.7 p -114.45 56.04 0.73 Allowed 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 113.964 -1.471 . . . . 0.0 107.229 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -119.53 -49.07 0.32 Allowed Glycine 0 N--CA 1.496 2.635 0 N-CA-C 108.374 -1.89 . . . . 0.0 108.374 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -91.36 -13.6 32.21 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.071 -1.064 . . . . 0.0 110.17 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.4 tttt . . . . . 0 N--CA 1.495 1.82 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 179.884 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.8 OUTLIER -34.35 154.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 124.432 3.422 . . . . 0.0 114.95 172.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 85.8 m-85 -121.34 157.8 29.62 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 113.384 -1.735 . . . . 0.0 109.64 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.413 HE21 ' HA ' ' A' ' 9' ' ' GLN . 72.8 tp60 -130.73 145.12 51.86 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 124.297 0.998 . . . . 0.0 108.795 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 40.4 t -92.97 138.89 31.08 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.403 ' HA ' HE22 ' A' ' 9' ' ' GLN . 56.3 tttp -105.24 36.1 2.6 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.415 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 31.8 m -131.57 -38.18 1.17 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 114.476 -1.238 . . . . 0.0 109.3 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.3 p -125.25 -39.04 2.24 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.538 -0.865 . . . . 0.0 109.406 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.413 ' HA ' HE21 ' A' ' 4' ' ' GLN . 90.6 mm-40 98.33 60.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 126.587 2.429 . . . . 0.0 109.81 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.2 ttt-85 -112.51 159.43 18.79 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 103.503 -2.777 . . . . 0.0 103.503 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -115.91 158.18 23.39 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.167 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.482 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 93.9 m-85 -139.59 179.65 6.44 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 124.157 0.911 . . . . 0.0 110.051 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.438 ' HG ' ' HD1' ' A' ' 17' ' ' HIS . 47.9 p -107.33 -39.75 5.58 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 124.735 1.272 . . . . 0.0 110.313 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.38 171.11 7.71 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.412 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 65.4 p -84.73 -40.16 17.64 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.407 ' H ' ' HG ' ' A' ' 15' ' ' SER . 1.9 p30 -62.75 -29.71 70.89 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.438 ' HD1' ' HG ' ' A' ' 13' ' ' SER . 37.8 m170 -66.34 -60.84 2.39 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.8 tp -43.6 -47.25 7.46 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 123.752 0.658 . . . . 0.0 111.365 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -58.05 -67.24 0.36 Allowed 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 119.685 -0.806 . . . . 0.0 109.624 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.2 m -35.39 -48.02 0.46 Allowed 'General case' 0 N--CA 1.504 2.231 0 O-C-N 124.641 1.213 . . . . 0.0 110.325 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.482 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 30.1 t60 -57.42 -61.17 2.68 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.654 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.492 ' C ' ' H ' ' A' ' 24' ' ' THR . 56.9 m -52.9 -12.74 0.35 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 124.255 0.972 . . . . 0.0 111.913 -179.648 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -90.46 40.29 1.01 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 123.373 1.559 . . . . 0.0 107.035 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.492 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.3 t -126.09 -26.11 3.45 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 103.585 -2.746 . . . . 0.0 103.585 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -96.2 -55.47 2.94 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 105.287 -2.116 . . . . 0.0 105.287 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 30.3 p -124.52 57.69 1.24 Allowed 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 113.831 -1.531 . . . . 0.0 110.684 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -122.7 -28.56 1.4 Allowed Glycine 0 N--CA 1.497 2.72 0 N-CA-C 108.434 -1.866 . . . . 0.0 108.434 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.458 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.4 mp0 -103.32 47.82 0.87 Allowed 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? . . . . . 0 N--CA 1.493 1.724 0 CA-C-N 113.869 -1.514 . . . . 0.0 108.74 -179.831 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -73.42 161.44 42.52 Favored 'Trans proline' 0 N--CA 1.493 1.476 0 C-N-CA 122.641 2.227 . . . . 0.0 113.148 -173.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.415 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 88.8 m-85 -131.31 162.24 30.52 Favored 'General case' 0 N--CA 1.499 2.0 0 CA-C-N 113.013 -1.903 . . . . 0.0 108.937 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.475 HE21 ' NZ ' ' A' ' 11' ' ' LYS . 50.8 tt0 -139.99 152.45 46.3 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.975 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.47 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 35.7 t -99.56 129.71 45.74 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 105.955 -1.868 . . . . 0.0 105.955 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -99.18 34.31 2.18 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 122.011 0.91 . . . . 0.0 109.445 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.47 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 53.5 m -123.17 -39.7 2.46 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.42 -1.718 . . . . 0.0 107.871 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -124.02 -40.78 2.26 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.292 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 104.41 51.74 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.72 0 O-C-N 126.299 2.249 . . . . 0.0 110.799 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 40.9 ttt85 -110.94 148.87 31.57 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 104.592 -2.373 . . . . 0.0 104.592 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.475 ' NZ ' HE21 ' A' ' 4' ' ' GLN . 2.3 mptp? -112.6 165.16 12.51 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.159 -1.016 . . . . 0.0 110.095 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -138.26 178.5 7.09 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.683 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 38.7 p -101.9 -40.25 6.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 125.175 1.547 . . . . 0.0 109.514 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.19 175.37 5.5 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.304 1.003 . . . . 0.0 109.55 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.415 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 74.8 p -89.84 -34.77 16.0 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.298 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.1 p-10 -65.05 -30.75 71.74 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -62.6 -61.54 2.35 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 106.063 -1.829 . . . . 0.0 106.063 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.2 tp -44.75 -50.99 9.78 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 124.115 0.884 . . . . 0.0 109.655 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -53.47 -60.27 3.52 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.802 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -47.55 -42.33 23.3 Favored 'General case' 0 N--CA 1.5 2.07 0 CA-C-O 121.646 0.736 . . . . 0.0 110.626 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -65.41 -57.65 7.81 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 113.781 -1.554 . . . . 0.0 114.233 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.9 p -45.03 -39.2 5.45 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.602 0.761 . . . . 0.0 111.651 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -82.85 39.02 0.6 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 116.939 -1.905 . . . . 0.0 112.98 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.0 t -121.23 -5.92 9.41 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -96.1 -23.47 16.75 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -115.82 -40.52 3.33 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 124.445 1.091 . . . . 0.0 108.374 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -116.54 49.37 0.86 Allowed Glycine 0 N--CA 1.496 2.693 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.716 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -23.91 114.85 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.175 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt . . . . . 0 N--CA 1.508 2.44 0 N-CA-C 116.543 2.053 . . . . 0.0 116.543 -179.952 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt . . . . . 0 N--CA 1.496 1.864 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -88.12 129.28 2.38 Favored 'Trans proline' 0 C--N 1.32 -0.971 0 C-N-CA 121.926 1.751 . . . . 0.0 112.145 -173.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.478 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 96.6 m-85 -120.72 160.27 23.66 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -147.22 160.61 42.27 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 117.773 -1.571 . . . . 0.0 111.959 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.451 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 43.2 t -93.68 142.41 27.38 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.8 ttpp -107.07 32.76 4.37 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 125.123 1.515 . . . . 0.0 107.606 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.451 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 57.9 m -127.57 -38.31 1.92 Allowed 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 114.514 -1.221 . . . . 0.0 109.378 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.6 p -122.42 -41.03 2.42 Favored 'General case' 0 N--CA 1.499 2.014 0 C-N-CA 119.861 -0.736 . . . . 0.0 111.193 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 101.58 52.36 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 O-C-N 126.53 2.394 . . . . 0.0 109.975 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.22 148.0 33.78 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 103.48 -2.785 . . . . 0.0 103.48 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -112.74 160.68 17.7 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 118.347 -1.341 . . . . 0.0 111.619 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.418 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 83.2 m-85 -131.34 178.89 6.37 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-N 112.615 -2.084 . . . . 0.0 111.131 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 p -103.24 -31.55 10.04 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 125.383 1.677 . . . . 0.0 112.171 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.9 mtp180 -116.5 179.12 4.09 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 124.637 1.211 . . . . 0.0 107.876 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.478 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 89.6 p -108.7 20.74 18.15 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.973 0.892 . . . . 0.0 110.695 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.93 -35.06 3.57 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 55.7 m170 -59.8 -54.25 48.4 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 103.483 -2.784 . . . . 0.0 103.483 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.9 tp -36.83 -55.12 0.91 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 113.267 -1.788 . . . . 0.0 111.561 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.9 tptt -60.28 -59.18 5.83 Favored 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 m -42.68 -31.19 0.44 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 124.511 1.132 . . . . 0.0 111.376 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.418 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 16.2 t60 -82.28 -56.75 3.72 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 113.415 -1.721 . . . . 0.0 112.633 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.443 ' C ' ' H ' ' A' ' 24' ' ' THR . 14.6 m -43.86 -31.53 0.87 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 124.132 0.895 . . . . 0.0 111.522 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.42 43.13 0.53 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 118.5 -1.28 . . . . 0.0 112.453 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.443 ' H ' ' C ' ' A' ' 22' ' ' THR . 8.7 t -120.77 -24.92 5.56 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 103.053 -2.943 . . . . 0.0 103.053 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -90.11 -43.94 10.13 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 103.888 -2.634 . . . . 0.0 103.888 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.8 m -118.43 54.78 0.92 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 104.522 -2.399 . . . . 0.0 104.522 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -6.72 -63.33 0.01 OUTLIER Glycine 0 N--CA 1.502 3.071 0 CA-C-N 112.822 -1.99 . . . . 0.0 116.183 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -99.56 83.12 2.74 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm . . . . . 0 N--CA 1.506 2.338 0 O-C-N 126.396 2.31 . . . . 0.0 108.686 179.782 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt . . . . . 0 N--CA 1.493 1.716 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -94.48 160.57 1.95 Allowed 'Trans proline' 0 C--N 1.314 -1.262 0 C-N-CA 123.047 2.498 . . . . 0.0 111.954 171.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -120.26 157.11 29.84 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 105.564 -2.013 . . . . 0.0 105.564 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.418 HE21 ' HA ' ' A' ' 9' ' ' GLN . 71.1 tp60 -135.8 148.09 48.59 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 120.122 -0.631 . . . . 0.0 112.35 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 16.7 t -99.15 133.67 43.11 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 101.936 -3.357 . . . . 0.0 101.936 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.482 ' HD3' ' N ' ' A' ' 6' ' ' LYS . 3.3 mppt? -105.9 35.27 2.96 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.247 0.967 . . . . 0.0 109.063 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.8 m -123.67 -40.86 2.29 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 113.158 -1.837 . . . . 0.0 106.699 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 24.8 p -130.2 -10.18 4.22 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 123.889 0.743 . . . . 0.0 111.196 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.418 ' HA ' HE21 ' A' ' 4' ' ' GLN . 17.6 mp0 67.65 60.87 0.45 Allowed 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 123.066 1.412 . . . . 0.0 111.018 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -116.13 145.1 43.33 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 102.04 -3.318 . . . . 0.0 102.04 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -107.77 162.33 14.09 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.865 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -140.74 -179.9 6.32 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.565 1.165 . . . . 0.0 110.158 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 64.6 p -102.75 -36.78 8.16 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.13 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.44 -176.9 3.32 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 124.307 1.004 . . . . 0.0 111.366 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 95.6 p -98.53 -37.01 9.73 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.488 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -61.02 -29.46 69.73 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -66.31 -67.89 0.41 Allowed 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 62.1 tp -38.62 -48.28 1.43 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 123.871 0.732 . . . . 0.0 112.373 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -53.82 -67.83 0.23 Allowed 'General case' 0 N--CA 1.499 2.0 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.882 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.2 m -46.71 -36.33 7.04 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 114.183 -1.372 . . . . 0.0 110.624 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 39.8 t60 -66.91 -60.2 2.85 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-N 114.77 -1.105 . . . . 0.0 112.03 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.5 m -50.7 -25.14 3.94 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 121.203 0.525 . . . . 0.0 112.407 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.409 ' NH2' ' HB3' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -58.69 -8.2 1.22 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.446 179.374 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 t -91.46 -3.83 56.2 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.069 0.462 . . . . 0.0 110.205 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 -110.66 -47.22 3.28 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 114.595 -1.184 . . . . 0.0 107.807 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.3 t -108.59 -25.82 10.7 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 116.465 2.024 . . . . 0.0 116.465 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -102.03 59.21 0.59 Allowed Glycine 0 N--CA 1.498 2.828 0 C-N-CA 120.342 -0.932 . . . . 0.0 114.777 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -118.59 51.05 1.12 Allowed 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm . . . . . 0 N--CA 1.494 1.734 0 CA-C-N 113.542 -1.663 . . . . 0.0 109.808 -179.828 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -63.53 174.29 3.68 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 123.672 2.915 . . . . 0.0 113.756 -175.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -121.92 163.43 19.28 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 112.608 -2.087 . . . . 0.0 106.974 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 73.9 tp60 -136.62 146.96 46.63 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.908 0.755 . . . . 0.0 110.952 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.435 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 12.6 t -104.03 130.91 51.72 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 101.342 -3.577 . . . . 0.0 101.342 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -106.47 42.97 1.19 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 122.316 1.055 . . . . 0.0 108.817 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.435 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 94.7 m -126.71 -40.58 1.9 Allowed 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 p -121.4 -32.19 3.91 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 123.987 0.805 . . . . 0.0 108.845 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 89.35 55.83 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 126.25 2.219 . . . . 0.0 109.448 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 44.4 ttt-85 -115.36 154.66 28.79 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.5 167.65 10.55 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 118.852 -1.139 . . . . 0.0 110.349 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.424 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 88.6 m-85 -139.93 -179.76 6.14 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 114.297 -1.319 . . . . 0.0 109.159 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.8 p -104.06 -44.89 4.88 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 124.475 1.11 . . . . 0.0 110.094 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.538 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 23.7 mtt180 -109.96 -176.33 2.97 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.437 1.085 . . . . 0.0 109.428 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.6 p -95.19 -29.93 14.28 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.008 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -76.65 -4.31 42.4 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.538 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 46.1 m170 -97.16 -10.3 26.19 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 124.973 1.421 . . . . 0.0 107.903 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.7 tp -106.46 -54.22 2.51 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.359 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -66.13 -2.08 3.84 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.5 m -105.55 -39.96 5.93 Favored 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 104.254 -2.498 . . . . 0.0 104.254 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.424 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 50.1 t60 -58.54 -57.16 14.19 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.455 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.453 ' C ' ' H ' ' A' ' 24' ' ' THR . 7.7 p -37.26 -40.86 0.36 Allowed 'General case' 0 C--N 1.308 -1.218 0 O-C-N 125.282 1.614 . . . . 0.0 111.55 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.492 ' HA ' ' H ' ' A' ' 27' ' ' GLY . 36.7 mtt180 -76.93 37.97 0.2 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 125.117 1.511 . . . . 0.0 113.066 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.453 ' H ' ' C ' ' A' ' 22' ' ' THR . 11.2 t -115.96 -24.59 8.04 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 103.585 -2.746 . . . . 0.0 103.585 179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -95.74 -34.56 11.87 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 100.705 -3.813 . . . . 0.0 100.705 179.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.484 ' O ' ' N ' ' A' ' 28' ' ' GLU . 92.3 m 114.48 46.39 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 129.977 3.311 . . . . 0.0 106.771 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.492 ' H ' ' HA ' ' A' ' 23' ' ' ARG . . . 16.13 44.79 0.01 OUTLIER Glycine 0 N--CA 1.502 3.099 0 CA-C-N 110.804 -2.907 . . . . 0.0 114.399 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -73.5 158.59 34.62 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 112.101 -2.049 . . . . 0.0 111.906 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm . . . . . 0 N--CA 1.495 1.808 0 CA-C-N 113.765 -1.561 . . . . 0.0 109.508 -179.925 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.456 0.169 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -57.56 165.66 5.78 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 123.661 2.907 . . . . 0.0 112.984 157.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -124.32 163.47 21.63 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-N 113.087 -1.87 . . . . 0.0 108.066 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.0 tp60 -139.7 137.52 35.24 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.884 0.74 . . . . 0.0 109.486 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.427 ' HA ' HD13 ' A' ' 18' ' ' LEU . 44.0 t -84.4 144.21 28.94 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 179.501 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -105.87 32.57 4.27 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 124.743 1.277 . . . . 0.0 108.997 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 97.2 m -135.08 -39.51 0.76 Allowed 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 114.317 -1.31 . . . . 0.0 111.188 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.7 p -119.95 -45.71 2.46 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 119.465 -0.894 . . . . 0.0 109.475 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 103.48 61.51 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 126.942 2.651 . . . . 0.0 110.474 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.6 ttt85 -115.29 158.84 21.79 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 103.273 -2.862 . . . . 0.0 103.273 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.593 ' H ' ' HZ1' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -113.72 163.74 14.62 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 119.231 -0.988 . . . . 0.0 109.759 -179.767 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.488 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 99.2 m-85 -139.98 -179.41 5.94 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 124.553 1.158 . . . . 0.0 110.696 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.3 p -104.43 -37.18 7.29 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 113.637 -1.619 . . . . 0.0 110.57 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.18 -172.32 2.2 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 124.175 0.922 . . . . 0.0 110.567 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 80.2 p -97.4 -33.48 11.39 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -86.54 10.35 15.65 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.465 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -115.87 -18.18 10.81 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 5' ' ' CYS . 36.2 tp -93.46 -57.51 2.57 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.374 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.7 ttmp? -53.1 -64.19 0.9 Allowed 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.2 m -38.93 -43.65 0.98 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.257 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.488 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 22.0 t60 -69.68 -58.5 3.85 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 113.7 -1.591 . . . . 0.0 112.336 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.405 ' N ' ' CD2' ' A' ' 21' ' ' HIS . 21.8 m -45.78 -40.38 9.54 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 121.753 0.787 . . . . 0.0 110.356 -179.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.6 ttp85 -85.11 52.28 2.4 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-O 123.867 1.794 . . . . 0.0 111.865 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.9 t -137.01 -19.78 1.28 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 111.363 -2.653 . . . . 0.0 105.397 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 -71.33 -39.21 71.5 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.8 m -106.4 -49.23 3.39 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 105.572 -2.01 . . . . 0.0 105.572 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.71 -58.73 0.62 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 108.957 -1.657 . . . . 0.0 108.957 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -115.12 129.07 56.58 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 113.472 -1.364 . . . . 0.0 109.127 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.9 mttm . . . . . 0 N--CA 1.496 1.837 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.151 -179.976 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -52.15 139.72 52.36 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 123.192 2.595 . . . . 0.0 116.227 -157.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.415 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 79.0 m-85 -128.66 158.89 37.28 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 112.688 -2.051 . . . . 0.0 107.492 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -142.76 155.81 44.9 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.73 0.776 . . . . 0.0 110.857 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.551 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 15.1 t -104.31 107.89 19.02 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.13 33.58 0.68 Allowed 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 122.514 1.15 . . . . 0.0 110.132 -179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.551 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 35.0 m -112.71 -41.67 3.77 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 112.688 -2.051 . . . . 0.0 106.507 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 32.1 p -121.48 -29.34 4.44 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 124.041 0.838 . . . . 0.0 109.66 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 90.03 60.27 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 O-C-N 125.851 1.97 . . . . 0.0 110.831 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.4 ttt180 -121.05 151.68 39.52 Favored 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 104.627 -2.361 . . . . 0.0 104.627 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -116.28 161.14 19.45 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.417 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 90.3 m-85 -138.22 176.54 8.61 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 113.078 -1.874 . . . . 0.0 109.283 -179.62 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.7 p -102.71 -32.71 9.71 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 124.302 1.001 . . . . 0.0 110.573 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.4 ' CD ' ' CE1' ' A' ' 17' ' ' HIS . 32.7 mtp85 -116.54 176.3 5.17 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 124.484 1.115 . . . . 0.0 110.085 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.415 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 81.7 p -90.25 -36.58 14.65 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -66.16 -40.27 90.4 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 104.194 -2.521 . . . . 0.0 104.194 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.4 ' CE1' ' CD ' ' A' ' 14' ' ' ARG . 39.3 m170 -54.94 -58.92 5.66 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.2 tp -45.47 -52.82 9.7 Favored 'General case' 0 N--CA 1.502 2.132 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -52.54 -55.45 22.07 Favored 'General case' 0 N--CA 1.503 2.189 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.508 ' HA ' ' CZ ' ' A' ' 23' ' ' ARG . 52.9 m -42.94 -46.63 5.47 Favored 'General case' 0 N--CA 1.505 2.313 0 CA-C-O 121.612 0.72 . . . . 0.0 109.775 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.417 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 61.2 t60 -64.72 -56.81 11.37 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 113.359 -1.746 . . . . 0.0 114.588 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 48.7 p -43.77 -34.63 1.6 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.508 ' CZ ' ' HA ' ' A' ' 20' ' ' THR . 66.9 mtt85 -42.85 -23.62 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 179.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.2 t -95.29 19.6 10.48 Favored 'General case' 0 N--CA 1.512 2.631 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 31.2 m-70 -124.17 -43.17 2.09 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 104.226 -2.509 . . . . 0.0 104.226 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 64.5 m -72.14 -48.34 44.31 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 104.286 -2.487 . . . . 0.0 104.286 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -108.18 47.38 1.05 Allowed Glycine 0 N--CA 1.488 2.102 1 N-CA-C 101.405 -4.678 . . . . 0.0 101.405 179.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -13.98 -94.47 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 111.088 -2.556 . . . . 0.0 117.325 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.5 pttt . . . . . 0 N--CA 1.493 1.682 0 O-C-N 124.852 1.345 . . . . 0.0 110.804 -179.752 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.4 ptmm? . . . . . 0 N--CA 1.492 1.642 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -73.01 167.17 28.08 Favored 'Trans proline' 0 N--CA 1.49 1.301 0 C-N-CA 122.783 2.322 . . . . 0.0 110.32 167.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.457 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 57.4 m-85 -123.67 161.25 25.47 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 113.577 -1.647 . . . . 0.0 107.631 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -130.43 149.27 52.18 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 124.188 0.93 . . . . 0.0 111.149 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.483 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 42.1 t -99.16 125.83 44.8 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 103.814 -2.661 . . . . 0.0 103.814 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -97.18 40.47 1.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 122.476 1.131 . . . . 0.0 108.644 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.483 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.7 m -131.6 -46.98 0.97 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 112.534 -2.121 . . . . 0.0 107.045 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 p -129.52 7.18 5.28 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 123.94 0.775 . . . . 0.0 112.731 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.6 mm-40 51.36 57.51 6.53 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-O 122.735 1.255 . . . . 0.0 111.765 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.5 ttt180 -118.08 140.94 49.03 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 103.123 -2.918 . . . . 0.0 103.123 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -105.52 165.97 10.77 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -179.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -140.76 -171.46 3.24 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 113.428 -1.715 . . . . 0.0 110.446 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.6 p -106.38 -39.17 5.98 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 124.438 1.086 . . . . 0.0 110.571 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.7 mtp-105 -119.09 179.94 4.01 Favored 'General case' 0 N--CA 1.5 2.071 0 CA-C-O 121.78 0.8 . . . . 0.0 109.77 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.457 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 80.3 p -94.08 -33.09 13.51 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -76.49 -3.39 37.06 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -95.9 -56.03 2.8 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 101.575 -3.491 . . . . 0.0 101.575 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 69.1 tp -46.47 -50.48 16.87 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -52.06 -64.72 0.72 Allowed 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.5 m -40.22 -43.61 1.72 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.329 0.585 . . . . 0.0 110.68 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 41.0 t60 -64.64 -59.36 4.37 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 114.103 -1.408 . . . . 0.0 112.33 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.8 p -45.35 -34.57 3.08 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -43.07 -25.01 0.09 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.1 t -92.38 9.57 33.61 Favored 'General case' 0 N--CA 1.511 2.586 0 N-CA-C 116.165 1.913 . . . . 0.0 116.165 -179.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 27.5 m-70 -107.1 -38.78 5.91 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 104.55 -2.389 . . . . 0.0 104.55 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.544 ' HG1' ' H ' ' A' ' 27' ' ' GLY . 25.5 p -83.5 -54.58 4.85 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 113.319 -1.764 . . . . 0.0 108.934 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.544 ' H ' ' HG1' ' A' ' 26' ' ' THR . . . 100.1 -46.69 1.35 Allowed Glycine 0 N--CA 1.491 2.355 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.973 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -105.82 -41.49 5.41 Favored 'General case' 0 N--CA 1.496 1.863 0 CA-C-N 114.076 -1.062 . . . . 0.0 111.92 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt . . . . . 0 N--CA 1.499 1.993 0 O-C-N 124.457 1.098 . . . . 0.0 109.933 -179.838 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 120.991 0.424 . . . . 0.0 110.94 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -61.64 145.25 97.73 Favored 'Trans proline' 0 N--CA 1.491 1.357 0 C-N-CA 122.326 2.017 . . . . 0.0 109.481 170.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.469 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 81.7 m-85 -120.56 155.17 34.24 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -141.0 154.96 46.27 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.19 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.7 t -92.55 140.81 29.18 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 114.149 -1.387 . . . . 0.0 107.806 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.471 ' H ' ' HD3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -100.38 29.1 4.55 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 114.759 -1.109 . . . . 0.0 109.851 -179.727 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.463 HG23 ' CG ' ' A' ' 25' ' ' HIS . 56.0 m -129.6 -43.0 1.27 Allowed 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 114.097 -1.41 . . . . 0.0 110.764 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.1 p -125.25 -0.83 7.68 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 119.568 -0.853 . . . . 0.0 110.027 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 54.35 60.37 3.61 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 122.948 1.356 . . . . 0.0 110.556 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -112.44 149.97 31.83 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 103.302 -2.851 . . . . 0.0 103.302 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -110.99 160.22 17.01 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 119.085 -1.046 . . . . 0.0 112.025 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -137.58 175.41 9.63 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 114.495 -1.229 . . . . 0.0 109.528 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.2 p -98.58 -40.81 8.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 124.708 1.255 . . . . 0.0 110.41 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.454 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 42.6 mtt180 -113.77 167.24 10.79 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 124.258 0.974 . . . . 0.0 110.09 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.469 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 84.3 p -81.64 -36.15 29.2 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.4 ' N ' ' HG ' ' A' ' 15' ' ' SER . 1.1 p30 -64.92 -30.72 71.73 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.454 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.7 m170 -66.97 -60.38 2.68 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 tp -43.29 -52.52 5.71 Favored 'General case' 0 N--CA 1.503 2.191 0 CA-C-O 121.303 0.573 . . . . 0.0 110.603 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -49.45 -65.4 0.57 Allowed 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.832 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 85.8 m -43.82 -44.74 7.0 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.853 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -58.71 -60.29 4.06 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.4 m -45.35 -21.9 0.11 Allowed 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 114.861 -1.063 . . . . 0.0 113.734 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.1 ptt-85 -50.12 -24.6 2.84 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.3 t -82.24 7.17 14.47 Favored 'General case' 0 N--CA 1.505 2.28 0 CA-C-O 121.45 0.643 . . . . 0.0 112.183 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.463 ' CG ' HG23 ' A' ' 7' ' ' THR . 59.8 m-70 -124.26 -50.9 1.77 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.198 -1.365 . . . . 0.0 109.958 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.4 m -101.86 -29.54 11.79 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-N 112.696 -2.047 . . . . 0.0 114.065 -179.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -99.84 34.71 5.27 Favored Glycine 0 N--CA 1.5 2.945 0 C-N-CA 119.996 -1.097 . . . . 0.0 112.209 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -132.72 -59.1 0.91 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.3 pttm . . . . . 0 N--CA 1.497 1.884 0 CA-C-N 112.984 -1.916 . . . . 0.0 109.773 179.899 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -73.6 161.91 41.01 Favored 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 122.736 2.291 . . . . 0.0 112.053 174.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -125.66 155.78 40.3 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 112.238 -2.255 . . . . 0.0 106.19 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -136.2 152.08 50.4 Favored 'General case' 0 N--CA 1.499 1.975 0 C-N-CA 119.221 -0.992 . . . . 0.0 112.212 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.542 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 27.0 t -101.11 109.12 20.97 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.455 ' H ' ' HD2' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -88.06 39.68 0.91 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.542 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 27.6 m -122.76 -39.8 2.49 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 113.195 -1.82 . . . . 0.0 106.808 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.428 ' O ' ' CB ' ' A' ' 9' ' ' GLN . 31.4 p -125.21 -32.74 2.94 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.428 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 1.0 OUTLIER 93.72 57.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 126.358 2.286 . . . . 0.0 110.201 179.693 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.45 155.83 29.0 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -118.71 161.43 20.11 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.497 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 82.5 m-85 -137.94 -175.49 4.11 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.357 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.5 p -105.03 -37.51 6.92 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 124.24 0.963 . . . . 0.0 111.246 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.503 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 54.7 mtt85 -118.69 -175.7 2.94 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 123.804 0.69 . . . . 0.0 110.423 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.416 ' C ' ' H ' ' A' ' 17' ' ' HIS . 88.6 p -93.07 -33.51 14.05 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -76.51 3.21 11.8 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.503 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 39.1 m170 -103.04 -42.22 5.86 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.7 tp -65.56 -49.45 68.8 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.155 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -55.61 -64.43 0.85 Allowed 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 47.3 m -41.07 -38.42 1.02 Allowed 'General case' 0 N--CA 1.503 2.19 0 O-C-N 124.278 0.986 . . . . 0.0 111.968 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 46.5 t60 -73.36 -55.33 6.53 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.5 m -49.48 -23.34 1.52 Allowed 'General case' 0 N--CA 1.508 2.453 0 CA-C-O 120.931 0.396 . . . . 0.0 112.04 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -48.64 -26.95 2.52 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.098 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.0 p -79.66 5.48 13.14 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -122.43 -56.86 1.78 Allowed 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.3 m -127.0 57.03 1.48 Allowed 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 113.183 -1.826 . . . . 0.0 111.053 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -121.55 57.34 0.61 Allowed Glycine 0 N--CA 1.497 2.764 0 N-CA-C 109.044 -1.622 . . . . 0.0 109.044 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -117.91 60.68 0.77 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 88.3 tttt . . . . . 0 N--CA 1.497 1.911 0 CA-C-N 114.528 -1.214 . . . . 0.0 109.181 -179.796 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 120.405 0.145 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -76.99 146.97 26.3 Favored 'Trans proline' 0 C--N 1.315 -1.194 0 C-N-CA 122.804 2.336 . . . . 0.0 107.521 162.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.413 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 38.8 m-85 -119.95 157.09 29.53 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -139.89 155.62 47.1 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.958 -0.697 . . . . 0.0 109.887 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.6 t -91.68 142.52 27.52 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.8 mmmp? -104.71 38.4 1.91 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 115.107 -0.951 . . . . 0.0 108.999 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.8 m -136.14 -43.12 0.64 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 113.266 -1.788 . . . . 0.0 110.223 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.1 p -118.34 -40.83 2.89 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 124.123 0.89 . . . . 0.0 110.09 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 93.86 56.61 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.976 0 O-C-N 126.778 2.549 . . . . 0.0 110.57 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.531 ' NH1' ' CE1' ' A' ' 12' ' ' PHE . 41.2 ttt-85 -107.5 157.98 17.58 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 101.034 -3.691 . . . . 0.0 101.034 179.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.66 167.38 10.27 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 118.647 -1.221 . . . . 0.0 113.041 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.531 ' CE1' ' NH1' ' A' ' 10' ' ' ARG . 94.5 m-85 -144.96 177.03 9.04 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 113.612 -1.631 . . . . 0.0 108.12 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 81.8 p -104.61 -34.04 8.31 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.543 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 31.6 mtt180 -119.86 -173.86 2.63 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 113.744 -1.571 . . . . 0.0 111.697 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.413 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 38.3 p -95.71 -33.81 12.17 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.859 -1.519 . . . . 0.0 108.374 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -70.35 -35.18 73.41 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.543 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 36.7 m170 -64.74 -13.77 56.24 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 124.512 1.133 . . . . 0.0 110.742 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.5 tp -100.08 -50.8 3.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 123.973 0.796 . . . . 0.0 109.733 -179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.31 -32.35 64.54 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 119.799 -0.761 . . . . 0.0 112.009 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.0 m -74.63 -42.11 59.18 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.437 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 43.5 t60 -56.2 -58.15 9.17 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.428 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.0 p -42.16 -24.45 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.566 1.547 . . . . 0.0 113.795 -179.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.4 mtt85 -70.84 10.3 0.54 Allowed 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 114.627 -1.169 . . . . 0.0 111.358 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.428 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.3 t -106.95 -2.36 21.29 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -108.28 -54.17 2.54 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.2 m -124.92 47.65 2.11 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.59 -41.38 0.07 OUTLIER Glycine 0 N--CA 1.493 2.436 0 CA-C-N 113.55 -1.659 . . . . 0.0 110.373 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.69 -56.5 2.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.081 0.518 . . . . 0.0 109.719 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.506 2.333 0 N-CA-C 117.463 2.394 . . . . 0.0 117.463 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 68.9 mttm . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -49.33 155.06 3.46 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.682 2.921 . . . . 0.0 114.078 177.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -127.31 153.08 46.62 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 112.586 -2.097 . . . . 0.0 106.883 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -130.21 139.46 50.81 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.51 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 44.8 t -91.35 105.12 17.55 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 101.537 -3.505 . . . . 0.0 101.537 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.1 pttt -90.34 42.95 1.12 Allowed 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 123.021 1.391 . . . . 0.0 108.29 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.51 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 26.1 m -124.34 -42.77 2.09 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 111.686 -2.506 . . . . 0.0 105.164 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.4 p -123.32 -35.98 2.88 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 123.838 0.711 . . . . 0.0 109.757 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 94.38 66.0 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 O-C-N 126.307 2.254 . . . . 0.0 111.711 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.4 ttt85 -122.1 153.89 38.08 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 104.029 -2.582 . . . . 0.0 104.029 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -112.51 156.41 22.66 Favored 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 119.647 -0.821 . . . . 0.0 112.671 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -140.94 -179.55 6.14 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 113.919 -1.492 . . . . 0.0 108.417 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 56.3 p -108.28 -37.42 6.01 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 124.147 0.904 . . . . 0.0 110.139 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.481 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 52.9 mtt85 -118.92 179.09 4.25 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 124.606 1.191 . . . . 0.0 111.719 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.435 ' C ' ' H ' ' A' ' 17' ' ' HIS . 92.8 p -94.38 -29.01 15.22 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 113.283 -1.78 . . . . 0.0 107.134 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -83.26 13.52 4.2 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.481 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 35.9 m170 -113.34 -57.58 2.27 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 101.111 -3.662 . . . . 0.0 101.111 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.9 tp -47.65 -46.26 28.75 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -51.26 -65.69 0.51 Allowed 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.3 m -39.74 -46.05 1.83 Allowed 'General case' 0 N--CA 1.502 2.135 0 CA-C-O 121.793 0.806 . . . . 0.0 111.016 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.5 t60 -63.67 -55.47 23.21 Favored 'General case' 0 N--CA 1.495 1.786 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.501 ' C ' ' H ' ' A' ' 24' ' ' THR . 21.6 p -47.77 -16.19 0.07 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -179.534 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -75.01 23.16 0.1 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.542 -1.263 . . . . 0.0 111.68 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.501 ' H ' ' C ' ' A' ' 22' ' ' THR . 25.5 p -114.47 -14.37 12.15 Favored 'General case' 0 N--CA 1.498 1.928 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 -111.39 -44.67 3.5 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 55.4 m -113.01 60.98 0.64 Allowed 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 114.16 -1.382 . . . . 0.0 107.326 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -113.41 55.5 0.51 Allowed Glycine 0 N--CA 1.495 2.57 0 N-CA-C 108.451 -1.859 . . . . 0.0 108.451 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -118.01 155.84 29.59 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.9 mmmp? . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 122.634 1.207 . . . . 0.0 109.561 -179.908 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 120.771 0.32 . . . . 0.0 110.731 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -44.75 160.56 0.1 Allowed 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 123.582 2.855 . . . . 0.0 113.948 165.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -121.79 153.24 38.57 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 112.577 -2.102 . . . . 0.0 106.548 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -135.41 152.94 51.89 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 119.574 -0.85 . . . . 0.0 109.298 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 28.9 t -91.79 146.66 23.59 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 114.656 -1.156 . . . . 0.0 108.57 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -105.48 36.89 2.36 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 121.905 0.859 . . . . 0.0 109.612 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.488 HG23 ' CG ' ' A' ' 25' ' ' HIS . 90.0 m -134.12 -45.15 0.78 Allowed 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 113.491 -1.686 . . . . 0.0 110.149 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.0 p -120.85 -24.34 5.69 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 124.218 0.949 . . . . 0.0 110.272 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.7 mp0 75.79 56.69 0.06 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 125.308 1.63 . . . . 0.0 109.556 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.7 ttt85 -109.63 153.47 24.16 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 101.481 -3.526 . . . . 0.0 101.481 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HZ1' ' HB2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -114.67 163.79 14.95 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 118.708 -1.197 . . . . 0.0 112.624 -179.79 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.448 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 84.4 m-85 -138.17 177.83 7.58 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.801 -1.545 . . . . 0.0 108.01 -179.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 p -101.72 -35.14 9.18 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 124.042 0.839 . . . . 0.0 111.534 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.4 mtp-105 -118.14 179.13 4.19 Favored 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 85.5 p -89.38 -40.42 12.76 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -62.09 -22.85 66.13 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -75.11 -58.8 3.06 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 105.739 -1.948 . . . . 0.0 105.739 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.5 tp -43.98 -48.74 8.72 Favored 'General case' 0 N--CA 1.504 2.236 0 CA-C-O 121.312 0.577 . . . . 0.0 110.019 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -54.82 -59.49 4.65 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 73.1 m -45.43 -43.56 11.46 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-O 121.285 0.564 . . . . 0.0 110.649 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.448 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 68.1 t60 -63.3 -61.68 2.2 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 114.108 -1.405 . . . . 0.0 113.38 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.9 p -43.82 -31.91 0.94 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.451 ' CZ ' ' HA ' ' A' ' 23' ' ' ARG . 0.2 OUTLIER -44.35 -29.01 0.61 Allowed 'General case' 0 N--CA 1.489 1.48 0 CA-C-N 114.396 -1.275 . . . . 0.0 113.631 179.429 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.4 t -86.22 9.51 17.39 Favored 'General case' 0 N--CA 1.507 2.412 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.488 ' CG ' HG23 ' A' ' 7' ' ' THR . 39.8 m-70 -119.66 -47.92 2.4 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 60.3 m -56.44 -48.99 75.88 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-N 113.629 -1.623 . . . . 0.0 111.541 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 25.27 48.14 0.03 OUTLIER Glycine 0 N--CA 1.496 2.647 0 O-C-N 126.416 2.323 . . . . 0.0 112.868 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.47 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 11.5 mp0 8.98 62.92 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 126.858 2.063 . . . . 0.0 116.329 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.1 tptt . . . . . 0 N--CA 1.499 2.016 0 CA-C-N 113.759 -1.564 . . . . 0.0 109.513 179.83 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.462 ' H3 ' ' HD2' ' A' ' 1' ' ' LYS . 2.0 mptp? . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -77.72 152.54 29.22 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 123.022 2.482 . . . . 0.0 109.978 165.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.416 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 70.8 m-85 -128.95 161.41 29.97 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-N 112.963 -1.926 . . . . 0.0 108.138 179.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -138.08 156.76 47.46 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 123.717 0.636 . . . . 0.0 111.017 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 44.3 t -97.34 136.04 38.37 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 179.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -100.89 36.93 1.83 Allowed 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 122.03 0.919 . . . . 0.0 109.191 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.415 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 59.6 m -131.72 -43.57 1.0 Allowed 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.594 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.7 p -118.98 -26.42 6.0 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 123.92 0.763 . . . . 0.0 110.188 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 78.87 56.68 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 125.359 1.662 . . . . 0.0 109.278 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.06 157.82 22.04 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 103.286 -2.857 . . . . 0.0 103.286 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -117.27 163.2 16.68 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 118.924 -1.11 . . . . 0.0 113.042 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.42 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 81.6 m-85 -140.01 -177.61 5.07 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 113.522 -1.672 . . . . 0.0 108.824 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.423 ' HG ' ' HD1' ' A' ' 17' ' ' HIS . 39.1 p -107.59 -24.02 11.92 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.188 0.93 . . . . 0.0 111.721 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.8 mtp180 -125.18 170.08 11.59 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 123.569 0.543 . . . . 0.0 110.182 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.416 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 82.8 p -96.93 15.79 21.27 Favored 'General case' 0 N--CA 1.503 2.182 0 CA-C-O 121.667 0.746 . . . . 0.0 110.066 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.76 -29.41 4.34 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.423 ' HD1' ' HG ' ' A' ' 13' ' ' SER . 35.6 m170 -67.79 -50.74 55.29 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 100.223 -3.991 . . . . 0.0 100.223 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.9 tp -57.26 -46.17 83.32 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 113.873 -1.512 . . . . 0.0 109.144 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 ttmm -64.69 -9.81 22.55 Favored 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.4 m -99.31 -41.58 7.38 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 103.567 -2.753 . . . . 0.0 103.567 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.42 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 55.1 t60 -54.67 -57.66 10.58 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 113.975 -1.466 . . . . 0.0 111.27 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.492 ' C ' ' H ' ' A' ' 24' ' ' THR . 9.9 p -42.33 -24.56 0.05 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 125.426 1.49 . . . . 0.0 113.185 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.4 mtt180 -81.36 34.21 0.37 Allowed 'General case' 0 N--CA 1.486 1.37 0 O-C-N 124.459 1.1 . . . . 0.0 110.536 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.492 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.7 t -124.54 -10.47 7.38 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 -111.7 -56.29 2.4 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.484 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.9 m -119.2 51.79 1.11 Allowed 'General case' 0 N--CA 1.501 2.096 0 CA-C-O 122.623 1.202 . . . . 0.0 109.216 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -125.6 56.93 0.7 Allowed Glycine 0 N--CA 1.493 2.47 0 N-CA-C 105.881 -2.888 . . . . 0.0 105.881 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -122.1 -60.24 1.59 Allowed 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt . . . . . 0 N--CA 1.509 2.48 0 O-C-N 125.658 1.849 . . . . 0.0 115.844 -179.638 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.411 ' HB2' ' HD2' ' A' ' 2' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.833 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 . . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.411 ' HD2' ' HB2' ' A' ' 1' ' ' LYS . 18.3 Cg_endo -46.6 161.56 0.18 Allowed 'Trans proline' 0 N--CA 1.503 2.068 0 C-N-CA 121.9 1.733 . . . . 0.0 112.906 167.307 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.427 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 61.8 m-85 -122.41 164.02 18.77 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 113.695 -1.593 . . . . 0.0 109.367 -179.829 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -135.25 151.07 50.24 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 124.495 1.122 . . . . 0.0 108.334 179.458 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.518 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 42.9 t -98.99 130.57 45.34 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -102.37 40.34 1.37 Allowed 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 122.731 1.253 . . . . 0.0 108.856 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.518 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 32.8 m -126.69 -41.07 1.87 Allowed 'General case' 0 N--CA 1.485 1.325 0 CA-C-N 112.32 -2.218 . . . . 0.0 105.727 179.481 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 28.4 p -122.93 -44.95 2.17 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 123.904 0.752 . . . . 0.0 111.375 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 104.22 57.67 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 127.523 2.329 . . . . 0.0 107.794 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.465 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 33.2 ttt180 -112.48 162.66 15.36 Favored 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 179.796 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -122.44 159.83 26.77 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.598 -0.841 . . . . 0.0 112.423 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.1 m-85 -140.63 -173.89 3.82 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 124.405 1.065 . . . . 0.0 109.596 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.4 p -108.39 -40.26 5.19 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.575 -179.803 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.573 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.2 mtt180 -112.41 179.54 3.96 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 124.142 0.901 . . . . 0.0 110.112 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.427 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 87.7 p -100.38 0.56 40.16 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 114.411 -1.268 . . . . 0.0 107.658 179.791 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -112.03 7.86 19.94 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 179.485 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.573 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 39.5 m170 -114.44 -14.8 12.14 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.4 tp -92.27 -34.67 14.15 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 179.852 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.474 ' HB3' ' HZ1' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -80.2 -40.96 26.12 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.85 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.8 m -66.27 -8.78 26.94 Favored 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 179.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.543 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 13.0 t60 -98.34 -56.07 2.58 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.377 179.38 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 94.2 m -54.06 -17.81 3.03 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -179.458 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.8 ptt180 -66.34 4.78 0.66 Allowed 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 119.299 -0.96 . . . . 0.0 113.323 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 72.9 p -105.42 0.14 26.57 Favored 'General case' 0 N--CA 1.505 2.299 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.569 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 -106.99 -46.49 3.91 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 179.964 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 28.0 m -101.15 -26.9 13.51 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.656 -179.647 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -98.98 53.01 1.08 Allowed Glycine 0 N--CA 1.5 2.905 0 N-CA-C 106.828 -2.509 . . . . 0.0 106.828 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -132.41 179.35 6.18 Favored 'General case' 0 N--CA 1.499 2.011 0 CA-C-N 113.088 -1.556 . . . . 0.0 110.066 -179.715 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 mmmt . . . . . 0 N--CA 1.501 2.118 0 CA-C-O 122.193 0.997 . . . . 0.0 108.93 179.693 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.5 OUTLIER -86.52 163.73 9.46 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 123.514 2.809 . . . . 0.0 111.971 -175.535 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -125.69 164.29 20.94 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 113.501 -1.681 . . . . 0.0 107.54 179.784 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.43 HE21 ' HA ' ' A' ' 9' ' ' GLN . 70.0 tp60 -135.27 152.08 51.17 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 123.818 0.699 . . . . 0.0 110.118 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.42 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 32.0 t -100.33 136.54 40.06 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 179.511 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -105.33 36.97 2.32 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 124.908 1.38 . . . . 0.0 108.25 -179.939 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.42 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 14.3 m -130.25 -42.23 1.22 Allowed 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 113.358 -1.747 . . . . 0.0 108.947 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.9 p -120.28 -45.9 2.42 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.953 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.43 ' HA ' HE21 ' A' ' 4' ' ' GLN . 97.7 mm-40 105.55 60.75 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 126.983 2.677 . . . . 0.0 110.51 179.933 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.415 ' NH1' ' CE1' ' A' ' 12' ' ' PHE . 45.9 ttt-85 -114.16 154.45 27.82 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 102.878 -3.008 . . . . 0.0 102.878 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -111.29 163.44 13.95 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.299 -0.961 . . . . 0.0 110.421 -179.758 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.498 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 92.9 m-85 -141.24 -173.72 3.82 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 124.532 1.145 . . . . 0.0 109.639 -179.725 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.491 ' HG ' ' HD1' ' A' ' 17' ' ' HIS . 21.4 p -108.87 -38.86 5.49 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 124.604 1.19 . . . . 0.0 109.702 -179.965 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.423 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 46.9 mtt180 -119.16 -176.95 3.23 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 124.102 0.876 . . . . 0.0 110.67 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 81.1 p -95.0 -36.97 11.35 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.182 -179.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -64.84 -33.97 77.27 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 104.036 -2.579 . . . . 0.0 104.036 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.491 ' HD1' ' HG ' ' A' ' 13' ' ' SER . 47.6 m170 -59.83 -57.22 13.85 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 106.279 -1.749 . . . . 0.0 106.279 179.491 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.1 tp -47.03 -47.81 22.23 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.037 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.6 mttp -60.21 -50.66 72.8 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 118.354 -1.338 . . . . 0.0 110.834 179.473 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.5 m -47.59 -46.25 28.08 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 179.545 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.498 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 62.7 t60 -60.58 -56.44 21.29 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 113.221 -1.809 . . . . 0.0 114.406 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.494 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.1 p -50.46 -14.44 0.18 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -89.52 39.59 0.95 Allowed 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 179.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.494 ' H ' ' C ' ' A' ' 22' ' ' THR . 95.5 m -131.75 -11.72 3.42 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 112.487 -2.142 . . . . 0.0 107.481 179.839 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 50.4 m-70 -107.22 -44.8 4.26 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 179.843 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 63.8 p -100.64 -15.43 17.76 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 114.071 -1.422 . . . . 0.0 109.536 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -116.39 54.06 0.6 Allowed Glycine 0 N--CA 1.498 2.812 0 N-CA-C 108.884 -1.686 . . . . 0.0 108.884 179.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -132.79 172.4 12.62 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-N 114.541 -0.83 . . . . 0.0 110.007 -179.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.6 mptt . . . . . 0 N--CA 1.511 2.596 0 N-CA-C 116.434 2.012 . . . . 0.0 116.434 179.97 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.455 ' H3 ' ' CD ' ' A' ' 1' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.811 . . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -66.97 159.46 51.77 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 123.147 2.565 . . . . 0.0 113.226 -177.063 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -127.23 161.17 29.19 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 112.942 -1.935 . . . . 0.0 107.257 179.738 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -140.08 149.57 43.26 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.427 179.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.508 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 37.0 t -98.36 121.37 40.21 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 103.785 -2.672 . . . . 0.0 103.785 179.439 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -95.57 41.27 1.1 Allowed 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.508 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 22.4 m -128.95 -42.13 1.41 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 113.406 -1.725 . . . . 0.0 108.55 -179.935 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.3 p -120.25 -42.32 2.58 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 123.96 0.788 . . . . 0.0 109.119 -179.957 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 102.75 57.66 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.975 0 O-C-N 126.888 2.617 . . . . 0.0 111.163 179.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.07 155.34 26.13 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 103.171 -2.9 . . . . 0.0 103.171 179.45 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -113.47 163.08 15.35 Favored 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.8 -179.737 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.412 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.2 m-85 -140.97 -178.09 5.4 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 124.264 0.978 . . . . 0.0 109.135 -179.802 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.0 p -105.85 -37.19 6.77 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 124.955 1.409 . . . . 0.0 111.002 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.8 mtp-105 -118.66 -178.85 3.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 124.424 1.078 . . . . 0.0 109.942 179.975 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 74.1 p -93.6 -34.82 13.17 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.14 179.905 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -74.96 0.54 15.45 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -97.61 -52.82 3.63 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 102.051 -3.315 . . . . 0.0 102.051 179.493 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.8 tp -52.26 -47.52 65.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 124.157 0.911 . . . . 0.0 108.917 179.547 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -59.5 -55.75 30.68 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.585 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 65.8 m -52.87 -25.25 11.04 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.025 0.441 . . . . 0.0 111.173 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.412 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 66.4 t60 -82.98 -55.87 4.13 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.341 179.677 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.432 ' C ' ' H ' ' A' ' 24' ' ' THR . 8.1 p -45.95 -37.28 6.27 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.174 0.99 . . . . 0.0 112.602 -179.544 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -64.02 10.95 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 118.693 -1.203 . . . . 0.0 114.013 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.432 ' H ' ' C ' ' A' ' 22' ' ' THR . 11.8 t -105.06 -7.14 19.37 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.682 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 -102.95 -55.67 2.38 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.7 m -128.55 47.08 2.49 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 124.349 1.031 . . . . 0.0 108.904 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -140.81 -43.52 0.07 OUTLIER Glycine 0 N--CA 1.497 2.755 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 179.822 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -103.37 165.39 11.06 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 113.454 -1.373 . . . . 0.0 109.313 -179.853 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.5 pttt . . . . . 0 N--CA 1.495 1.778 0 CA-C-N 113.988 -1.46 . . . . 0.0 111.788 -179.646 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -50.63 163.44 0.71 Allowed 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 122.829 2.353 . . . . 0.0 112.472 169.355 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -129.05 149.95 50.65 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.665 -1.607 . . . . 0.0 107.159 179.907 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.4 HE21 ' HA ' ' A' ' 9' ' ' GLN . 71.5 tp60 -124.54 141.82 51.81 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 123.971 0.794 . . . . 0.0 109.415 179.97 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.46 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 49.6 t -91.73 119.71 31.82 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 101.82 -3.4 . . . . 0.0 101.82 179.49 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -95.05 39.27 1.11 Allowed 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 -179.688 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.46 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 24.0 m -128.7 -44.62 1.34 Allowed 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 113.106 -1.861 . . . . 0.0 108.234 179.963 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.9 p -119.65 -34.05 3.87 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 119.759 -0.777 . . . . 0.0 109.403 -179.838 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.4 ' HA ' HE21 ' A' ' 4' ' ' GLN . 4.3 mp0 91.77 64.33 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 126.38 2.3 . . . . 0.0 111.359 179.712 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.56 152.84 36.34 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 104.058 -2.571 . . . . 0.0 104.058 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -113.56 155.07 26.07 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 119.187 -1.005 . . . . 0.0 110.553 -179.691 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -135.4 -172.03 2.97 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.184 -179.694 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.1 p -108.98 -42.8 4.35 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 113.605 -1.634 . . . . 0.0 111.458 -179.84 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.534 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 55.5 mtt180 -114.6 170.28 8.43 Favored 'General case' 0 N--CA 1.506 2.342 0 CA-C-O 121.839 0.828 . . . . 0.0 111.815 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.439 ' HG ' ' H ' ' A' ' 16' ' ' ASP . 69.3 p -82.39 -39.16 23.08 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 179.939 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.439 ' H ' ' HG ' ' A' ' 15' ' ' SER . 1.0 OUTLIER -67.47 -27.55 67.12 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 179.864 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.534 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 45.7 m170 -71.16 -60.29 2.31 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 104.418 -2.438 . . . . 0.0 104.418 179.491 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.5 tp -41.44 -52.05 3.68 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 123.801 0.688 . . . . 0.0 109.431 179.41 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -47.04 -69.02 0.14 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.713 0.633 . . . . 0.0 110.796 179.471 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.442 ' HA ' ' NH1' ' A' ' 23' ' ' ARG . 56.0 m -42.66 -42.03 3.32 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.936 -179.91 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -66.46 -61.81 1.8 Allowed 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 113.915 -1.493 . . . . 0.0 113.611 179.983 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.3 m -41.85 -45.69 3.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 124.382 1.051 . . . . 0.0 111.605 -178.925 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.442 ' NH1' ' HA ' ' A' ' 20' ' ' THR . 37.6 ttp180 -34.7 -31.9 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 O-C-N 125.97 2.044 . . . . 0.0 114.792 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.3 t -77.18 14.39 0.92 Allowed 'General case' 0 N--CA 1.506 2.329 0 CA-C-O 121.765 0.793 . . . . 0.0 112.667 -179.659 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.0 m-70 -112.73 -2.17 14.54 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 114.039 -1.437 . . . . 0.0 107.784 179.562 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -120.06 -46.29 2.43 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.933 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 15.1 48.49 0.01 OUTLIER Glycine 0 N--CA 1.498 2.819 0 O-C-N 126.288 2.243 . . . . 0.0 117.329 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -116.07 129.58 56.41 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 179.58 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.7 pttm . . . . . 0 N--CA 1.51 2.532 0 N-CA-C 116.852 2.167 . . . . 0.0 116.852 -179.849 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 59.1 tttp . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -81.83 153.47 17.27 Favored 'Trans proline' 0 N--CA 1.49 1.277 0 C-N-CA 123.501 2.801 . . . . 0.0 109.554 173.894 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -121.9 159.9 25.9 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 113.05 -1.886 . . . . 0.0 107.055 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -140.31 150.49 44.07 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.489 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 31.9 t -87.25 144.59 26.74 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 179.596 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -102.54 32.16 3.73 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.162 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 39.9 m -131.57 -40.88 1.08 Allowed 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 114.124 -1.398 . . . . 0.0 110.178 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.9 p -121.34 -42.13 2.47 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 124.011 0.819 . . . . 0.0 111.259 -179.671 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 99.62 58.5 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 126.811 2.569 . . . . 0.0 108.955 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.431 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 16.8 ttt180 -104.6 159.31 15.86 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 101.373 -3.566 . . . . 0.0 101.373 179.477 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -114.49 161.18 18.34 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 119.197 -1.001 . . . . 0.0 112.165 -179.41 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.429 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.9 m-85 -144.04 176.26 9.43 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 124.44 1.087 . . . . 0.0 109.348 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 43.5 p -106.19 -40.52 5.61 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.653 1.221 . . . . 0.0 110.598 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.546 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 58.2 mtt85 -112.27 171.57 7.43 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 124.579 1.174 . . . . 0.0 110.053 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.444 ' HG ' ' N ' ' A' ' 16' ' ' ASP . 88.8 p -85.51 -36.63 20.4 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 179.864 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.444 ' N ' ' HG ' ' A' ' 15' ' ' SER . 0.8 OUTLIER -63.26 -32.78 74.28 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 179.978 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.546 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 41.6 m170 -67.1 -60.78 2.33 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 179.666 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.6 tp -40.14 -51.77 2.61 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 123.758 0.661 . . . . 0.0 110.721 179.451 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -54.81 -60.37 3.46 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.644 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.5 m -42.35 -40.81 2.63 Favored 'General case' 0 N--CA 1.501 2.103 0 CA-C-O 121.489 0.661 . . . . 0.0 111.767 179.723 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.431 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 53.3 t60 -71.57 -57.37 4.46 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 113.92 -1.491 . . . . 0.0 114.191 179.666 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.7 p -44.01 -35.92 2.28 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.591 0.757 . . . . 0.0 112.306 -179.127 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -81.73 44.88 0.85 Allowed 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 118.457 -1.297 . . . . 0.0 111.766 179.765 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.0 t -124.14 -21.78 4.95 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 179.495 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -87.15 -52.39 5.44 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 114.107 -1.406 . . . . 0.0 110.249 -179.6 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.5 m -125.02 -19.52 5.18 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 124.203 0.939 . . . . 0.0 113.393 -179.773 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -101.27 42.82 1.84 Allowed Glycine 0 N--CA 1.497 2.733 0 C-N-CA 119.89 -1.148 . . . . 0.0 110.783 -179.745 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -120.91 63.78 0.86 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 179.915 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.412 ' HD3' ' H ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.975 0 CA-C-N 113.854 -1.521 . . . . 0.0 109.952 -179.824 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -58.46 158.13 24.26 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.747 2.298 . . . . 0.0 113.335 -172.101 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -127.74 167.6 16.25 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 113.005 -1.907 . . . . 0.0 107.746 179.982 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -148.06 153.18 38.58 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.846 179.493 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.507 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 34.7 t -94.79 127.75 41.02 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 179.819 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.42 38.78 1.14 Allowed 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 -179.585 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.507 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 29.2 m -130.68 -44.59 1.08 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 113.887 -1.506 . . . . 0.0 109.89 179.932 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 32.0 p -120.71 -26.58 5.25 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 123.75 0.656 . . . . 0.0 110.789 -179.858 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 85.82 57.91 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 125.93 2.018 . . . . 0.0 112.304 179.732 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.68 151.86 34.26 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 179.35 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -113.96 162.88 15.86 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.149 -1.02 . . . . 0.0 112.216 -179.799 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -137.11 -173.81 3.56 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.699 -1.591 . . . . 0.0 109.485 -179.575 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 80.7 p -111.24 -37.58 5.26 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 124.313 1.008 . . . . 0.0 108.452 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.498 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.4 mtt85 -116.09 -178.16 3.34 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.913 -179.939 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.415 ' C ' ' H ' ' A' ' 17' ' ' HIS . 87.1 p -97.17 -24.19 15.85 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 113.689 -1.596 . . . . 0.0 107.418 179.95 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -90.29 19.01 5.42 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 122.483 1.135 . . . . 0.0 108.549 179.808 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.498 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 22.7 m170 -120.27 -19.71 7.58 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 112.275 -2.239 . . . . 0.0 105.147 179.514 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.8 tp -101.12 -48.77 4.3 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 114.405 -1.271 . . . . 0.0 109.405 -179.809 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -71.81 3.8 3.87 Favored 'General case' 0 N--CA 1.504 2.25 0 CA-C-O 121.121 0.486 . . . . 0.0 111.412 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.4 m -105.51 -43.17 5.02 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 103.781 -2.674 . . . . 0.0 103.781 179.536 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -61.71 -56.92 14.51 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 113.484 -1.689 . . . . 0.0 111.73 179.832 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.48 ' C ' ' H ' ' A' ' 24' ' ' THR . 17.1 p -45.06 -23.63 0.17 Allowed 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 124.686 1.194 . . . . 0.0 112.6 -179.872 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.8 mmm-85 -78.85 32.83 0.21 Allowed 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.75 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.48 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.0 t -124.58 -23.48 4.39 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 179.746 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.1 m-70 -97.79 -43.51 7.11 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.169 -179.748 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.7 t -105.54 -28.15 10.96 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 124.398 1.061 . . . . 0.0 113.178 -179.777 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -110.77 51.45 0.7 Allowed Glycine 0 N--CA 1.499 2.862 0 C-N-CA 120.312 -0.947 . . . . 0.0 111.976 -179.771 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -14.35 105.37 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.353 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 179.848 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.5 tptp . . . . . 0 N--CA 1.496 1.843 0 O-C-N 124.256 0.973 . . . . 0.0 110.136 -179.941 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.1 tptt . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 107.351 -1.351 . . . . 0.0 107.351 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -47.11 157.2 0.65 Allowed 'Trans proline' 0 N--CA 1.494 1.545 0 C-N-CA 123.535 2.823 . . . . 0.0 115.346 -174.584 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -125.49 155.67 40.17 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 112.02 -2.355 . . . . 0.0 108.018 -179.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -135.45 152.37 51.3 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.226 179.415 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.438 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 44.5 t -91.17 128.8 37.14 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 179.624 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.3 pttm -99.59 38.89 1.37 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.375 -179.72 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.438 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 54.7 m -130.88 -42.73 1.11 Allowed 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 112.251 -2.25 . . . . 0.0 107.353 179.62 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.3 p -124.91 -30.79 3.21 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 124.06 0.85 . . . . 0.0 111.806 -179.875 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 88.0 62.81 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.325 0 O-C-N 125.64 1.838 . . . . 0.0 110.443 179.839 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -115.68 154.19 29.96 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 102.725 -3.065 . . . . 0.0 102.725 179.696 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -114.51 155.66 26.02 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 119.153 -1.019 . . . . 0.0 112.535 -179.47 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.428 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 85.2 m-85 -136.56 -179.63 5.8 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 114.393 -1.276 . . . . 0.0 109.059 -179.733 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.432 ' HG ' HH11 ' A' ' 14' ' ' ARG . 76.3 p -106.37 -34.69 7.36 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 124.417 1.073 . . . . 0.0 110.122 -179.861 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.558 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 52.5 mtt85 -117.41 169.73 9.28 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 124.838 1.337 . . . . 0.0 111.413 -179.796 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 96.7 p -85.99 -37.04 19.4 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 179.913 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -64.27 -30.01 71.07 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 179.782 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.558 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 21.7 m170 -71.48 -60.62 2.14 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 105.858 -1.904 . . . . 0.0 105.858 179.685 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 5' ' ' CYS . 62.9 tp -40.61 -52.4 2.88 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 124.073 0.858 . . . . 0.0 111.175 179.608 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -55.06 -64.39 0.85 Allowed 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 118.922 -0.561 . . . . 0.0 110.306 179.626 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.0 m -39.2 -45.47 1.35 Allowed 'General case' 0 N--CA 1.504 2.246 0 O-C-N 124.231 0.957 . . . . 0.0 110.292 179.763 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.428 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 44.9 t60 -60.33 -60.99 2.94 Favored 'General case' 0 N--CA 1.489 1.502 0 CA-C-N 113.878 -1.51 . . . . 0.0 111.24 179.591 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.5 m -47.53 -23.32 0.61 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 123.751 0.657 . . . . 0.0 112.735 -179.581 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 mmm180 -53.57 -21.47 6.64 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.196 179.484 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.7 t -88.21 17.16 5.35 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-O 121.778 0.799 . . . . 0.0 110.81 -179.884 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 36.3 m-70 -125.47 -53.81 1.58 Allowed 'General case' 0 N--CA 1.492 1.651 0 CA-C-N 113.652 -1.613 . . . . 0.0 108.731 179.705 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.4 m -122.36 3.57 9.72 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -179.677 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.88 -48.94 9.29 Favored Glycine 0 N--CA 1.499 2.849 0 N-CA-C 108.75 -1.74 . . . . 0.0 108.75 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.56 -10.94 60.49 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 114.133 -1.033 . . . . 0.0 111.969 179.712 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.7 tttt . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 122.752 1.263 . . . . 0.0 109.228 -179.848 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt . . . . . 0 N--CA 1.493 1.719 0 CA-C-O 118.807 -0.616 . . . . 0.0 109.434 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -66.61 165.2 26.13 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.417 2.078 . . . . 0.0 112.865 165.688 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.44 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 50.1 m-85 -129.17 168.04 16.73 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 113.635 -1.621 . . . . 0.0 108.93 179.826 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.482 HE21 ' HA ' ' A' ' 9' ' ' GLN . 72.2 tp60 -133.82 149.37 51.39 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 124.165 0.915 . . . . 0.0 111.752 -179.806 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.425 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 41.7 t -99.34 141.4 32.17 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 104.616 -2.364 . . . . 0.0 104.616 179.304 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.32 19.31 20.8 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 124.748 1.28 . . . . 0.0 109.183 -179.843 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.425 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 40.9 m -114.81 -42.86 3.19 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 114.09 -1.414 . . . . 0.0 108.214 179.919 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.476 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 22.4 p -130.9 10.28 5.02 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 119.576 -0.85 . . . . 0.0 112.355 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.482 ' HA ' HE21 ' A' ' 4' ' ' GLN . 96.2 mm-40 47.16 59.39 4.08 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 122.747 1.26 . . . . 0.0 111.226 -179.825 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.476 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 15.4 ttt180 -117.04 157.42 25.87 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 103.934 -2.617 . . . . 0.0 103.934 179.812 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 pttp -114.91 165.39 12.9 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 118.32 -1.352 . . . . 0.0 112.149 -179.938 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.497 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 98.9 m-85 -140.84 -170.67 3.08 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 113.896 -1.502 . . . . 0.0 110.448 -179.768 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.8 p -108.36 -35.41 6.52 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 124.737 1.273 . . . . 0.0 109.495 179.923 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.41 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 5.6 mtp85 -127.12 174.61 8.77 Favored 'General case' 0 N--CA 1.504 2.227 0 CA-C-O 121.658 0.742 . . . . 0.0 110.371 179.497 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.44 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 90.3 p -82.55 -41.87 19.08 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.447 -1.251 . . . . 0.0 108.549 -179.891 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -67.86 -28.52 67.61 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 -179.992 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.41 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 53.9 m170 -69.16 -61.53 1.75 Allowed 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 104.625 -2.361 . . . . 0.0 104.625 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.0 tp -39.21 -52.63 1.94 Allowed 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 121.808 0.813 . . . . 0.0 110.179 179.318 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -49.07 -68.43 0.18 Allowed 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.151 179.584 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.4 m -39.83 -45.2 1.74 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 124.635 1.21 . . . . 0.0 110.284 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 8.2 t60 -57.06 -61.18 2.63 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.174 -1.376 . . . . 0.0 111.265 179.797 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.501 ' C ' ' H ' ' A' ' 24' ' ' THR . 12.5 m -41.54 -26.49 0.07 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.985 1.428 . . . . 0.0 111.238 -179.68 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -79.42 36.65 0.31 Allowed 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 114.849 -1.068 . . . . 0.0 110.47 179.797 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.501 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.7 t -125.77 -12.08 6.59 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 104.882 -2.266 . . . . 0.0 104.882 179.496 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -95.67 -41.23 9.0 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.801 -179.895 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.4 m -110.73 -35.95 5.85 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 124.55 1.156 . . . . 0.0 114.036 -179.739 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -114.2 60.32 0.38 Allowed Glycine 0 N--CA 1.5 2.963 0 O-C-N 124.374 1.046 . . . . 0.0 112.054 -179.499 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -57.39 162.82 2.61 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 124.486 0.757 . . . . 0.0 109.992 179.878 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 pttm . . . . . 0 N--CA 1.499 1.979 0 CA-C-O 122.441 1.115 . . . . 0.0 110.448 179.94 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 67.1 mttm . . . . . 0 N--CA 1.492 1.651 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -79.96 124.02 5.39 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 C-N-CA 122.891 2.394 . . . . 0.0 110.564 177.061 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -114.92 145.14 42.52 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 105.172 -2.158 . . . . 0.0 105.172 179.669 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -127.61 151.13 49.32 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.25 0.969 . . . . 0.0 109.768 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.418 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 32.2 t -99.59 136.25 39.8 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 103.254 -2.869 . . . . 0.0 103.254 179.587 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -99.11 23.6 8.88 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.408 -0.917 . . . . 0.0 111.714 -179.422 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.631 ' HG1' ' HG1' ' A' ' 26' ' ' THR . 18.7 m -119.84 -44.56 2.52 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 179.296 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.517 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 27.2 p -127.25 10.32 6.82 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 48.57 57.7 6.01 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-O 123.372 1.558 . . . . 0.0 109.71 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.517 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 55.7 ttm-85 -116.22 130.04 56.59 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 111.101 -2.772 . . . . 0.0 103.909 -179.929 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -103.68 163.09 12.55 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.062 -1.055 . . . . 0.0 113.576 -179.352 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -138.49 175.3 9.68 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 112.932 -1.94 . . . . 0.0 110.345 -179.385 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.486 ' HG ' HH11 ' A' ' 14' ' ' ARG . 84.9 p -101.7 -27.35 13.1 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.57 1.169 . . . . 0.0 110.719 -179.875 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.488 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 57.1 mtt85 -118.2 165.85 13.31 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 124.546 1.153 . . . . 0.0 111.007 -179.936 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 61.8 p -85.16 -38.98 18.38 Favored 'General case' 0 N--CA 1.492 1.631 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.432 -179.953 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.4 -36.42 82.26 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 179.921 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.488 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 28.6 m170 -66.37 -62.23 1.58 Allowed 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 179.708 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 39.2 tp -40.1 -55.18 2.15 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.087 0.867 . . . . 0.0 111.478 179.613 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -54.01 -62.0 1.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 124.045 0.841 . . . . 0.0 112.376 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.8 m -45.26 -43.43 10.46 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 123.893 0.746 . . . . 0.0 111.014 179.889 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.443 ' CE1' ' HD2' ' A' ' 10' ' ' ARG . 63.6 t60 -61.82 -63.62 1.2 Allowed 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.535 179.842 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -51.25 -42.47 61.07 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -179.439 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -34.12 -31.57 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 125.453 1.721 . . . . 0.0 112.992 179.454 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.5 t -78.73 -47.95 15.87 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.364 -179.72 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.486 ' CG ' HG23 ' A' ' 7' ' ' THR . 0.8 OUTLIER -124.77 42.73 3.2 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 179.866 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.631 ' HG1' ' HG1' ' A' ' 7' ' ' THR . 86.7 m -140.17 -44.24 0.42 Allowed 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 114.164 -1.38 . . . . 0.0 108.303 179.642 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -120.32 53.81 0.68 Allowed Glycine 0 N--CA 1.498 2.828 0 CA-C-N 113.941 -1.481 . . . . 0.0 109.493 -179.973 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -125.76 66.19 1.18 Allowed 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -179.875 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp . . . . . 0 N--CA 1.501 2.115 0 CA-C-O 122.651 1.215 . . . . 0.0 110.932 -179.755 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.8 tptp . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -88.69 159.94 6.33 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 C-N-CA 122.65 2.234 . . . . 0.0 111.966 176.999 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -122.44 154.56 37.61 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 112.258 -2.246 . . . . 0.0 105.964 179.76 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.47 HE21 ' HA ' ' A' ' 9' ' ' GLN . 72.0 tp60 -132.14 147.9 52.45 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 123.847 0.717 . . . . 0.0 110.592 -179.864 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.401 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 18.3 t -95.46 135.36 37.2 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 103.169 -2.9 . . . . 0.0 103.169 179.491 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.8 mptt -99.76 33.44 2.54 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 125.124 1.515 . . . . 0.0 108.539 -179.576 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.437 HG23 ' CG ' ' A' ' 25' ' ' HIS . 69.9 m -131.76 -46.48 0.96 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.393 179.946 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.2 p -125.58 5.97 7.55 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.674 -179.75 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.47 ' HA ' HE21 ' A' ' 4' ' ' GLN . 86.5 mm-40 53.1 58.71 5.03 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-O 122.941 1.353 . . . . 0.0 111.062 179.878 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.458 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 20.6 ttt180 -111.79 148.94 32.47 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 102.613 -3.106 . . . . 0.0 102.613 179.67 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -115.58 162.53 17.09 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 119.088 -1.045 . . . . 0.0 112.22 -179.8 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -140.98 177.47 8.03 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-N 114.085 -1.416 . . . . 0.0 108.599 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.448 ' HG ' HH11 ' A' ' 14' ' ' ARG . 80.5 p -106.83 -30.48 8.89 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 124.29 0.994 . . . . 0.0 110.642 -179.86 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.495 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 51.9 mtt85 -119.96 -178.85 3.75 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.901 -179.757 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 99.8 p -98.19 -33.57 11.07 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -64.17 -22.71 67.04 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.495 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 32.4 m170 -80.25 -42.68 22.72 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 179.731 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.86 -47.42 83.41 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 179.763 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.37 -61.25 2.43 Favored 'General case' 0 N--CA 1.503 2.214 0 CA-C-N 118.928 0.785 . . . . 0.0 110.388 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.5 m -48.11 -26.22 1.77 Allowed 'General case' 0 N--CA 1.502 2.17 0 CA-C-O 120.959 0.409 . . . . 0.0 112.088 179.73 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.458 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 71.3 t60 -84.61 -56.13 3.76 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.633 179.612 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.492 ' C ' ' H ' ' A' ' 24' ' ' THR . 19.2 p -50.26 -33.59 20.32 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.417 1.087 . . . . 0.0 113.383 -179.464 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -65.63 14.28 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.643 -1.223 . . . . 0.0 113.888 179.744 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.492 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.4 t -109.75 -10.51 14.79 Favored 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 179.554 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.437 ' CG ' HG23 ' A' ' 7' ' ' THR . 40.7 m-70 -107.59 -41.51 5.02 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 104.731 -2.322 . . . . 0.0 104.731 179.857 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.8 m -75.47 -40.26 57.61 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 179.618 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -105.62 61.72 0.35 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 104.525 -3.43 . . . . 0.0 104.525 179.651 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -121.68 169.61 10.54 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 112.864 -1.668 . . . . 0.0 109.531 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 122.145 0.974 . . . . 0.0 109.786 179.776 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.0 tttp . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 107.057 -1.461 . . . . 0.0 107.057 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -78.25 161.31 29.1 Favored 'Trans proline' 0 C--N 1.316 -1.178 0 C-N-CA 122.719 2.279 . . . . 0.0 111.167 -171.694 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -124.95 154.82 40.58 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 112.678 -2.055 . . . . 0.0 106.571 179.798 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -135.87 145.04 45.94 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 124.084 0.865 . . . . 0.0 109.394 179.93 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.2 t -93.56 140.52 29.51 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 104.891 -2.262 . . . . 0.0 104.891 179.619 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -104.63 37.62 2.09 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -179.672 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.9 m -131.93 -44.31 0.96 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 113.7 -1.591 . . . . 0.0 109.059 179.992 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.0 p -118.93 -34.22 3.97 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 123.896 0.747 . . . . 0.0 109.832 -179.933 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.5 mp0 88.77 56.68 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.196 0 O-C-N 126.342 2.276 . . . . 0.0 108.98 179.706 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.65 138.54 49.29 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 102.946 -2.983 . . . . 0.0 102.946 179.747 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -102.64 164.98 11.33 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.949 -1.101 . . . . 0.0 112.15 -179.53 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -139.42 -178.08 5.22 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 113.52 -1.673 . . . . 0.0 109.293 -179.704 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.5 p -105.06 -39.53 6.19 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 124.883 1.365 . . . . 0.0 108.818 -179.909 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.484 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 55.9 mtt180 -109.7 -177.69 3.34 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 124.438 1.086 . . . . 0.0 111.369 179.965 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 17' ' ' HIS . 50.5 p -97.67 -30.44 12.82 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 113.671 -1.604 . . . . 0.0 109.461 -179.879 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -88.41 19.42 3.84 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 122.162 0.982 . . . . 0.0 108.475 179.906 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.484 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.5 m170 -119.45 -24.39 6.34 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 179.529 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.5 tp -93.76 -54.3 3.68 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 114.322 -1.308 . . . . 0.0 110.154 -179.968 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -0.86 12.71 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.821 -179.846 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.0 m -104.5 -36.01 7.68 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 105.299 -2.111 . . . . 0.0 105.299 179.921 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 25.3 t60 -70.33 -53.37 16.98 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 124.041 0.838 . . . . 0.0 108.801 179.727 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 p -37.94 -46.01 0.93 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.129 0.972 . . . . 0.0 111.135 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.3 mmt-85 -43.32 -21.38 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 179.921 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.9 t -73.91 -21.54 60.02 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 123.099 0.249 . . . . 0.0 111.335 -179.548 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 56.6 m-70 -99.11 25.39 6.83 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 179.705 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 45.4 m -137.28 -55.01 0.7 Allowed 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 -179.723 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -121.2 25.19 7.12 Favored Glycine 0 N--CA 1.496 2.685 0 CA-C-N 114.294 -1.321 . . . . 0.0 113.218 -179.542 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -130.42 -70.94 0.6 Allowed 'General case' 0 N--CA 1.501 2.079 0 C-N-CA 119.038 -1.065 . . . . 0.0 108.797 179.673 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp . . . . . 0 N--CA 1.491 1.596 0 CA-C-N 114.574 -1.193 . . . . 0.0 108.19 179.93 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt . . . . . 0 N--CA 1.493 1.69 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_exo -54.46 154.9 18.09 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 122.316 2.011 . . . . 0.0 111.906 168.219 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.453 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 56.7 m-85 -128.28 163.14 25.42 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 113.586 -1.643 . . . . 0.0 108.783 179.936 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -136.29 153.71 51.09 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 124.148 0.905 . . . . 0.0 110.489 179.775 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.508 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 34.6 t -99.54 124.74 45.01 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 179.664 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -97.88 40.48 1.17 Allowed 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 122.376 1.084 . . . . 0.0 109.101 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.508 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.3 m -124.42 -41.59 2.16 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 112.84 -1.982 . . . . 0.0 105.668 179.633 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.8 p -122.31 -36.86 2.89 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 124.097 0.873 . . . . 0.0 110.684 180.0 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 92.26 56.81 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.456 0 O-C-N 126.143 2.152 . . . . 0.0 111.434 179.791 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.4 ttt-85 -116.65 161.11 19.71 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 103.897 -2.631 . . . . 0.0 103.897 179.529 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -117.2 163.52 16.18 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 119.773 -0.771 . . . . 0.0 112.951 -179.898 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.605 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 72.2 m-85 -138.35 -175.61 4.17 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 112.711 -2.041 . . . . 0.0 107.935 -179.825 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.0 p -106.2 -33.04 7.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 124.142 0.901 . . . . 0.0 110.609 -179.986 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.462 ' CD ' ' CE1' ' A' ' 17' ' ' HIS . 35.5 mtp180 -120.06 171.08 8.71 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 123.793 0.683 . . . . 0.0 110.623 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.453 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 92.1 p -80.84 -29.07 35.91 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.562 -179.898 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -82.55 -28.23 31.12 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 179.78 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.462 ' CE1' ' CD ' ' A' ' 14' ' ' ARG . 42.9 m170 -68.85 -52.18 32.56 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 101.867 -3.383 . . . . 0.0 101.867 179.275 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 52.6 tp -43.04 -49.04 6.19 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.115 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.81 -58.74 6.79 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 179.415 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.7 m -40.18 -38.51 0.77 Allowed 'General case' 0 N--CA 1.503 2.213 0 CA-C-O 121.116 0.484 . . . . 0.0 110.849 179.612 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.605 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 51.3 t60 -75.16 -51.78 12.56 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 113.835 -1.53 . . . . 0.0 114.078 179.592 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.7 p -43.13 -37.26 1.97 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 118.899 0.772 . . . . 0.0 110.459 -179.769 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -43.44 -21.25 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 179.31 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 68.1 p -80.33 -18.87 47.93 Favored 'General case' 0 N--CA 1.509 2.509 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -179.733 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 47.7 m-70 -97.49 -40.75 8.51 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 106.117 -1.809 . . . . 0.0 106.117 179.969 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -107.44 34.47 3.5 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 124.306 1.004 . . . . 0.0 112.39 -179.87 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -120.76 57.27 0.59 Allowed Glycine 0 N--CA 1.5 2.956 0 N-CA-C 106.02 -2.832 . . . . 0.0 106.02 179.501 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -104.42 -175.55 2.83 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.1 -1.05 . . . . 0.0 109.191 -179.665 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? . . . . . 0 N--CA 1.503 2.188 0 CA-C-O 122.322 1.058 . . . . 0.0 110.234 179.986 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.5 tttp . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -55.85 164.46 4.64 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 122.933 2.422 . . . . 0.0 112.911 176.694 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -123.15 166.09 15.78 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 112.611 -2.086 . . . . 0.0 107.973 -179.992 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -142.17 152.83 43.54 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 123.954 0.784 . . . . 0.0 109.759 179.558 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.427 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 46.2 t -93.24 136.37 33.57 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 179.574 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -104.44 35.32 2.76 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.649 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.427 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 58.7 m -127.52 -40.57 1.76 Allowed 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 113.287 -1.779 . . . . 0.0 107.763 179.861 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.4 p -122.52 -38.39 2.67 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 124.14 0.9 . . . . 0.0 110.5 -179.942 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 91.54 62.3 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 126.22 2.2 . . . . 0.0 110.63 179.793 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -118.73 155.84 30.39 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 102.692 -3.077 . . . . 0.0 102.692 179.624 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.6 mtpt -113.8 163.98 14.33 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 118.841 -1.144 . . . . 0.0 113.169 -179.657 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.437 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 88.7 m-85 -139.96 -178.15 5.31 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 114.348 -1.297 . . . . 0.0 108.28 -179.586 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 55.1 p -103.76 -38.95 6.85 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -179.974 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.453 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 58.8 mtt85 -115.64 178.07 4.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 124.508 1.13 . . . . 0.0 110.4 179.905 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 94.7 p -89.43 -36.61 15.35 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 113.907 -1.497 . . . . 0.0 109.363 -179.759 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -65.69 -34.1 77.43 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 179.953 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.453 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 50.1 m170 -61.5 -61.77 2.29 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 179.587 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 5' ' ' CYS . 50.1 tp -42.43 -54.97 3.61 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 124.025 0.828 . . . . 0.0 110.999 179.688 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -50.29 -63.66 1.05 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.801 179.701 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.1 m -41.57 -45.22 3.25 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 124.162 0.913 . . . . 0.0 110.333 179.928 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.437 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 36.9 t60 -63.4 -59.64 4.42 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.366 -1.743 . . . . 0.0 113.204 179.9 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.511 ' C ' ' H ' ' A' ' 24' ' ' THR . 25.0 m -52.71 -25.81 12.17 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 123.784 0.678 . . . . 0.0 112.192 -179.325 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -79.81 38.81 0.4 Allowed 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 122.578 1.18 . . . . 0.0 110.49 179.789 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.511 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.8 t -126.28 -27.44 3.21 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 179.23 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 79.4 m-70 -86.0 -45.5 11.4 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 179.956 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.0 m -71.05 -56.51 6.0 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 113.92 -1.491 . . . . 0.0 107.539 -179.943 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.93 -52.01 0.82 Allowed Glycine 0 N--CA 1.49 2.251 0 CA-C-N 113.773 -1.558 . . . . 0.0 111.206 179.749 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 2.95 67.93 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.225 0 N-CA-C 118.085 2.624 . . . . 0.0 118.085 -179.862 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.4 mttm . . . . . 0 N--CA 1.509 2.485 0 CA-C-O 122.097 0.951 . . . . 0.0 109.876 179.92 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp . . . . . 0 N--CA 1.495 1.776 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -80.54 159.82 22.28 Favored 'Trans proline' 0 C--N 1.315 -1.207 0 C-N-CA 123.087 2.525 . . . . 0.0 114.317 -159.055 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.403 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 58.0 m-85 -134.45 154.88 51.17 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 112.027 -2.351 . . . . 0.0 105.888 179.652 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -142.61 154.92 44.84 Favored 'General case' 0 N--CA 1.501 2.101 0 C-N-CA 118.991 -1.084 . . . . 0.0 111.381 179.715 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 36.6 t -90.92 139.6 30.61 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 179.745 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -102.01 38.21 1.7 Allowed 'General case' 0 N--CA 1.5 2.075 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.478 -179.674 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 56.6 m -135.77 -45.93 0.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 113.808 -1.542 . . . . 0.0 110.302 -179.975 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.8 p -121.79 -20.25 6.49 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 124.124 0.89 . . . . 0.0 111.195 -179.601 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.3 mp0 75.57 57.73 0.06 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 125.406 1.691 . . . . 0.0 111.307 179.702 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -107.79 148.21 29.81 Favored 'General case' 0 N--CA 1.487 1.414 1 N-CA-C 100.104 -4.036 . . . . 0.0 100.104 179.394 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -112.01 157.18 21.03 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.378 -0.929 . . . . 0.0 110.907 -179.615 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -134.55 -177.51 4.64 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 113.634 -1.621 . . . . 0.0 109.512 -179.622 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 57.9 p -110.85 -34.1 6.34 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 124.631 1.207 . . . . 0.0 109.939 -179.965 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.433 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.9 mtt180 -118.02 -176.54 3.07 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.535 179.731 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.405 ' C ' ' H ' ' A' ' 17' ' ' HIS . 79.8 p -97.85 -25.31 15.07 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 114.278 -1.328 . . . . 0.0 107.963 -179.986 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 53.9 p30 -91.87 25.62 2.71 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.571 1.177 . . . . 0.0 108.862 179.94 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.433 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 33.1 m170 -122.14 -42.63 2.36 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 102.568 -3.123 . . . . 0.0 102.568 179.688 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -77.53 -50.78 11.89 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 113.353 -1.749 . . . . 0.0 109.705 179.877 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -72.05 5.72 2.55 Favored 'General case' 0 N--CA 1.502 2.139 0 CA-C-O 121.169 0.509 . . . . 0.0 112.136 -179.861 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 79.5 m -106.53 -43.78 4.65 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 102.896 -3.001 . . . . 0.0 102.896 179.582 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 54.4 t60 -60.35 -58.26 9.28 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.477 -1.692 . . . . 0.0 111.256 179.7 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 20.0 p -46.83 -18.87 0.08 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -179.639 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 mtp-105 -67.61 -8.6 35.82 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.239 -179.905 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.3 t -89.95 -7.24 54.54 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -110.47 -53.7 2.66 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 30.1 m -132.99 50.7 2.21 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 123.916 0.76 . . . . 0.0 110.962 -179.822 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -129.18 -3.62 5.24 Favored Glycine 0 N--CA 1.503 3.118 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.6 179.765 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -116.99 -38.92 3.31 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -179.942 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.421 ' H ' ' HD2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 CA-C-N 113.58 -1.646 . . . . 0.0 109.723 -179.97 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.1 mttm . . . . . 0 N--CA 1.496 1.84 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -93.5 165.66 2.32 Favored 'Trans proline' 0 C--N 1.318 -1.068 0 C-N-CA 122.546 2.164 . . . . 0.0 112.253 166.125 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -126.93 163.39 23.77 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 113.653 -1.612 . . . . 0.0 106.907 179.671 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -133.05 149.48 52.17 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 123.711 0.632 . . . . 0.0 111.923 -179.778 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.6 t -99.59 139.85 34.65 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 179.444 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -106.46 40.99 1.51 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 122.416 1.103 . . . . 0.0 109.557 179.948 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 62.6 m -135.99 -39.02 0.7 Allowed 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 113.05 -1.886 . . . . 0.0 108.434 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.3 p -123.21 -43.09 2.22 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 119.135 -1.026 . . . . 0.0 108.871 -179.876 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 98.3 mm-40 100.19 59.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 O-C-N 126.726 2.516 . . . . 0.0 108.94 179.831 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 ttt-85 -115.82 157.04 25.01 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 179.741 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -112.77 164.4 13.43 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.113 179.977 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.545 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 95.7 m-85 -139.2 -173.8 3.69 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.61 -2.087 . . . . 0.0 109.771 -179.893 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.1 p -106.72 -35.79 6.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 124.477 1.111 . . . . 0.0 110.187 -179.959 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.474 ' HB2' ' CG ' ' A' ' 17' ' ' HIS . 46.2 mtt85 -121.46 -179.71 4.17 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 123.808 0.692 . . . . 0.0 112.173 179.8 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.4 ' HG ' ' H ' ' A' ' 16' ' ' ASP . 64.5 p -90.48 -40.05 12.24 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 114.47 -1.241 . . . . 0.0 107.886 -179.932 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.4 ' H ' ' HG ' ' A' ' 15' ' ' SER . 0.8 OUTLIER -67.35 -33.21 74.76 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 104.682 -2.34 . . . . 0.0 104.682 179.786 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.474 ' CG ' ' HB2' ' A' ' 14' ' ' ARG . 49.7 m170 -66.61 -56.65 9.75 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 179.433 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.9 tp -46.02 -55.62 6.63 Favored 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.9 tttm -46.56 -59.44 3.0 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 122.049 0.14 . . . . 0.0 110.899 179.582 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.9 m -45.14 -44.65 10.84 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.616 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.545 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 61.1 t60 -67.42 -52.9 34.12 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 114.162 -1.381 . . . . 0.0 114.705 179.716 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.413 ' C ' ' H ' ' A' ' 24' ' ' THR . 44.2 p -49.1 -39.8 29.56 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 118.908 0.776 . . . . 0.0 109.945 -179.602 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.5 mtt-85 -68.61 19.76 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 179.94 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.413 ' H ' ' C ' ' A' ' 22' ' ' THR . 77.2 p -108.39 -6.99 15.96 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.223 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 61.3 m-70 -99.49 -39.61 8.26 Favored 'General case' 0 C--N 1.302 -1.481 1 N-CA-C 100.036 -4.061 . . . . 0.0 100.036 179.203 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 57.1 p 111.19 39.48 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.14 1 C-N-CA 133.068 4.547 . . . . 0.0 102.264 179.746 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 97.97 -56.87 1.1 Allowed Glycine 0 N--CA 1.486 2.004 1 N-CA-C 102.118 -4.393 . . . . 0.0 102.118 -179.303 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -128.04 148.18 50.54 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-N 112.657 -1.771 . . . . 0.0 109.495 179.797 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 122.466 1.127 . . . . 0.0 109.488 179.663 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.0 tptm . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -80.84 147.91 17.26 Favored 'Trans proline' 0 N--CA 1.491 1.334 0 C-N-CA 122.41 2.073 . . . . 0.0 113.26 177.195 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -128.92 157.37 41.79 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 113.283 -1.78 . . . . 0.0 107.025 179.596 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -139.95 154.61 47.24 Favored 'General case' 0 N--CA 1.5 2.075 0 C-N-CA 119.956 -0.698 . . . . 0.0 111.78 179.649 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.494 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 15.7 t -104.31 122.74 46.06 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 105.029 -2.212 . . . . 0.0 105.029 179.44 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -97.86 46.41 1.02 Allowed 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 122.999 1.38 . . . . 0.0 109.045 -179.851 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.494 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.4 m -129.3 -43.88 1.28 Allowed 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 111.77 -2.468 . . . . 0.0 105.682 179.693 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.4 p -122.49 -24.29 5.0 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.292 0.995 . . . . 0.0 112.166 -179.932 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 84.43 53.92 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 O-C-N 124.871 1.357 . . . . 0.0 108.66 179.866 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.458 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 17.7 ttm180 -113.97 156.38 24.15 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 104.496 -2.409 . . . . 0.0 104.496 179.968 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.429 ' H ' ' HD3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -120.75 161.54 21.27 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 119.073 -1.051 . . . . 0.0 111.488 -179.829 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.449 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 75.7 m-85 -136.68 179.29 6.46 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.316 -1.765 . . . . 0.0 110.442 -179.58 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.2 p -104.9 -30.33 9.9 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 124.907 1.38 . . . . 0.0 110.731 -179.847 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.524 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 65.6 mtt85 -124.09 177.79 5.64 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 123.992 0.808 . . . . 0.0 111.314 179.974 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.404 ' HG ' ' N ' ' A' ' 16' ' ' ASP . 84.4 p -94.15 -35.28 12.59 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 114.288 -1.324 . . . . 0.0 108.43 179.996 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.404 ' N ' ' HG ' ' A' ' 15' ' ' SER . 8.8 p-10 -65.44 -34.61 78.69 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 104.03 -2.581 . . . . 0.0 104.03 179.805 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.524 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 36.5 m170 -62.77 -64.0 1.05 Allowed 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.418 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.2 tp -42.59 -52.56 4.76 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 123.534 0.521 . . . . 0.0 110.927 179.515 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -50.84 -48.35 59.94 Favored 'General case' 0 N--CA 1.508 2.442 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 179.69 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 87.2 m -65.73 -37.53 86.64 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.236 179.738 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.458 ' CE1' ' HD2' ' A' ' 10' ' ' ARG . 68.9 t60 -62.95 -53.71 49.85 Favored 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.799 179.743 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.474 ' C ' ' H ' ' A' ' 24' ' ' THR . 25.1 p -61.02 -7.43 2.49 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.086 179.687 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.411 ' H ' ' C ' ' A' ' 21' ' ' HIS . 0.0 OUTLIER -91.4 32.02 1.1 Allowed 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 105.555 -2.017 . . . . 0.0 105.555 179.858 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.474 ' H ' ' C ' ' A' ' 22' ' ' THR . 92.9 m -127.0 -27.37 3.02 Favored 'General case' 0 N--CA 1.491 1.625 0 CA-C-N 113.287 -1.779 . . . . 0.0 106.896 -179.947 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 -97.05 -48.83 5.24 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 114.715 -1.13 . . . . 0.0 111.79 -179.695 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 74.9 m -122.8 56.12 1.16 Allowed 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 -179.801 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -4.1 -67.09 0.0 OUTLIER Glycine 0 N--CA 1.497 2.742 0 CA-C-N 112.131 -2.304 . . . . 0.0 115.577 179.969 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -126.55 146.57 50.09 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.02 179.82 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.6 tttp . . . . . 0 N--CA 1.493 1.688 0 CA-C-N 114.29 -1.323 . . . . 0.0 108.459 179.756 . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.6 pttp . . . . . 0 N--CA 1.494 1.747 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -85.1 149.76 10.71 Favored 'Trans proline' 0 N--CA 1.49 1.306 0 C-N-CA 122.76 2.307 . . . . 0.0 113.935 -168.973 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -127.78 145.73 50.82 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-N 111.819 -2.446 . . . . 0.0 105.168 179.658 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -132.27 150.09 52.23 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.371 179.811 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.55 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 13.4 t -100.93 102.8 13.9 Favored 'General case' 0 C--N 1.305 -1.342 1 N-CA-C 99.989 -4.078 . . . . 0.0 99.989 179.533 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -87.88 39.58 0.9 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 -179.404 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.55 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 40.8 m -116.19 -42.34 3.06 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 104.49 -2.411 . . . . 0.0 104.49 179.713 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.9 p -124.68 -24.6 4.13 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 124.053 0.846 . . . . 0.0 111.172 179.89 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 86.44 59.21 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 126.548 1.939 . . . . 0.0 111.924 179.952 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -118.29 152.35 35.94 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 102.971 -2.974 . . . . 0.0 102.971 179.52 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.13 160.81 20.91 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 119.107 -1.037 . . . . 0.0 112.594 -179.681 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -139.98 175.77 9.31 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 112.818 -1.992 . . . . 0.0 107.512 -179.753 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.7 p -110.83 -19.89 12.67 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 124.219 0.949 . . . . 0.0 109.803 -179.862 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.3 mtp-105 -125.79 178.55 5.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 124.082 0.864 . . . . 0.0 109.193 179.838 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.407 ' C ' ' H ' ' A' ' 17' ' ' HIS . 89.1 p -94.89 -28.15 15.34 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 114.051 -1.432 . . . . 0.0 108.174 -179.978 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -84.15 14.31 4.37 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 121.78 0.8 . . . . 0.0 109.367 -179.949 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.407 ' H ' ' C ' ' A' ' 15' ' ' SER . 34.6 m170 -114.96 -62.09 1.65 Allowed 'General case' 0 C--N 1.307 -1.252 1 N-CA-C 99.759 -4.163 . . . . 0.0 99.759 179.362 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.5 tp -44.24 -53.02 6.99 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.424 179.528 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -57.69 -66.78 0.41 Allowed 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 119.735 -0.786 . . . . 0.0 110.103 179.953 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.7 m -33.63 -47.9 0.25 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 124.649 1.218 . . . . 0.0 110.769 179.634 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -64.59 -58.5 6.17 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 112.909 -1.95 . . . . 0.0 113.043 179.727 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.522 ' C ' ' H ' ' A' ' 24' ' ' THR . 87.4 m -52.76 -20.35 3.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 123.782 0.676 . . . . 0.0 111.718 -179.376 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.469 ' HA ' ' HE ' ' A' ' 23' ' ' ARG . 4.8 mmp_? -82.32 38.68 0.56 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 122.422 1.106 . . . . 0.0 109.129 179.411 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.522 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.8 t -128.23 -10.03 5.28 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 104.887 -2.264 . . . . 0.0 104.887 179.36 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 57.4 m-70 -105.87 -46.51 4.1 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 103.698 -2.704 . . . . 0.0 103.698 179.894 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 96.8 m -86.43 -40.26 15.53 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 113.81 -1.541 . . . . 0.0 107.814 179.744 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -106.54 66.21 0.25 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 107.322 -2.311 . . . . 0.0 107.322 179.844 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -110.13 -55.68 2.42 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 114.144 -1.028 . . . . 0.0 108.32 -179.764 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.465 ' H ' ' HD3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.916 0 CA-C-N 113.808 -1.542 . . . . 0.0 110.455 179.971 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm . . . . . 0 N--CA 1.493 1.675 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -78.84 162.06 26.89 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 C-N-CA 123.479 2.786 . . . . 0.0 113.301 -165.918 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.535 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 76.0 m-85 -128.15 141.92 51.34 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 179.561 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -129.29 152.95 48.3 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 119.089 -1.044 . . . . 0.0 110.353 179.935 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.413 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 22.8 t -90.64 140.21 29.98 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 179.599 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -102.2 39.33 1.51 Allowed 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 122.049 0.928 . . . . 0.0 108.948 -179.805 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.413 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 32.5 m -133.27 -44.27 0.85 Allowed 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 113.419 -1.719 . . . . 0.0 110.2 179.913 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.0 p -118.65 -35.34 3.74 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 124.056 0.848 . . . . 0.0 110.407 -179.71 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 88.24 55.93 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.052 0 O-C-N 126.522 2.389 . . . . 0.0 109.458 179.845 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -107.74 151.22 25.98 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 100.706 -3.813 . . . . 0.0 100.706 179.466 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -116.33 159.79 21.42 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 118.743 -1.183 . . . . 0.0 110.428 -179.559 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.4 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 75.7 m-85 -133.71 -177.06 4.38 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.842 -1.526 . . . . 0.0 110.253 -179.653 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.5 p -98.35 -41.29 7.9 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.023 -179.814 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.489 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.0 mtt85 -117.56 179.41 4.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 124.395 1.06 . . . . 0.0 111.093 179.877 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.535 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 88.6 p -91.73 -36.21 13.71 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.391 -179.974 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 41.8 p-10 -68.74 -24.71 64.49 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.902 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.489 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 48.3 m170 -71.34 -58.96 3.04 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 179.665 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -48.06 -46.27 33.27 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 121.449 0.642 . . . . 0.0 109.907 179.489 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -54.85 -52.67 62.05 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.887 -0.508 . . . . 0.0 110.453 179.603 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 84.9 m -56.17 -42.09 76.53 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.698 -0.801 . . . . 0.0 108.845 179.609 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.4 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 62.4 t60 -58.12 -61.79 2.29 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.885 179.912 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.444 ' C ' ' H ' ' A' ' 24' ' ' THR . 13.3 p -42.3 -27.15 0.13 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.675 1.19 . . . . 0.0 112.052 -179.649 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.61 43.48 1.03 Allowed 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 123.257 1.503 . . . . 0.0 110.158 179.708 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.444 ' H ' ' C ' ' A' ' 22' ' ' THR . 12.4 t -126.47 -26.83 3.24 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 111.936 -2.393 . . . . 0.0 105.044 179.637 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -100.32 -46.89 5.12 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 105.48 -2.045 . . . . 0.0 105.48 179.89 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.1 p -109.29 56.2 0.62 Allowed 'General case' 0 N--CA 1.497 1.896 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.252 -179.89 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -109.76 60.37 0.33 Allowed Glycine 0 N--CA 1.499 2.86 0 N-CA-C 109.074 -1.611 . . . . 0.0 109.074 -179.91 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -26.7 149.07 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 119.734 3.235 . . . . 0.0 119.734 -179.959 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 pttp . . . . . 0 N--CA 1.502 2.132 0 CA-C-N 112.104 -2.316 . . . . 0.0 116.007 179.471 . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 27.6 tptp . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.6 OUTLIER -30.23 142.98 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.778 0 C-N-CA 125.289 3.993 . . . . 0.0 117.594 -165.185 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.448 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 77.6 m-85 -123.42 162.76 22.18 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.285 -2.234 . . . . 0.0 108.843 -179.795 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -142.74 156.72 45.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 123.914 0.759 . . . . 0.0 110.093 179.576 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.542 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 29.4 t -100.49 125.69 46.84 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 179.617 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.516 ' H ' ' HD2' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -97.83 40.58 1.16 Allowed 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 122.492 1.139 . . . . 0.0 108.629 -179.846 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.542 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 23.4 m -127.25 -42.48 1.69 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 112.671 -2.059 . . . . 0.0 107.662 179.836 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.4 p -122.61 -39.91 2.5 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 123.788 0.68 . . . . 0.0 109.833 179.986 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 99.78 58.12 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 126.722 2.514 . . . . 0.0 111.538 179.781 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.8 ttt85 -112.72 158.11 20.46 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 103.188 -2.893 . . . . 0.0 103.188 179.437 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -117.04 160.62 20.69 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 119.472 -0.891 . . . . 0.0 112.39 -179.668 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.434 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 84.3 m-85 -137.9 176.04 9.05 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 113.841 -1.527 . . . . 0.0 107.314 -179.935 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.0 p -120.59 -22.56 6.34 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 116.64 2.089 . . . . 0.0 116.64 -179.495 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.41 ' O ' ' HB3' ' A' ' 15' ' ' SER . 40.0 mtp180 -101.48 -54.6 2.72 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 -179.071 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.448 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 95.0 p 130.23 -40.41 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 128.551 2.74 . . . . 0.0 108.364 -179.879 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -63.27 -33.85 76.39 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 103.75 -2.685 . . . . 0.0 103.75 179.688 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -58.26 -60.88 3.08 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 104.524 -2.399 . . . . 0.0 104.524 179.348 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.1 tp -45.43 -56.61 4.82 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.086 179.577 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -49.79 -56.61 9.68 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 179.871 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.1 m -51.08 -44.95 61.29 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 122.019 0.914 . . . . 0.0 109.117 179.64 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.434 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 70.9 t60 -63.1 -47.28 83.5 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-N 113.769 -1.56 . . . . 0.0 112.656 -179.886 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 p -67.56 -11.27 57.66 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.351 -0.843 . . . . 0.0 110.993 179.773 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 50.4 mmt-85 -106.07 45.14 0.99 Allowed 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 179.353 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.413 ' HB ' ' O ' ' A' ' 21' ' ' HIS . 89.8 m -127.79 -46.69 1.41 Allowed 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 110.299 -3.137 . . . . 0.0 102.674 179.759 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -71.6 -29.5 64.76 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 104.4 -2.444 . . . . 0.0 104.4 179.562 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 25.0 m -96.12 -51.97 4.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 105.186 -2.153 . . . . 0.0 105.186 179.781 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.39 -61.0 0.42 Allowed Glycine 0 N--CA 1.492 2.382 0 N-CA-C 107.903 -2.079 . . . . 0.0 107.903 179.821 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -7.71 73.56 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 -179.962 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.1 mttp . . . . . 0 N--CA 1.498 1.962 0 CA-C-N 114.076 -1.42 . . . . 0.0 108.167 179.745 . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -54.26 166.07 1.87 Allowed 'Trans proline' 0 N--CA 1.499 1.805 0 C-N-CA 123.47 2.78 . . . . 0.0 114.324 -177.079 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.451 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 79.9 m-85 -116.79 104.18 11.08 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 112.976 -1.92 . . . . 0.0 107.529 -179.934 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.403 ' HA ' ' HA ' ' A' ' 11' ' ' LYS . 21.6 tt0 -102.65 159.66 15.26 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 122.871 1.319 . . . . 0.0 113.635 -179.444 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.558 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 26.3 t -105.0 109.32 21.28 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 111.569 -2.56 . . . . 0.0 105.119 -179.989 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -94.83 48.43 1.19 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 123.386 1.565 . . . . 0.0 107.165 -179.812 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.558 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 23.8 m -123.45 -41.62 2.27 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 102.735 -3.061 . . . . 0.0 102.735 179.591 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.6 p -123.49 -35.7 2.89 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 124.187 0.929 . . . . 0.0 111.593 179.797 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 100.52 57.11 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.576 0 O-C-N 126.055 2.097 . . . . 0.0 109.011 -179.916 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.449 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 22.1 ttt180 -119.28 144.92 46.53 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 179.978 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 4' ' ' GLN . 63.8 pttt -111.86 165.87 11.7 Favored 'General case' 0 N--CA 1.502 2.158 0 C-N-CA 119.189 -1.005 . . . . 0.0 111.274 -179.777 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -139.35 176.15 8.96 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 124.22 0.95 . . . . 0.0 111.162 -179.563 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.0 p -97.34 -36.47 10.38 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 125.409 1.693 . . . . 0.0 109.785 -179.751 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.552 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 59.1 mtt85 -114.32 174.02 6.16 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 124.377 1.048 . . . . 0.0 109.871 179.858 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.451 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 97.7 p -102.15 11.36 38.43 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.726 -179.978 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.04 -32.53 6.01 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 105.497 -2.038 . . . . 0.0 105.497 179.607 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.552 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.7 m170 -67.97 -28.14 67.19 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 179.373 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.5 tp -76.69 -48.13 19.86 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 114.264 -1.334 . . . . 0.0 108.542 179.837 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -52.92 -62.92 1.34 Allowed 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.5 m -43.49 -43.26 5.3 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 124.716 1.26 . . . . 0.0 110.665 179.887 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.449 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 56.1 t60 -64.37 -56.53 13.76 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 113.712 -1.585 . . . . 0.0 114.23 179.992 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.492 ' C ' ' H ' ' A' ' 24' ' ' THR . 33.8 m -58.37 -10.91 2.33 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 112.297 0.481 . . . . 0.0 112.297 -179.446 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -90.2 38.8 0.94 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 179.537 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.492 ' H ' ' C ' ' A' ' 22' ' ' THR . 87.7 m -131.03 -13.65 3.54 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-N 111.831 -2.44 . . . . 0.0 105.538 179.72 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 -104.81 -44.13 4.92 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 104.323 -2.473 . . . . 0.0 104.323 179.744 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.5 m -93.79 -33.87 13.41 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-N 113.007 -1.906 . . . . 0.0 108.15 179.899 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -110.27 57.4 0.43 Allowed Glycine 0 N--CA 1.493 2.496 0 O-C-N 124.75 1.281 . . . . 0.0 111.746 -179.843 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.99 168.45 10.28 Favored 'General case' 0 C--N 1.308 -1.231 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.707 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.969 0 CA-C-O 122.317 1.056 . . . . 0.0 111.322 -179.863 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo . . . . . 0 N--CA 1.493 1.462 0 CA-C-O 121.659 0.608 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -124.46 156.9 36.42 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 113.378 -1.737 . . . . 0.0 108.551 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -133.42 145.19 50.05 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 124.572 1.17 . . . . 0.0 108.481 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.475 ' HA ' HD11 ' A' ' 18' ' ' LEU . 41.6 t -91.29 133.12 35.68 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 104.25 -2.5 . . . . 0.0 104.25 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.402 ' HZ2' ' HB2' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -101.52 34.87 2.45 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 124.412 1.07 . . . . 0.0 108.226 -179.649 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -128.33 -40.74 1.61 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 113.744 -1.571 . . . . 0.0 109.058 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.4 p -123.37 -41.85 2.27 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.482 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 102.39 64.43 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.16 0 O-C-N 126.452 2.345 . . . . 0.0 109.951 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -120.85 152.75 38.02 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 103.578 -2.749 . . . . 0.0 103.578 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -111.91 163.23 14.46 Favored 'General case' 0 N--CA 1.503 2.176 0 C-N-CA 118.668 -1.213 . . . . 0.0 112.382 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.46 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 92.9 m-85 -142.12 176.86 8.64 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 125.079 1.487 . . . . 0.0 109.079 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.8 p -107.52 -25.76 11.23 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 124.373 1.046 . . . . 0.0 111.273 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.569 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 64.6 mtt85 -123.94 164.67 18.83 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 123.88 0.737 . . . . 0.0 110.24 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.9 p -78.59 -33.63 47.41 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -70.66 -32.82 70.24 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 106.411 -1.699 . . . . 0.0 106.411 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.569 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 29.7 m170 -66.16 -62.16 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 105.532 -2.025 . . . . 0.0 105.532 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.475 HD11 ' HA ' ' A' ' 5' ' ' CYS . 43.5 tp -40.53 -56.18 2.13 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 124.34 1.025 . . . . 0.0 110.416 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -51.16 -64.85 0.68 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.247 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.1 m -41.96 -42.53 2.83 Favored 'General case' 0 N--CA 1.504 2.258 0 CA-C-O 121.734 0.778 . . . . 0.0 111.138 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.46 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 40.5 t60 -67.99 -58.01 5.23 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 113.648 -1.615 . . . . 0.0 113.748 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.425 ' C ' ' H ' ' A' ' 24' ' ' THR . 11.9 m -52.1 -38.51 57.55 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.172 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -71.6 24.31 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 117.804 -1.558 . . . . 0.0 114.563 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.425 ' H ' ' C ' ' A' ' 22' ' ' THR . 5.2 t -113.48 -3.72 13.66 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 . . . . . 0 N--CA 1.49 1.574 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.489 179.95 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo . . . . . 0 N--CA 1.48 0.692 0 CA-C-O 122.083 0.785 . . . . 0.0 111.598 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -123.49 160.99 25.75 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 112.805 -1.998 . . . . 0.0 106.355 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -137.31 153.03 50.36 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.507 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.406 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 36.0 t -97.69 133.8 41.73 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -99.19 38.55 1.39 Allowed 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.406 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 39.4 m -131.78 -42.62 1.01 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 113.858 -1.519 . . . . 0.0 109.744 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.0 p -121.4 -26.66 4.96 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 123.872 0.732 . . . . 0.0 111.139 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 85.17 51.04 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.198 0 O-C-N 125.36 1.663 . . . . 0.0 109.8 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.9 ttt-85 -110.49 156.71 20.49 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 103.189 -2.893 . . . . 0.0 103.189 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -119.13 163.56 16.85 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 119.074 -1.05 . . . . 0.0 112.389 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.441 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 86.5 m-85 -137.65 -174.95 3.91 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 113.793 -1.549 . . . . 0.0 110.054 -179.591 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.8 p -106.47 -41.84 5.18 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 124.419 1.075 . . . . 0.0 111.559 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.535 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 7.7 mtt180 -113.47 175.96 5.23 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 124.18 0.925 . . . . 0.0 110.114 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.7 p -87.82 -38.28 15.84 Favored 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.036 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -66.57 -29.89 70.06 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.535 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 49.4 m170 -65.07 -59.03 4.57 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.9 tp -45.25 -53.47 8.28 Favored 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -48.68 -61.21 2.15 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.1 m -43.57 -43.76 5.78 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.441 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 72.5 t60 -66.46 -53.32 36.71 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 114.884 -1.053 . . . . 0.0 113.015 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 82.8 p -44.0 -28.93 0.52 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 119.682 1.128 . . . . 0.0 110.604 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.442 ' N ' ' HD2' ' A' ' 23' ' ' ARG . 2.1 mpt_? -80.91 44.9 0.78 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 122.958 1.361 . . . . 0.0 113.715 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.419 ' H ' ' H ' ' A' ' 25' ' ' HIS . 29.8 p -131.3 -26.28 2.11 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.419 ' H ' ' H ' ' A' ' 24' ' ' THR . 63.3 m-70 . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 103.774 -2.676 . . . . 0.0 103.774 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo . . . . . 0 N--CA 1.489 1.25 0 N-CA-C 109.72 -0.916 . . . . 0.0 109.72 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.484 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 93.9 m-85 -114.76 143.59 44.83 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 101.908 -3.367 . . . . 0.0 101.908 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -128.54 154.89 45.69 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 119.837 -0.745 . . . . 0.0 111.35 -179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.447 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 8.2 t -101.02 136.44 40.86 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 103.572 -2.751 . . . . 0.0 103.572 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.9 mmmm -100.55 41.48 1.17 Allowed 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 122.163 0.982 . . . . 0.0 109.253 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.518 HG21 ' CG ' ' A' ' 25' ' ' HIS . 46.0 m -135.92 -48.38 0.67 Allowed 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.138 -1.846 . . . . 0.0 110.262 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 32.0 p -123.64 -16.81 6.62 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 124.257 0.973 . . . . 0.0 110.006 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 69.7 64.31 0.25 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 124.059 1.885 . . . . 0.0 109.764 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.447 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 28.5 ttt180 -116.1 120.06 37.82 Favored 'General case' 0 C--N 1.304 -1.386 1 N-CA-C 100.019 -4.067 . . . . 0.0 100.019 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.6 ' H ' ' HD2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -93.71 165.49 12.68 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 118.959 -1.096 . . . . 0.0 111.014 -179.662 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -136.48 174.29 10.77 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 113.628 -1.624 . . . . 0.0 109.737 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.4 p -96.85 -39.26 9.5 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 124.926 1.391 . . . . 0.0 107.896 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.469 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 5.5 mtt-85 -111.5 -179.18 3.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 124.921 1.388 . . . . 0.0 108.357 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.484 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 91.4 p -99.28 -21.92 15.84 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.871 -1.513 . . . . 0.0 107.843 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -91.39 26.85 2.12 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 122.419 1.104 . . . . 0.0 108.388 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.469 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 49.1 m170 -125.36 -40.18 2.13 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.6 tp -75.13 -52.0 12.06 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 106.387 -1.709 . . . . 0.0 106.387 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -68.34 -15.75 63.68 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.259 0.349 . . . . 0.0 110.363 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 84.8 m -95.82 -9.01 32.69 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 43.2 t60 -97.35 -55.72 2.75 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.17 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.473 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.3 p -44.02 -21.13 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.081 1.353 . . . . 0.0 113.542 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 20.7 ptt85 -77.07 27.2 0.14 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 124.089 0.868 . . . . 0.0 111.518 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.473 ' H ' ' C ' ' A' ' 22' ' ' THR . 8.9 t -117.08 -22.39 8.42 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.518 ' CG ' HG21 ' A' ' 7' ' ' THR . 66.0 m-70 . . . . . 0 N--CA 1.489 1.516 0 CA-C-N 113.882 -1.508 . . . . 0.0 107.525 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo . . . . . 0 N--CA 1.489 1.226 0 CA-C-O 121.853 0.689 . . . . 0.0 111.857 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.441 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 51.0 m-85 -132.0 112.29 12.26 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 112.458 -2.155 . . . . 0.0 106.386 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -108.39 157.49 18.36 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.469 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 38.0 t -97.07 112.82 24.42 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 103.753 -2.684 . . . . 0.0 103.753 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.1 29.42 0.83 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 124.472 1.108 . . . . 0.0 109.513 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.469 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.7 m -115.34 -41.9 3.23 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 113.597 -1.638 . . . . 0.0 108.518 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.9 p -119.27 -34.62 3.79 Favored 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.592 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 97.2 58.66 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.347 0 O-C-N 126.096 2.122 . . . . 0.0 109.978 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.456 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 48.3 ttt180 -118.94 146.54 44.88 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -112.91 162.51 15.74 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.588 -0.845 . . . . 0.0 112.45 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -138.94 179.61 6.39 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-N 113.219 -1.81 . . . . 0.0 109.51 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 88.6 p -102.44 -33.82 9.39 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 124.379 1.049 . . . . 0.0 108.969 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.544 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.0 mtt85 -119.41 171.66 8.17 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.587 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.441 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 94.3 p -85.16 -35.38 21.74 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.71 -39.77 94.21 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 104.209 -2.515 . . . . 0.0 104.209 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.544 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 37.7 m170 -56.39 -60.15 3.94 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.7 tp -42.82 -56.4 3.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 124.109 0.881 . . . . 0.0 109.74 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -48.57 -60.98 2.27 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.441 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.4 m -41.0 -46.09 2.76 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.712 0.768 . . . . 0.0 110.62 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.456 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 57.2 t60 -66.94 -55.36 14.94 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.668 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.2 p -45.51 -25.64 0.47 Allowed 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 48.8 mtt180 -52.87 -18.05 1.71 Allowed 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.0 t -87.02 -4.68 59.19 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 . . . . . 0 N--CA 1.494 1.727 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.987 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo . . . . . 0 N--CA 1.491 1.36 0 CA-C-O 121.637 0.599 . . . . 0.0 111.327 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.467 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 88.6 m-85 -122.46 152.61 40.1 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 105.176 -2.157 . . . . 0.0 105.176 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -140.2 154.17 46.83 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.496 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.517 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 40.2 t -98.44 117.23 32.38 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -92.26 37.56 0.99 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.517 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 57.2 m -123.39 -43.9 2.16 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 113.339 -1.755 . . . . 0.0 107.31 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 p -118.33 -36.86 3.45 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 123.921 0.763 . . . . 0.0 111.019 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 99.41 55.77 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 126.269 2.23 . . . . 0.0 109.079 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.0 157.42 18.69 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 103.225 -2.88 . . . . 0.0 103.225 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -120.34 158.47 27.05 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.812 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -138.31 171.53 14.25 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.888 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.4 p -96.67 -36.73 10.6 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.108 -1.86 . . . . 0.0 108.273 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.565 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 60.5 mtt85 -116.1 175.99 5.3 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 124.708 1.255 . . . . 0.0 110.96 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.467 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 90.1 p -95.38 -34.25 12.19 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 113.474 -1.694 . . . . 0.0 106.542 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.78 -38.28 90.44 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 104.659 -2.349 . . . . 0.0 104.659 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.565 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 31.5 m170 -59.94 -58.62 7.77 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.6 tp -44.6 -55.52 5.12 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.747 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -51.05 -58.8 5.16 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.193 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.9 m -43.86 -46.17 7.8 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 121.822 0.82 . . . . 0.0 110.159 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -64.32 -56.55 13.7 Favored 'General case' 0 N--CA 1.488 1.438 0 CA-C-N 113.182 -1.827 . . . . 0.0 114.046 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.419 ' C ' ' H ' ' A' ' 24' ' ' THR . 37.9 p -44.07 -30.68 0.78 Allowed 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.253 0.621 . . . . 0.0 110.414 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.04 39.43 0.37 Allowed 'General case' 0 N--CA 1.487 1.42 0 CA-C-N 114.112 -1.404 . . . . 0.0 111.319 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.419 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.5 t -124.37 -27.17 3.81 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 104.687 -2.338 . . . . 0.0 104.687 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.403 ' H ' ' H ' ' A' ' 24' ' ' THR . 70.9 m-70 . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 103.363 -2.828 . . . . 0.0 103.363 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 N--CA 1.492 1.405 0 N-CA-C 110.325 -0.683 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.535 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 81.1 m-85 -127.72 159.45 34.72 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 114.011 -1.449 . . . . 0.0 109.228 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -134.82 151.64 51.1 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 119.545 -0.862 . . . . 0.0 113.282 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 40.8 t -94.73 133.1 38.77 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 113.337 -1.756 . . . . 0.0 106.448 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -100.05 40.36 1.25 Allowed 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.422 HG21 ' CG ' ' A' ' 25' ' ' HIS . 53.3 m -134.84 -47.12 0.73 Allowed 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 113.026 -1.897 . . . . 0.0 108.453 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.447 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 29.9 p -125.33 4.15 7.75 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 123.891 0.744 . . . . 0.0 111.461 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 53.54 52.78 12.65 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 122.752 1.263 . . . . 0.0 110.328 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.447 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 19.4 ttt180 -105.34 154.39 20.35 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 102.666 -3.087 . . . . 0.0 102.666 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -116.93 158.87 23.34 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.903 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -135.91 -176.07 4.18 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 123.723 0.64 . . . . 0.0 110.075 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.5 p -103.09 -41.13 6.19 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 124.67 1.231 . . . . 0.0 110.255 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.498 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 28.7 mtt180 -114.89 163.83 14.99 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 124.169 0.918 . . . . 0.0 109.942 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.535 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 88.4 p -78.5 -33.65 47.98 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -69.49 -35.03 75.17 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 105.64 -1.985 . . . . 0.0 105.64 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.498 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 33.7 m170 -63.06 -59.01 5.37 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.7 tp -42.88 -53.94 4.43 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.857 0.723 . . . . 0.0 109.667 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -53.79 -57.64 10.15 Favored 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 119.875 -0.73 . . . . 0.0 111.468 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.0 m -41.34 -46.46 3.3 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 121.795 0.807 . . . . 0.0 110.142 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.1 t60 -65.49 -56.7 10.93 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 112.974 -1.921 . . . . 0.0 113.507 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.427 ' C ' ' H ' ' A' ' 24' ' ' THR . 45.4 p -52.26 -29.22 21.94 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.8 ttp180 -82.81 42.19 0.77 Allowed 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 123.032 1.396 . . . . 0.0 110.579 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.427 ' H ' ' C ' ' A' ' 22' ' ' THR . 5.9 t -131.52 -22.36 2.45 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 105.556 -2.016 . . . . 0.0 105.556 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.426 ' H ' ' H ' ' A' ' 24' ' ' THR . 78.3 m-70 . . . . . 0 N--CA 1.494 1.732 0 N-CA-C 104.832 -2.284 . . . . 0.0 104.832 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.498 1.789 0 N-CA-C 114.95 1.096 . . . . 0.0 114.95 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.435 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 85.8 m-85 -121.34 157.8 29.62 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 113.384 -1.735 . . . . 0.0 109.64 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -130.73 145.12 51.86 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 124.297 0.998 . . . . 0.0 108.795 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.407 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 40.4 t -92.97 138.89 31.08 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -105.24 36.1 2.6 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.8 m -131.57 -38.18 1.17 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 114.476 -1.238 . . . . 0.0 109.3 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.3 p -125.25 -39.04 2.24 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.538 -0.865 . . . . 0.0 109.406 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 98.33 60.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 126.587 2.429 . . . . 0.0 109.81 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.407 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 39.2 ttt-85 -112.51 159.43 18.79 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 103.503 -2.777 . . . . 0.0 103.503 179.6 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -115.91 158.18 23.39 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.167 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.482 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 93.9 m-85 -139.59 179.65 6.44 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 124.157 0.911 . . . . 0.0 110.051 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.9 p -107.33 -39.75 5.58 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 124.735 1.272 . . . . 0.0 110.313 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.38 171.11 7.71 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.435 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 65.4 p -84.73 -40.16 17.64 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -62.75 -29.71 70.89 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -66.34 -60.84 2.39 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.8 tp -43.6 -47.25 7.46 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 123.752 0.658 . . . . 0.0 111.365 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -58.05 -67.24 0.36 Allowed 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 119.685 -0.806 . . . . 0.0 109.624 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.2 m -35.39 -48.02 0.46 Allowed 'General case' 0 N--CA 1.504 2.231 0 O-C-N 124.641 1.213 . . . . 0.0 110.325 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.482 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 30.1 t60 -57.42 -61.17 2.68 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.654 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.473 ' C ' ' H ' ' A' ' 24' ' ' THR . 56.9 m -52.9 -12.74 0.35 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 124.255 0.972 . . . . 0.0 111.913 -179.648 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -90.46 40.29 1.01 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 123.373 1.559 . . . . 0.0 107.035 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.473 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.3 t -126.09 -26.11 3.45 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 103.585 -2.746 . . . . 0.0 103.585 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 105.287 -2.116 . . . . 0.0 105.287 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo . . . . . 0 N--CA 1.493 1.476 0 CA-C-O 121.88 0.7 . . . . 0.0 113.148 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 88.8 m-85 -131.31 162.24 30.52 Favored 'General case' 0 N--CA 1.499 2.0 0 CA-C-N 113.013 -1.903 . . . . 0.0 108.937 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -139.99 152.45 46.3 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.975 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.432 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 35.7 t -99.56 129.71 45.74 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 105.955 -1.868 . . . . 0.0 105.955 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -99.18 34.31 2.18 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 122.011 0.91 . . . . 0.0 109.445 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.432 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 53.5 m -123.17 -39.7 2.46 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.42 -1.718 . . . . 0.0 107.871 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -124.02 -40.78 2.26 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.292 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 104.41 51.74 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.72 0 O-C-N 126.299 2.249 . . . . 0.0 110.799 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 40.9 ttt85 -110.94 148.87 31.57 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 104.592 -2.373 . . . . 0.0 104.592 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -112.6 165.16 12.51 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.159 -1.016 . . . . 0.0 110.095 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -138.26 178.5 7.09 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.683 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 38.7 p -101.9 -40.25 6.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 125.175 1.547 . . . . 0.0 109.514 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.19 175.37 5.5 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.304 1.003 . . . . 0.0 109.55 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.442 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 74.8 p -89.84 -34.77 16.0 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.298 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.1 p-10 -65.05 -30.75 71.74 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -62.6 -61.54 2.35 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 106.063 -1.829 . . . . 0.0 106.063 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.2 tp -44.75 -50.99 9.78 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 124.115 0.884 . . . . 0.0 109.655 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -53.47 -60.27 3.52 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.802 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -47.55 -42.33 23.3 Favored 'General case' 0 N--CA 1.5 2.07 0 CA-C-O 121.646 0.736 . . . . 0.0 110.626 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -65.41 -57.65 7.81 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 113.781 -1.554 . . . . 0.0 114.233 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.9 p -45.03 -39.2 5.45 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.602 0.761 . . . . 0.0 111.651 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -82.85 39.02 0.6 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 116.939 -1.905 . . . . 0.0 112.98 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.0 t -121.23 -5.92 9.41 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 . . . . . 0 N--CA 1.488 1.429 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 179.854 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 N--CA 1.483 0.902 0 CA-C-O 121.888 0.703 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.528 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 96.6 m-85 -120.72 160.27 23.66 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -147.22 160.61 42.27 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 117.773 -1.571 . . . . 0.0 111.959 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.411 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 43.2 t -93.68 142.41 27.38 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.8 ttpp -107.07 32.76 4.37 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 125.123 1.515 . . . . 0.0 107.606 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.411 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 57.9 m -127.57 -38.31 1.92 Allowed 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 114.514 -1.221 . . . . 0.0 109.378 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.6 p -122.42 -41.03 2.42 Favored 'General case' 0 N--CA 1.499 2.014 0 C-N-CA 119.861 -0.736 . . . . 0.0 111.193 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 101.58 52.36 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 O-C-N 126.53 2.394 . . . . 0.0 109.975 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.22 148.0 33.78 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 103.48 -2.785 . . . . 0.0 103.48 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -112.74 160.68 17.7 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 118.347 -1.341 . . . . 0.0 111.619 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.418 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 83.2 m-85 -131.34 178.89 6.37 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-N 112.615 -2.084 . . . . 0.0 111.131 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 p -103.24 -31.55 10.04 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 125.383 1.677 . . . . 0.0 112.171 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.9 mtp180 -116.5 179.12 4.09 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 124.637 1.211 . . . . 0.0 107.876 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.528 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 89.6 p -108.7 20.74 18.15 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.973 0.892 . . . . 0.0 110.695 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.93 -35.06 3.57 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 55.7 m170 -59.8 -54.25 48.4 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 103.483 -2.784 . . . . 0.0 103.483 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.407 HD11 ' HA ' ' A' ' 5' ' ' CYS . 63.9 tp -36.83 -55.12 0.91 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 113.267 -1.788 . . . . 0.0 111.561 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.9 tptt -60.28 -59.18 5.83 Favored 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 m -42.68 -31.19 0.44 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 124.511 1.132 . . . . 0.0 111.376 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.418 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 16.2 t60 -82.28 -56.75 3.72 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 113.415 -1.721 . . . . 0.0 112.633 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.433 ' C ' ' H ' ' A' ' 24' ' ' THR . 14.6 m -43.86 -31.53 0.87 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 124.132 0.895 . . . . 0.0 111.522 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.42 43.13 0.53 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 118.5 -1.28 . . . . 0.0 112.453 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.433 ' H ' ' C ' ' A' ' 22' ' ' THR . 8.7 t -120.77 -24.92 5.56 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 103.053 -2.943 . . . . 0.0 103.053 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.407 ' H ' ' H ' ' A' ' 24' ' ' THR . 68.9 m-70 . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 103.888 -2.634 . . . . 0.0 103.888 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.487 1.102 0 CA-C-O 121.897 0.707 . . . . 0.0 111.954 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -120.26 157.11 29.84 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 105.564 -2.013 . . . . 0.0 105.564 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -135.8 148.09 48.59 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 120.122 -0.631 . . . . 0.0 112.35 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.469 ' HA ' HD11 ' A' ' 18' ' ' LEU . 16.7 t -99.15 133.67 43.11 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 101.936 -3.357 . . . . 0.0 101.936 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.532 ' HD3' ' N ' ' A' ' 6' ' ' LYS . 3.3 mppt? -105.9 35.27 2.96 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.247 0.967 . . . . 0.0 109.063 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.8 m -123.67 -40.86 2.29 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 113.158 -1.837 . . . . 0.0 106.699 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.423 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 24.8 p -130.2 -10.18 4.22 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 123.889 0.743 . . . . 0.0 111.196 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.6 mp0 67.65 60.87 0.45 Allowed 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 123.066 1.412 . . . . 0.0 111.018 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.423 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 21.0 ttt180 -116.13 145.1 43.33 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 102.04 -3.318 . . . . 0.0 102.04 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -107.77 162.33 14.09 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.865 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -140.74 -179.9 6.32 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.565 1.165 . . . . 0.0 110.158 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 64.6 p -102.75 -36.78 8.16 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.13 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.44 -176.9 3.32 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 124.307 1.004 . . . . 0.0 111.366 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 95.6 p -98.53 -37.01 9.73 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.488 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -61.02 -29.46 69.73 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -66.31 -67.89 0.41 Allowed 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.469 HD11 ' HA ' ' A' ' 5' ' ' CYS . 62.1 tp -38.62 -48.28 1.43 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 123.871 0.732 . . . . 0.0 112.373 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -53.82 -67.83 0.23 Allowed 'General case' 0 N--CA 1.499 2.0 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.882 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.2 m -46.71 -36.33 7.04 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 114.183 -1.372 . . . . 0.0 110.624 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 39.8 t60 -66.91 -60.2 2.85 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-N 114.77 -1.105 . . . . 0.0 112.03 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.5 m -50.7 -25.14 3.94 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 121.203 0.525 . . . . 0.0 112.407 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.446 ' HB3' ' NH2' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -58.69 -8.2 1.22 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.446 179.374 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 t -91.46 -3.83 56.2 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.069 0.462 . . . . 0.0 110.205 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 . . . . . 0 N--CA 1.492 1.658 0 CA-C-N 114.595 -1.184 . . . . 0.0 107.807 -179.88 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 N--CA 1.494 1.537 0 CA-C-O 122.192 0.83 . . . . 0.0 113.756 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -121.92 163.43 19.28 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 112.608 -2.087 . . . . 0.0 106.974 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -136.62 146.96 46.63 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.908 0.755 . . . . 0.0 110.952 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.412 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 12.6 t -104.03 130.91 51.72 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 101.342 -3.577 . . . . 0.0 101.342 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -106.47 42.97 1.19 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 122.316 1.055 . . . . 0.0 108.817 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.412 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 94.7 m -126.71 -40.58 1.9 Allowed 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 p -121.4 -32.19 3.91 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 123.987 0.805 . . . . 0.0 108.845 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 89.35 55.83 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 126.25 2.219 . . . . 0.0 109.448 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 44.4 ttt-85 -115.36 154.66 28.79 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HD3' ' H ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -114.5 167.65 10.55 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 118.852 -1.139 . . . . 0.0 110.349 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.424 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 88.6 m-85 -139.93 -179.76 6.14 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 114.297 -1.319 . . . . 0.0 109.159 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.8 p -104.06 -44.89 4.88 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 124.475 1.11 . . . . 0.0 110.094 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.587 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 23.7 mtt180 -109.96 -176.33 2.97 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.437 1.085 . . . . 0.0 109.428 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.6 p -95.19 -29.93 14.28 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.008 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -76.65 -4.31 42.4 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.587 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 46.1 m170 -97.16 -10.3 26.19 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 124.973 1.421 . . . . 0.0 107.903 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.7 tp -106.46 -54.22 2.51 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.359 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -66.13 -2.08 3.84 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.5 m -105.55 -39.96 5.93 Favored 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 104.254 -2.498 . . . . 0.0 104.254 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.424 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 50.1 t60 -58.54 -57.16 14.19 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.455 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.435 ' C ' ' H ' ' A' ' 24' ' ' THR . 7.7 p -37.26 -40.86 0.36 Allowed 'General case' 0 C--N 1.308 -1.218 0 O-C-N 125.282 1.614 . . . . 0.0 111.55 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.7 mtt180 -76.93 37.97 0.2 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 125.117 1.511 . . . . 0.0 113.066 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.435 ' H ' ' C ' ' A' ' 22' ' ' THR . 11.2 t -115.96 -24.59 8.04 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 103.585 -2.746 . . . . 0.0 103.585 179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 . . . . . 0 C--N 1.308 -1.2 0 N-CA-C 100.705 -3.813 . . . . 0.0 100.705 179.358 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo . . . . . 0 N--CA 1.493 1.445 0 CA-C-O 121.836 0.682 . . . . 0.0 112.984 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.427 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 64.6 m-85 -124.32 163.47 21.63 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-N 113.087 -1.87 . . . . 0.0 108.066 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.7 tp-100 -139.7 137.52 35.24 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.884 0.74 . . . . 0.0 109.486 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.462 ' HA ' HD11 ' A' ' 18' ' ' LEU . 44.0 t -84.4 144.21 28.94 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 179.501 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -105.87 32.57 4.27 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 124.743 1.277 . . . . 0.0 108.997 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 97.2 m -135.08 -39.51 0.76 Allowed 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 114.317 -1.31 . . . . 0.0 111.188 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.7 p -119.95 -45.71 2.46 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 119.465 -0.894 . . . . 0.0 109.475 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 103.48 61.51 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 126.942 2.651 . . . . 0.0 110.474 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.6 ttt85 -115.29 158.84 21.79 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 103.273 -2.862 . . . . 0.0 103.273 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.695 ' HB2' ' HZ3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -113.72 163.74 14.62 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 119.231 -0.988 . . . . 0.0 109.759 -179.767 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.488 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 99.2 m-85 -139.98 -179.41 5.94 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 124.553 1.158 . . . . 0.0 110.696 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.3 p -104.43 -37.18 7.29 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 113.637 -1.619 . . . . 0.0 110.57 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.18 -172.32 2.2 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 124.175 0.922 . . . . 0.0 110.567 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 80.2 p -97.4 -33.48 11.39 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -86.54 10.35 15.65 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.465 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -115.87 -18.18 10.81 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' A' ' 5' ' ' CYS . 36.2 tp -93.46 -57.51 2.57 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.374 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.421 ' NZ ' ' HB2' ' A' ' 19' ' ' LYS . 3.7 ttmp? -53.1 -64.19 0.9 Allowed 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.2 m -38.93 -43.65 0.98 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.257 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.488 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 22.0 t60 -69.68 -58.5 3.85 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 113.7 -1.591 . . . . 0.0 112.336 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.405 ' N ' ' CD2' ' A' ' 21' ' ' HIS . 21.8 m -45.78 -40.38 9.54 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 121.753 0.787 . . . . 0.0 110.356 -179.202 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.6 ttp85 -85.11 52.28 2.4 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-O 123.867 1.794 . . . . 0.0 111.865 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.9 t -137.01 -19.78 1.28 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 111.363 -2.653 . . . . 0.0 105.397 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 -179.898 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo . . . . . 0 N--CA 1.496 1.664 0 N-CA-C 116.227 1.587 . . . . 0.0 116.227 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 79.0 m-85 -128.66 158.89 37.28 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 112.688 -2.051 . . . . 0.0 107.492 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -142.76 155.81 44.9 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.73 0.776 . . . . 0.0 110.857 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.508 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 15.1 t -104.31 107.89 19.02 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 179.385 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.13 33.58 0.68 Allowed 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 122.514 1.15 . . . . 0.0 110.132 -179.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.508 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 35.0 m -112.71 -41.67 3.77 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 112.688 -2.051 . . . . 0.0 106.507 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 32.1 p -121.48 -29.34 4.44 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 124.041 0.838 . . . . 0.0 109.66 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 3.2 mp0 90.03 60.27 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 O-C-N 125.851 1.97 . . . . 0.0 110.831 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.4 ttt180 -121.05 151.68 39.52 Favored 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 104.627 -2.361 . . . . 0.0 104.627 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -116.28 161.14 19.45 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.417 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 90.3 m-85 -138.22 176.54 8.61 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 113.078 -1.874 . . . . 0.0 109.283 -179.62 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.7 p -102.71 -32.71 9.71 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 124.302 1.001 . . . . 0.0 110.573 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.4 ' CD ' ' CE1' ' A' ' 17' ' ' HIS . 32.7 mtp85 -116.54 176.3 5.17 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 124.484 1.115 . . . . 0.0 110.085 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 81.7 p -90.25 -36.58 14.65 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -66.16 -40.27 90.4 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 104.194 -2.521 . . . . 0.0 104.194 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.4 ' CE1' ' CD ' ' A' ' 14' ' ' ARG . 39.3 m170 -54.94 -58.92 5.66 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.2 tp -45.47 -52.82 9.7 Favored 'General case' 0 N--CA 1.502 2.132 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -52.54 -55.45 22.07 Favored 'General case' 0 N--CA 1.503 2.189 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.53 ' HA ' ' CZ ' ' A' ' 23' ' ' ARG . 52.9 m -42.94 -46.63 5.47 Favored 'General case' 0 N--CA 1.505 2.313 0 CA-C-O 121.612 0.72 . . . . 0.0 109.775 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.417 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 61.2 t60 -64.72 -56.81 11.37 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 113.359 -1.746 . . . . 0.0 114.588 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 48.7 p -43.77 -34.63 1.6 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.53 ' CZ ' ' HA ' ' A' ' 20' ' ' THR . 66.9 mtt85 -42.85 -23.62 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 179.511 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.2 t -95.29 19.6 10.48 Favored 'General case' 0 N--CA 1.512 2.631 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 31.2 m-70 . . . . . 0 N--CA 1.497 1.889 0 N-CA-C 104.226 -2.509 . . . . 0.0 104.226 179.297 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo . . . . . 0 N--CA 1.49 1.301 0 N-CA-C 110.32 -0.685 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.471 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 57.4 m-85 -123.67 161.25 25.47 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 113.577 -1.647 . . . . 0.0 107.631 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -130.43 149.27 52.18 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 124.188 0.93 . . . . 0.0 111.149 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.457 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 42.1 t -99.16 125.83 44.8 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 103.814 -2.661 . . . . 0.0 103.814 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -97.18 40.47 1.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 122.476 1.131 . . . . 0.0 108.644 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.457 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.7 m -131.6 -46.98 0.97 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 112.534 -2.121 . . . . 0.0 107.045 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 p -129.52 7.18 5.28 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 123.94 0.775 . . . . 0.0 112.731 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 51.36 57.51 6.53 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-O 122.735 1.255 . . . . 0.0 111.765 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.413 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 21.5 ttt180 -118.08 140.94 49.03 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 103.123 -2.918 . . . . 0.0 103.123 179.694 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -105.52 165.97 10.77 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -179.542 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -140.76 -171.46 3.24 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 113.428 -1.715 . . . . 0.0 110.446 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.6 p -106.38 -39.17 5.98 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 124.438 1.086 . . . . 0.0 110.571 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.403 ' HB2' ' CG ' ' A' ' 17' ' ' HIS . 3.7 mtp-105 -119.09 179.94 4.01 Favored 'General case' 0 N--CA 1.5 2.071 0 CA-C-O 121.78 0.8 . . . . 0.0 109.77 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.471 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 80.3 p -94.08 -33.09 13.51 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -76.49 -3.39 37.06 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.403 ' CG ' ' HB2' ' A' ' 14' ' ' ARG . 41.3 m170 -95.9 -56.03 2.8 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 101.575 -3.491 . . . . 0.0 101.575 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.411 HD11 ' HA ' ' A' ' 5' ' ' CYS . 69.1 tp -46.47 -50.48 16.87 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -52.06 -64.72 0.72 Allowed 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.5 m -40.22 -43.61 1.72 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.329 0.585 . . . . 0.0 110.68 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 41.0 t60 -64.64 -59.36 4.37 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 114.103 -1.408 . . . . 0.0 112.33 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.8 p -45.35 -34.57 3.08 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -43.07 -25.01 0.09 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.1 t -92.38 9.57 33.61 Favored 'General case' 0 N--CA 1.511 2.586 0 N-CA-C 116.165 1.913 . . . . 0.0 116.165 -179.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.418 ' CG ' HG21 ' A' ' 7' ' ' THR . 27.5 m-70 . . . . . 0 N--CA 1.497 1.878 0 N-CA-C 104.55 -2.389 . . . . 0.0 104.55 179.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 N--CA 1.491 1.357 0 N-CA-C 109.481 -1.007 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.5 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 81.7 m-85 -120.56 155.17 34.24 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -141.0 154.96 46.27 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.19 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.7 t -92.55 140.81 29.18 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 114.149 -1.387 . . . . 0.0 107.806 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.615 ' HD3' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -100.38 29.1 4.55 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 114.759 -1.109 . . . . 0.0 109.851 -179.727 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.513 HG21 ' CG ' ' A' ' 25' ' ' HIS . 56.0 m -129.6 -43.0 1.27 Allowed 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 114.097 -1.41 . . . . 0.0 110.764 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.1 p -125.25 -0.83 7.68 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 119.568 -0.853 . . . . 0.0 110.027 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 54.35 60.37 3.61 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 122.948 1.356 . . . . 0.0 110.556 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -112.44 149.97 31.83 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 103.302 -2.851 . . . . 0.0 103.302 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -110.99 160.22 17.01 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 119.085 -1.046 . . . . 0.0 112.025 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -137.58 175.41 9.63 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 114.495 -1.229 . . . . 0.0 109.528 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.2 p -98.58 -40.81 8.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 124.708 1.255 . . . . 0.0 110.41 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.47 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 42.6 mtt180 -113.77 167.24 10.79 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 124.258 0.974 . . . . 0.0 110.09 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.5 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 84.3 p -81.64 -36.15 29.2 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -64.92 -30.72 71.73 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.47 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.7 m170 -66.97 -60.38 2.68 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 tp -43.29 -52.52 5.71 Favored 'General case' 0 N--CA 1.503 2.191 0 CA-C-O 121.303 0.573 . . . . 0.0 110.603 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -49.45 -65.4 0.57 Allowed 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.832 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 85.8 m -43.82 -44.74 7.0 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.853 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -58.71 -60.29 4.06 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.4 m -45.35 -21.9 0.11 Allowed 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 114.861 -1.063 . . . . 0.0 113.734 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.1 ptt-85 -50.12 -24.6 2.84 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.3 t -82.24 7.17 14.47 Favored 'General case' 0 N--CA 1.505 2.28 0 CA-C-O 121.45 0.643 . . . . 0.0 112.183 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.513 ' CG ' HG21 ' A' ' 7' ' ' THR . 59.8 m-70 . . . . . 0 N--CA 1.493 1.722 0 CA-C-N 114.198 -1.365 . . . . 0.0 109.958 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.486 1.05 0 CA-C-O 122.259 0.858 . . . . 0.0 112.053 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -125.66 155.78 40.3 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 112.238 -2.255 . . . . 0.0 106.19 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -136.2 152.08 50.4 Favored 'General case' 0 N--CA 1.499 1.975 0 C-N-CA 119.221 -0.992 . . . . 0.0 112.212 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.501 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 27.0 t -101.11 109.12 20.97 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.58 ' H ' ' HD2' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -88.06 39.68 0.91 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.501 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 27.6 m -122.76 -39.8 2.49 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 113.195 -1.82 . . . . 0.0 106.808 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.428 ' O ' ' CB ' ' A' ' 9' ' ' GLN . 31.4 p -125.21 -32.74 2.94 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.428 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 9.8 tp60 93.72 57.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 126.358 2.286 . . . . 0.0 110.201 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.45 155.83 29.0 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -118.71 161.43 20.11 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.497 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 82.5 m-85 -137.94 -175.49 4.11 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.357 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.5 p -105.03 -37.51 6.92 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 124.24 0.963 . . . . 0.0 111.246 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.516 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 54.7 mtt85 -118.69 -175.7 2.94 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 123.804 0.69 . . . . 0.0 110.423 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 88.6 p -93.07 -33.51 14.05 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -76.51 3.21 11.8 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.516 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 39.1 m170 -103.04 -42.22 5.86 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.7 tp -65.56 -49.45 68.8 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.155 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -55.61 -64.43 0.85 Allowed 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 47.3 m -41.07 -38.42 1.02 Allowed 'General case' 0 N--CA 1.503 2.19 0 O-C-N 124.278 0.986 . . . . 0.0 111.968 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 46.5 t60 -73.36 -55.33 6.53 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.5 m -49.48 -23.34 1.52 Allowed 'General case' 0 N--CA 1.508 2.453 0 CA-C-O 120.931 0.396 . . . . 0.0 112.04 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -48.64 -26.95 2.52 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.098 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.0 p -79.66 5.48 13.14 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.92 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo . . . . . 0 N--CA 1.488 1.17 0 N-CA-C 107.521 -1.761 . . . . 0.0 107.521 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.427 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 38.8 m-85 -119.95 157.09 29.53 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -139.89 155.62 47.1 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.958 -0.697 . . . . 0.0 109.887 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.441 ' HA ' HD11 ' A' ' 18' ' ' LEU . 43.6 t -91.68 142.52 27.52 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.4 ' NZ ' ' HB3' ' A' ' 6' ' ' LYS . 3.8 mmmp? -104.71 38.4 1.91 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 115.107 -0.951 . . . . 0.0 108.999 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.8 m -136.14 -43.12 0.64 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 113.266 -1.788 . . . . 0.0 110.223 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.1 p -118.34 -40.83 2.89 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 124.123 0.89 . . . . 0.0 110.09 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 3.9 mp0 93.86 56.61 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.976 0 O-C-N 126.778 2.549 . . . . 0.0 110.57 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.531 ' NH1' ' CE1' ' A' ' 12' ' ' PHE . 41.2 ttt-85 -107.5 157.98 17.58 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 101.034 -3.691 . . . . 0.0 101.034 179.352 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.66 167.38 10.27 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 118.647 -1.221 . . . . 0.0 113.041 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.531 ' CE1' ' NH1' ' A' ' 10' ' ' ARG . 94.5 m-85 -144.96 177.03 9.04 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 113.612 -1.631 . . . . 0.0 108.12 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 81.8 p -104.61 -34.04 8.31 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.593 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 31.6 mtt180 -119.86 -173.86 2.63 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 113.744 -1.571 . . . . 0.0 111.697 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.427 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 38.3 p -95.71 -33.81 12.17 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.859 -1.519 . . . . 0.0 108.374 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -70.35 -35.18 73.41 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.593 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 36.7 m170 -64.74 -13.77 56.24 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 124.512 1.133 . . . . 0.0 110.742 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.441 HD11 ' HA ' ' A' ' 5' ' ' CYS . 51.5 tp -100.08 -50.8 3.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 123.973 0.796 . . . . 0.0 109.733 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.31 -32.35 64.54 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 119.799 -0.761 . . . . 0.0 112.009 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.0 m -74.63 -42.11 59.18 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.437 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 43.5 t60 -56.2 -58.15 9.17 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.405 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.0 p -42.16 -24.45 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.566 1.547 . . . . 0.0 113.795 -179.696 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.4 mtt85 -70.84 10.3 0.54 Allowed 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 114.627 -1.169 . . . . 0.0 111.358 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.405 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.3 t -106.95 -2.36 21.29 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.9 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo . . . . . 0 N--CA 1.495 1.579 0 CA-C-O 122.14 0.808 . . . . 0.0 114.078 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -127.31 153.08 46.62 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 112.586 -2.097 . . . . 0.0 106.883 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -130.21 139.46 50.81 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.465 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 44.8 t -91.35 105.12 17.55 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 101.537 -3.505 . . . . 0.0 101.537 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.1 pttt -90.34 42.95 1.12 Allowed 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 123.021 1.391 . . . . 0.0 108.29 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.465 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 26.1 m -124.34 -42.77 2.09 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 111.686 -2.506 . . . . 0.0 105.164 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 21.4 p -123.32 -35.98 2.88 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 123.838 0.711 . . . . 0.0 109.757 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.481 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 2.5 mp0 94.38 66.0 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 O-C-N 126.307 2.254 . . . . 0.0 111.711 179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.4 ttt85 -122.1 153.89 38.08 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 104.029 -2.582 . . . . 0.0 104.029 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -112.51 156.41 22.66 Favored 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 119.647 -0.821 . . . . 0.0 112.671 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -140.94 -179.55 6.14 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 113.919 -1.492 . . . . 0.0 108.417 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 56.3 p -108.28 -37.42 6.01 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 124.147 0.904 . . . . 0.0 110.139 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.512 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 52.9 mtt85 -118.92 179.09 4.25 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 124.606 1.191 . . . . 0.0 111.719 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.423 ' C ' ' H ' ' A' ' 17' ' ' HIS . 92.8 p -94.38 -29.01 15.22 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 113.283 -1.78 . . . . 0.0 107.134 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -83.26 13.52 4.2 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.512 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 35.9 m170 -113.34 -57.58 2.27 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 101.111 -3.662 . . . . 0.0 101.111 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.9 tp -47.65 -46.26 28.75 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -51.26 -65.69 0.51 Allowed 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.3 m -39.74 -46.05 1.83 Allowed 'General case' 0 N--CA 1.502 2.135 0 CA-C-O 121.793 0.806 . . . . 0.0 111.016 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.5 t60 -63.67 -55.47 23.21 Favored 'General case' 0 N--CA 1.495 1.786 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.495 ' C ' ' H ' ' A' ' 24' ' ' THR . 21.6 p -47.77 -16.19 0.07 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -179.534 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -75.01 23.16 0.1 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.542 -1.263 . . . . 0.0 111.68 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.495 ' H ' ' C ' ' A' ' 22' ' ' THR . 25.5 p -114.47 -14.37 12.15 Favored 'General case' 0 N--CA 1.498 1.928 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 . . . . . 0 N--CA 1.492 1.648 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 179.805 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.456 ' HB3' ' HZ3' ' A' ' 11' ' ' LYS . 38.5 Cg_exo . . . . . 0 N--CA 1.493 1.449 0 CA-C-O 122.153 0.814 . . . . 0.0 113.948 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.406 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 78.6 m-85 -121.79 153.24 38.57 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 112.577 -2.102 . . . . 0.0 106.548 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -135.41 152.94 51.89 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 119.574 -0.85 . . . . 0.0 109.298 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 28.9 t -91.79 146.66 23.59 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 114.656 -1.156 . . . . 0.0 108.57 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -105.48 36.89 2.36 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 121.905 0.859 . . . . 0.0 109.612 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.537 HG21 ' CG ' ' A' ' 25' ' ' HIS . 90.0 m -134.12 -45.15 0.78 Allowed 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 113.491 -1.686 . . . . 0.0 110.149 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 28.0 p -120.85 -24.34 5.69 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 124.218 0.949 . . . . 0.0 110.272 -179.679 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.415 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 11.7 mp0 75.79 56.69 0.06 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 125.308 1.63 . . . . 0.0 109.556 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.7 ttt85 -109.63 153.47 24.16 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 101.481 -3.526 . . . . 0.0 101.481 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HZ3' ' HB3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -114.67 163.79 14.95 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 118.708 -1.197 . . . . 0.0 112.624 -179.79 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.448 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 84.4 m-85 -138.17 177.83 7.58 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.801 -1.545 . . . . 0.0 108.01 -179.576 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 p -101.72 -35.14 9.18 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 124.042 0.839 . . . . 0.0 111.534 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.4 mtp-105 -118.14 179.13 4.19 Favored 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.406 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 85.5 p -89.38 -40.42 12.76 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -62.09 -22.85 66.13 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -75.11 -58.8 3.06 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 105.739 -1.948 . . . . 0.0 105.739 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.5 tp -43.98 -48.74 8.72 Favored 'General case' 0 N--CA 1.504 2.236 0 CA-C-O 121.312 0.577 . . . . 0.0 110.019 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -54.82 -59.49 4.65 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 73.1 m -45.43 -43.56 11.46 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-O 121.285 0.564 . . . . 0.0 110.649 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.448 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 68.1 t60 -63.3 -61.68 2.2 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 114.108 -1.405 . . . . 0.0 113.38 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.9 p -43.82 -31.91 0.94 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.456 ' CZ ' ' HA ' ' A' ' 23' ' ' ARG . 0.2 OUTLIER -44.35 -29.01 0.61 Allowed 'General case' 0 N--CA 1.489 1.48 0 CA-C-N 114.396 -1.275 . . . . 0.0 113.631 179.429 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.4 t -86.22 9.51 17.39 Favored 'General case' 0 N--CA 1.507 2.412 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -179.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.537 ' CG ' HG21 ' A' ' 7' ' ' THR . 39.8 m-70 . . . . . 0 N--CA 1.492 1.662 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo . . . . . 0 N--CA 1.49 1.285 0 N-CA-C 109.978 -0.816 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.461 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 70.8 m-85 -128.95 161.41 29.97 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-N 112.963 -1.926 . . . . 0.0 108.138 179.703 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -138.08 156.76 47.46 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 123.717 0.636 . . . . 0.0 111.017 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 44.3 t -97.34 136.04 38.37 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -100.89 36.93 1.83 Allowed 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 122.03 0.919 . . . . 0.0 109.191 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 59.6 m -131.72 -43.57 1.0 Allowed 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.594 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 29.7 p -118.98 -26.42 6.0 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 123.92 0.763 . . . . 0.0 110.188 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 9.9 mp0 78.87 56.68 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 125.359 1.662 . . . . 0.0 109.278 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.06 157.82 22.04 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 103.286 -2.857 . . . . 0.0 103.286 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -117.27 163.2 16.68 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 118.924 -1.11 . . . . 0.0 113.042 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.42 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 81.6 m-85 -140.01 -177.61 5.07 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 113.522 -1.672 . . . . 0.0 108.824 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.1 p -107.59 -24.02 11.92 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.188 0.93 . . . . 0.0 111.721 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.8 mtp180 -125.18 170.08 11.59 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 123.569 0.543 . . . . 0.0 110.182 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.461 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 82.8 p -96.93 15.79 21.27 Favored 'General case' 0 N--CA 1.503 2.182 0 CA-C-O 121.667 0.746 . . . . 0.0 110.066 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.76 -29.41 4.34 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -67.79 -50.74 55.29 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 100.223 -3.991 . . . . 0.0 100.223 179.079 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.9 tp -57.26 -46.17 83.32 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 113.873 -1.512 . . . . 0.0 109.144 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 ttmm -64.69 -9.81 22.55 Favored 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.4 m -99.31 -41.58 7.38 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 103.567 -2.753 . . . . 0.0 103.567 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.42 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 55.1 t60 -54.67 -57.66 10.58 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 113.975 -1.466 . . . . 0.0 111.27 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.481 ' C ' ' H ' ' A' ' 24' ' ' THR . 9.9 p -42.33 -24.56 0.05 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 125.426 1.49 . . . . 0.0 113.185 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.4 mtt180 -81.36 34.21 0.37 Allowed 'General case' 0 N--CA 1.486 1.37 0 O-C-N 124.459 1.1 . . . . 0.0 110.536 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.481 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.7 t -124.54 -10.47 7.38 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 . . . . . 0 N--CA 1.492 1.658 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.484 -179.906 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 N--CA 1.503 2.068 0 CA-C-O 122.202 0.834 . . . . 0.0 112.906 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.45 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 61.8 m-85 -122.41 164.02 18.77 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 113.695 -1.593 . . . . 0.0 109.367 -179.829 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -135.25 151.07 50.24 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 124.495 1.122 . . . . 0.0 108.334 179.458 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.487 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 42.9 t -98.99 130.57 45.34 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -102.37 40.34 1.37 Allowed 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 122.731 1.253 . . . . 0.0 108.856 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.487 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 32.8 m -126.69 -41.07 1.87 Allowed 'General case' 0 N--CA 1.485 1.325 0 CA-C-N 112.32 -2.218 . . . . 0.0 105.727 179.481 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.497 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 28.4 p -122.93 -44.95 2.17 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 123.904 0.752 . . . . 0.0 111.375 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 104.22 57.67 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 127.523 2.329 . . . . 0.0 107.794 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.497 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 33.2 ttt180 -112.48 162.66 15.36 Favored 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 179.796 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -122.44 159.83 26.77 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.598 -0.841 . . . . 0.0 112.423 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.1 m-85 -140.63 -173.89 3.82 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 124.405 1.065 . . . . 0.0 109.596 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.4 p -108.39 -40.26 5.19 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.575 -179.803 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.578 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.2 mtt180 -112.41 179.54 3.96 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 124.142 0.901 . . . . 0.0 110.112 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.45 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 87.7 p -100.38 0.56 40.16 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 114.411 -1.268 . . . . 0.0 107.658 179.791 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.424 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 1.4 p30 -112.03 7.86 19.94 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 179.485 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.578 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 39.5 m170 -114.44 -14.8 12.14 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.4 tp -92.27 -34.67 14.15 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 179.852 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.424 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 0.1 OUTLIER -80.2 -40.96 26.12 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.85 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.8 m -66.27 -8.78 26.94 Favored 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 179.564 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.543 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 13.0 t60 -98.34 -56.07 2.58 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.377 179.38 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 94.2 m -54.06 -17.81 3.03 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -179.458 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.8 ptt180 -66.34 4.78 0.66 Allowed 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 119.299 -0.96 . . . . 0.0 113.323 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 72.9 p -105.42 0.14 26.57 Favored 'General case' 0 N--CA 1.505 2.299 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.569 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 33.2 m170 . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 179.964 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.453 0 CA-C-O 121.712 0.63 . . . . 0.0 111.971 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -125.69 164.29 20.94 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 113.501 -1.681 . . . . 0.0 107.54 179.784 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.7 tp-100 -135.27 152.08 51.17 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 123.818 0.699 . . . . 0.0 110.118 -179.995 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.474 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 32.0 t -100.33 136.54 40.06 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 179.511 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -105.33 36.97 2.32 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 124.908 1.38 . . . . 0.0 108.25 -179.939 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.3 m -130.25 -42.23 1.22 Allowed 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 113.358 -1.747 . . . . 0.0 108.947 -179.948 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.9 p -120.28 -45.9 2.42 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.953 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.0 mm100 105.55 60.75 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 126.983 2.677 . . . . 0.0 110.51 179.933 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.474 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 45.9 ttt-85 -114.16 154.45 27.82 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 102.878 -3.008 . . . . 0.0 102.878 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -111.29 163.44 13.95 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.299 -0.961 . . . . 0.0 110.421 -179.758 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.498 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 92.9 m-85 -141.24 -173.72 3.82 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 124.532 1.145 . . . . 0.0 109.639 -179.725 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.4 p -108.87 -38.86 5.49 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 124.604 1.19 . . . . 0.0 109.702 -179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.424 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 46.9 mtt180 -119.16 -176.95 3.23 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 124.102 0.876 . . . . 0.0 110.67 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 81.1 p -95.0 -36.97 11.35 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.182 -179.908 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -64.84 -33.97 77.27 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 104.036 -2.579 . . . . 0.0 104.036 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.424 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 47.6 m170 -59.83 -57.22 13.85 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 106.279 -1.749 . . . . 0.0 106.279 179.491 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.1 tp -47.03 -47.81 22.23 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.037 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.6 mttp -60.21 -50.66 72.8 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 118.354 -1.338 . . . . 0.0 110.834 179.473 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.5 m -47.59 -46.25 28.08 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 179.545 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.498 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 62.7 t60 -60.58 -56.44 21.29 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 113.221 -1.809 . . . . 0.0 114.406 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.485 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.1 p -50.46 -14.44 0.18 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -89.52 39.59 0.95 Allowed 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 179.717 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.485 ' H ' ' C ' ' A' ' 22' ' ' THR . 95.5 m -131.75 -11.72 3.42 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 112.487 -2.142 . . . . 0.0 107.481 179.839 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 50.4 m-70 . . . . . 0 N--CA 1.494 1.76 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 179.843 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo . . . . . 0 N--CA 1.496 1.618 0 CA-C-O 121.735 0.64 . . . . 0.0 113.226 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.405 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 70.8 m-85 -127.23 161.17 29.19 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 112.942 -1.935 . . . . 0.0 107.257 179.738 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.499 HE22 ' HB3' ' A' ' 11' ' ' LYS . 9.9 tp-100 -140.08 149.57 43.26 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.427 179.908 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.467 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 37.0 t -98.36 121.37 40.21 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 103.785 -2.672 . . . . 0.0 103.785 179.439 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -95.57 41.27 1.1 Allowed 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.467 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 22.4 m -128.95 -42.13 1.41 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 113.406 -1.725 . . . . 0.0 108.55 -179.935 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.3 p -120.25 -42.32 2.58 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 123.96 0.788 . . . . 0.0 109.119 -179.957 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.8 mm100 102.75 57.66 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.975 0 O-C-N 126.888 2.617 . . . . 0.0 111.163 179.777 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.07 155.34 26.13 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 103.171 -2.9 . . . . 0.0 103.171 179.45 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.499 ' HB3' HE22 ' A' ' 4' ' ' GLN . 25.7 pttm -113.47 163.08 15.35 Favored 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.8 -179.737 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.412 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.2 m-85 -140.97 -178.09 5.4 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 124.264 0.978 . . . . 0.0 109.135 -179.802 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.0 p -105.85 -37.19 6.77 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 124.955 1.409 . . . . 0.0 111.002 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.8 mtp-105 -118.66 -178.85 3.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 124.424 1.078 . . . . 0.0 109.942 179.975 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.405 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 74.1 p -93.6 -34.82 13.17 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.14 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -74.96 0.54 15.45 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -97.61 -52.82 3.63 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 102.051 -3.315 . . . . 0.0 102.051 179.493 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.8 tp -52.26 -47.52 65.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 124.157 0.911 . . . . 0.0 108.917 179.547 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -59.5 -55.75 30.68 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.585 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 65.8 m -52.87 -25.25 11.04 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.025 0.441 . . . . 0.0 111.173 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.412 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 66.4 t60 -82.98 -55.87 4.13 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.341 179.677 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.407 ' C ' ' H ' ' A' ' 24' ' ' THR . 8.1 p -45.95 -37.28 6.27 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.174 0.99 . . . . 0.0 112.602 -179.544 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -64.02 10.95 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 118.693 -1.203 . . . . 0.0 114.013 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.407 ' H ' ' C ' ' A' ' 22' ' ' THR . 11.8 t -105.06 -7.14 19.37 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.682 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.994 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo . . . . . 0 N--CA 1.491 1.346 0 CA-C-O 121.675 0.615 . . . . 0.0 112.472 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.414 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 64.7 m-85 -129.05 149.95 50.65 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.665 -1.607 . . . . 0.0 107.159 179.907 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -124.54 141.82 51.81 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 123.971 0.794 . . . . 0.0 109.415 179.97 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.414 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 49.6 t -91.73 119.71 31.82 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 101.82 -3.4 . . . . 0.0 101.82 179.49 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -95.05 39.27 1.11 Allowed 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 -179.688 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.414 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 24.0 m -128.7 -44.62 1.34 Allowed 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 113.106 -1.861 . . . . 0.0 108.234 179.963 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 29.9 p -119.65 -34.05 3.87 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 119.759 -0.777 . . . . 0.0 109.403 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 4.3 mp0 91.77 64.33 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 126.38 2.3 . . . . 0.0 111.359 179.712 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.56 152.84 36.34 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 104.058 -2.571 . . . . 0.0 104.058 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -113.56 155.07 26.07 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 119.187 -1.005 . . . . 0.0 110.553 -179.691 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -135.4 -172.03 2.97 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.184 -179.694 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.1 p -108.98 -42.8 4.35 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 113.605 -1.634 . . . . 0.0 111.458 -179.84 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.545 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 55.5 mtt180 -114.6 170.28 8.43 Favored 'General case' 0 N--CA 1.506 2.342 0 CA-C-O 121.839 0.828 . . . . 0.0 111.815 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.414 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 69.3 p -82.39 -39.16 23.08 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 179.939 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.47 -27.55 67.12 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 179.864 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.545 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 45.7 m170 -71.16 -60.29 2.31 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 104.418 -2.438 . . . . 0.0 104.418 179.491 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.5 tp -41.44 -52.05 3.68 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 123.801 0.688 . . . . 0.0 109.431 179.41 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -47.04 -69.02 0.14 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.713 0.633 . . . . 0.0 110.796 179.471 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.47 ' HA ' ' NH1' ' A' ' 23' ' ' ARG . 56.0 m -42.66 -42.03 3.32 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.936 -179.91 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -66.46 -61.81 1.8 Allowed 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 113.915 -1.493 . . . . 0.0 113.611 179.983 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.3 m -41.85 -45.69 3.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 124.382 1.051 . . . . 0.0 111.605 -178.925 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.47 ' NH1' ' HA ' ' A' ' 20' ' ' THR . 37.6 ttp180 -34.7 -31.9 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 O-C-N 125.97 2.044 . . . . 0.0 114.792 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.3 t -77.18 14.39 0.92 Allowed 'General case' 0 N--CA 1.506 2.329 0 CA-C-O 121.765 0.793 . . . . 0.0 112.667 -179.659 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.0 m-70 . . . . . 0 N--CA 1.492 1.66 0 CA-C-N 114.039 -1.437 . . . . 0.0 107.784 179.562 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo . . . . . 0 N--CA 1.49 1.277 0 N-CA-C 109.554 -0.979 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -121.9 159.9 25.9 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 113.05 -1.886 . . . . 0.0 107.055 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -140.31 150.49 44.07 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.489 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.42 ' HA ' HD11 ' A' ' 18' ' ' LEU . 31.9 t -87.25 144.59 26.74 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 179.596 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -102.54 32.16 3.73 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.162 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 39.9 m -131.57 -40.88 1.08 Allowed 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 114.124 -1.398 . . . . 0.0 110.178 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 26.9 p -121.34 -42.13 2.47 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 124.011 0.819 . . . . 0.0 111.259 -179.671 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.5 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 2.6 mp0 99.62 58.5 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 126.811 2.569 . . . . 0.0 108.955 179.97 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.45 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 16.8 ttt180 -104.6 159.31 15.86 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 101.373 -3.566 . . . . 0.0 101.373 179.477 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -114.49 161.18 18.34 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 119.197 -1.001 . . . . 0.0 112.165 -179.41 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.429 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.9 m-85 -144.04 176.26 9.43 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 124.44 1.087 . . . . 0.0 109.348 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 43.5 p -106.19 -40.52 5.61 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.653 1.221 . . . . 0.0 110.598 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.552 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 58.2 mtt85 -112.27 171.57 7.43 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 124.579 1.174 . . . . 0.0 110.053 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 88.8 p -85.51 -36.63 20.4 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 179.864 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.26 -32.78 74.28 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 179.978 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.552 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 41.6 m170 -67.1 -60.78 2.33 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 179.666 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.42 HD11 ' HA ' ' A' ' 5' ' ' CYS . 44.6 tp -40.14 -51.77 2.61 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 123.758 0.661 . . . . 0.0 110.721 179.451 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -54.81 -60.37 3.46 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.644 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.5 m -42.35 -40.81 2.63 Favored 'General case' 0 N--CA 1.501 2.103 0 CA-C-O 121.489 0.661 . . . . 0.0 111.767 179.723 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.45 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 53.3 t60 -71.57 -57.37 4.46 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 113.92 -1.491 . . . . 0.0 114.191 179.666 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.7 p -44.01 -35.92 2.28 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.591 0.757 . . . . 0.0 112.306 -179.127 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -81.73 44.88 0.85 Allowed 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 118.457 -1.297 . . . . 0.0 111.766 179.765 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.0 t -124.14 -21.78 4.95 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 179.495 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 . . . . . 0 N--CA 1.486 1.374 0 CA-C-N 114.107 -1.406 . . . . 0.0 110.249 -179.6 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo . . . . . 0 N--CA 1.493 1.459 0 CA-C-O 121.842 0.684 . . . . 0.0 113.335 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.422 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 58.9 m-85 -127.74 167.6 16.25 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 113.005 -1.907 . . . . 0.0 107.746 179.982 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -148.06 153.18 38.58 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.846 179.493 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.475 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 34.7 t -94.79 127.75 41.02 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 179.819 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.467 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -95.42 38.78 1.14 Allowed 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 -179.585 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.475 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 29.2 m -130.68 -44.59 1.08 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 113.887 -1.506 . . . . 0.0 109.89 179.932 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 32.0 p -120.71 -26.58 5.25 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 123.75 0.656 . . . . 0.0 110.789 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.469 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 6.8 mp0 85.82 57.91 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 125.93 2.018 . . . . 0.0 112.304 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.68 151.86 34.26 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 179.35 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -113.96 162.88 15.86 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.149 -1.02 . . . . 0.0 112.216 -179.799 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -137.11 -173.81 3.56 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.699 -1.591 . . . . 0.0 109.485 -179.575 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 80.7 p -111.24 -37.58 5.26 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 124.313 1.008 . . . . 0.0 108.452 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.509 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.4 mtt85 -116.09 -178.16 3.34 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.913 -179.939 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.422 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 87.1 p -97.17 -24.19 15.85 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 113.689 -1.596 . . . . 0.0 107.418 179.95 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -90.29 19.01 5.42 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 122.483 1.135 . . . . 0.0 108.549 179.808 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.509 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 22.7 m170 -120.27 -19.71 7.58 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 112.275 -2.239 . . . . 0.0 105.147 179.514 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.8 tp -101.12 -48.77 4.3 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 114.405 -1.271 . . . . 0.0 109.405 -179.809 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -71.81 3.8 3.87 Favored 'General case' 0 N--CA 1.504 2.25 0 CA-C-O 121.121 0.486 . . . . 0.0 111.412 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.4 m -105.51 -43.17 5.02 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 103.781 -2.674 . . . . 0.0 103.781 179.536 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -61.71 -56.92 14.51 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 113.484 -1.689 . . . . 0.0 111.73 179.832 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.467 ' C ' ' H ' ' A' ' 24' ' ' THR . 17.1 p -45.06 -23.63 0.17 Allowed 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 124.686 1.194 . . . . 0.0 112.6 -179.872 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.8 mmm-85 -78.85 32.83 0.21 Allowed 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.75 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.467 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.0 t -124.58 -23.48 4.39 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 179.746 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.1 m-70 . . . . . 0 N--CA 1.491 1.605 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.169 -179.748 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo . . . . . 0 N--CA 1.494 1.545 0 N-CA-C 115.346 1.248 . . . . 0.0 115.346 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.408 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 76.9 m-85 -125.49 155.67 40.17 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 112.02 -2.355 . . . . 0.0 108.018 -179.941 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -135.45 152.37 51.3 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.226 179.415 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.44 ' HA ' HD11 ' A' ' 18' ' ' LEU . 44.5 t -91.17 128.8 37.14 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 179.624 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.3 pttm -99.59 38.89 1.37 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.375 -179.72 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.408 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 54.7 m -130.88 -42.73 1.11 Allowed 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 112.251 -2.25 . . . . 0.0 107.353 179.62 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.3 p -124.91 -30.79 3.21 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 124.06 0.85 . . . . 0.0 111.806 -179.875 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.494 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.0 mp0 88.0 62.81 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.325 0 O-C-N 125.64 1.838 . . . . 0.0 110.443 179.839 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.414 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 21.4 ttm-85 -115.68 154.19 29.96 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 102.725 -3.065 . . . . 0.0 102.725 179.696 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -114.51 155.66 26.02 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 119.153 -1.019 . . . . 0.0 112.535 -179.47 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.428 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 85.2 m-85 -136.56 -179.63 5.8 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 114.393 -1.276 . . . . 0.0 109.059 -179.733 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 76.3 p -106.37 -34.69 7.36 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 124.417 1.073 . . . . 0.0 110.122 -179.861 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.404 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 52.5 mtt85 -117.41 169.73 9.28 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 124.838 1.337 . . . . 0.0 111.413 -179.796 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.408 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 96.7 p -85.99 -37.04 19.4 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 179.913 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -64.27 -30.01 71.07 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 179.782 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.404 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 1.7 m-70 -71.48 -60.62 2.14 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 105.858 -1.904 . . . . 0.0 105.858 179.685 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.44 HD11 ' HA ' ' A' ' 5' ' ' CYS . 62.9 tp -40.61 -52.4 2.88 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 124.073 0.858 . . . . 0.0 111.175 179.608 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -55.06 -64.39 0.85 Allowed 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 118.922 -0.561 . . . . 0.0 110.306 179.626 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.0 m -39.2 -45.47 1.35 Allowed 'General case' 0 N--CA 1.504 2.246 0 O-C-N 124.231 0.957 . . . . 0.0 110.292 179.763 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.428 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 44.9 t60 -60.33 -60.99 2.94 Favored 'General case' 0 N--CA 1.489 1.502 0 CA-C-N 113.878 -1.51 . . . . 0.0 111.24 179.591 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.5 m -47.53 -23.32 0.61 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 123.751 0.657 . . . . 0.0 112.735 -179.581 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 mmm180 -53.57 -21.47 6.64 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.196 179.484 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.7 t -88.21 17.16 5.35 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-O 121.778 0.799 . . . . 0.0 110.81 -179.884 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 36.3 m-70 . . . . . 0 N--CA 1.492 1.651 0 CA-C-N 113.652 -1.613 . . . . 0.0 108.731 179.705 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo . . . . . 0 N--CA 1.492 1.385 0 CA-C-O 121.573 0.572 . . . . 0.0 112.865 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.457 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 50.1 m-85 -129.17 168.04 16.73 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 113.635 -1.621 . . . . 0.0 108.93 179.826 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.8 tp-100 -133.82 149.37 51.39 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 124.165 0.915 . . . . 0.0 111.752 -179.806 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.496 ' HA ' HD11 ' A' ' 18' ' ' LEU . 41.7 t -99.34 141.4 32.17 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 104.616 -2.364 . . . . 0.0 104.616 179.304 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.471 ' HD3' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -105.32 19.31 20.8 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 124.748 1.28 . . . . 0.0 109.183 -179.843 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.9 m -114.81 -42.86 3.19 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 114.09 -1.414 . . . . 0.0 108.214 179.919 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.534 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 22.4 p -130.9 10.28 5.02 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 119.576 -0.85 . . . . 0.0 112.355 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 47.16 59.39 4.08 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 122.747 1.26 . . . . 0.0 111.226 -179.825 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.534 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 15.4 ttt180 -117.04 157.42 25.87 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 103.934 -2.617 . . . . 0.0 103.934 179.812 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 pttp -114.91 165.39 12.9 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 118.32 -1.352 . . . . 0.0 112.149 -179.938 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.497 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 98.9 m-85 -140.84 -170.67 3.08 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 113.896 -1.502 . . . . 0.0 110.448 -179.768 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.8 p -108.36 -35.41 6.52 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 124.737 1.273 . . . . 0.0 109.495 179.923 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.419 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 5.6 mtp85 -127.12 174.61 8.77 Favored 'General case' 0 N--CA 1.504 2.227 0 CA-C-O 121.658 0.742 . . . . 0.0 110.371 179.497 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.457 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 90.3 p -82.55 -41.87 19.08 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.447 -1.251 . . . . 0.0 108.549 -179.891 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -67.86 -28.52 67.61 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 -179.992 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.419 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 53.9 m170 -69.16 -61.53 1.75 Allowed 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 104.625 -2.361 . . . . 0.0 104.625 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.496 HD11 ' HA ' ' A' ' 5' ' ' CYS . 40.0 tp -39.21 -52.63 1.94 Allowed 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 121.808 0.813 . . . . 0.0 110.179 179.318 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -49.07 -68.43 0.18 Allowed 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.151 179.584 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.4 m -39.83 -45.2 1.74 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 124.635 1.21 . . . . 0.0 110.284 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 8.2 t60 -57.06 -61.18 2.63 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.174 -1.376 . . . . 0.0 111.265 179.797 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.484 ' C ' ' H ' ' A' ' 24' ' ' THR . 12.5 m -41.54 -26.49 0.07 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.985 1.428 . . . . 0.0 111.238 -179.68 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.411 ' HA ' HH11 ' A' ' 23' ' ' ARG . 14.9 mmm180 -79.42 36.65 0.31 Allowed 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 114.849 -1.068 . . . . 0.0 110.47 179.797 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.484 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.7 t -125.77 -12.08 6.59 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 104.882 -2.266 . . . . 0.0 104.882 179.496 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 . . . . . 0 N--CA 1.487 1.389 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.801 -179.895 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo . . . . . 0 N--CA 1.485 1.015 0 N-CA-C 110.564 -0.591 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -114.92 145.14 42.52 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 105.172 -2.158 . . . . 0.0 105.172 179.669 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -127.61 151.13 49.32 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.25 0.969 . . . . 0.0 109.768 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.5 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 32.2 t -99.59 136.25 39.8 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 103.254 -2.869 . . . . 0.0 103.254 179.587 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -99.11 23.6 8.88 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.408 -0.917 . . . . 0.0 111.714 -179.422 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.502 HG21 ' CG ' ' A' ' 25' ' ' HIS . 18.7 m -119.84 -44.56 2.52 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 179.296 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.561 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 27.2 p -127.25 10.32 6.82 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 48.57 57.7 6.01 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-O 123.372 1.558 . . . . 0.0 109.71 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.561 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 55.7 ttm-85 -116.22 130.04 56.59 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 111.101 -2.772 . . . . 0.0 103.909 -179.929 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -103.68 163.09 12.55 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.062 -1.055 . . . . 0.0 113.576 -179.352 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -138.49 175.3 9.68 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 112.932 -1.94 . . . . 0.0 110.345 -179.385 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 84.9 p -101.7 -27.35 13.1 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.57 1.169 . . . . 0.0 110.719 -179.875 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 57.1 mtt85 -118.2 165.85 13.31 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 124.546 1.153 . . . . 0.0 111.007 -179.936 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 61.8 p -85.16 -38.98 18.38 Favored 'General case' 0 N--CA 1.492 1.631 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.432 -179.953 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.4 -36.42 82.26 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 179.921 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -66.37 -62.23 1.58 Allowed 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 179.708 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 39.2 tp -40.1 -55.18 2.15 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.087 0.867 . . . . 0.0 111.478 179.613 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -54.01 -62.0 1.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 124.045 0.841 . . . . 0.0 112.376 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.8 m -45.26 -43.43 10.46 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 123.893 0.746 . . . . 0.0 111.014 179.889 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.462 ' CE1' ' HD2' ' A' ' 10' ' ' ARG . 63.6 t60 -61.82 -63.62 1.2 Allowed 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.535 179.842 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -51.25 -42.47 61.07 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -179.439 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -34.12 -31.57 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 125.453 1.721 . . . . 0.0 112.992 179.454 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.5 t -78.73 -47.95 15.87 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.364 -179.72 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.502 ' CG ' HG21 ' A' ' 7' ' ' THR . 0.8 OUTLIER . . . . . 0 N--CA 1.494 1.76 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 179.866 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo . . . . . 0 N--CA 1.489 1.207 0 CA-C-O 122.174 0.822 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -122.44 154.56 37.61 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 112.258 -2.246 . . . . 0.0 105.964 179.76 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.8 tp-100 -132.14 147.9 52.45 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 123.847 0.717 . . . . 0.0 110.592 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.491 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 18.3 t -95.46 135.36 37.2 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 103.169 -2.9 . . . . 0.0 103.169 179.491 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 7.8 mptt -99.76 33.44 2.54 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 125.124 1.515 . . . . 0.0 108.539 -179.576 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.484 HG21 ' CG ' ' A' ' 25' ' ' HIS . 69.9 m -131.76 -46.48 0.96 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.393 179.946 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.2 p -125.58 5.97 7.55 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.674 -179.75 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 53.1 58.71 5.03 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-O 122.941 1.353 . . . . 0.0 111.062 179.878 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.491 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 20.6 ttt180 -111.79 148.94 32.47 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 102.613 -3.106 . . . . 0.0 102.613 179.67 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -115.58 162.53 17.09 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 119.088 -1.045 . . . . 0.0 112.22 -179.8 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -140.98 177.47 8.03 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-N 114.085 -1.416 . . . . 0.0 108.599 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 80.5 p -106.83 -30.48 8.89 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 124.29 0.994 . . . . 0.0 110.642 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.503 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 51.9 mtt85 -119.96 -178.85 3.75 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.901 -179.757 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 99.8 p -98.19 -33.57 11.07 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -64.17 -22.71 67.04 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.503 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 32.4 m170 -80.25 -42.68 22.72 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 179.731 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.86 -47.42 83.41 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 179.763 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.37 -61.25 2.43 Favored 'General case' 0 N--CA 1.503 2.214 0 CA-C-N 118.928 0.785 . . . . 0.0 110.388 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.5 m -48.11 -26.22 1.77 Allowed 'General case' 0 N--CA 1.502 2.17 0 CA-C-O 120.959 0.409 . . . . 0.0 112.088 179.73 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.479 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 71.3 t60 -84.61 -56.13 3.76 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.633 179.612 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.474 ' C ' ' H ' ' A' ' 24' ' ' THR . 19.2 p -50.26 -33.59 20.32 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.417 1.087 . . . . 0.0 113.383 -179.464 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -65.63 14.28 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.643 -1.223 . . . . 0.0 113.888 179.744 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.474 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.4 t -109.75 -10.51 14.79 Favored 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 179.554 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.484 ' CG ' HG21 ' A' ' 7' ' ' THR . 40.7 m-70 . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 104.731 -2.322 . . . . 0.0 104.731 179.857 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo . . . . . 0 N--CA 1.487 1.131 0 CA-C-O 121.952 0.73 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -124.95 154.82 40.58 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 112.678 -2.055 . . . . 0.0 106.571 179.798 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -135.87 145.04 45.94 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 124.084 0.865 . . . . 0.0 109.394 179.93 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.2 t -93.56 140.52 29.51 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 104.891 -2.262 . . . . 0.0 104.891 179.619 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -104.63 37.62 2.09 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -179.672 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.9 m -131.93 -44.31 0.96 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 113.7 -1.591 . . . . 0.0 109.059 179.992 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.497 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.0 p -118.93 -34.22 3.97 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 123.896 0.747 . . . . 0.0 109.832 -179.933 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.497 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 6.5 mp0 88.77 56.68 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.196 0 O-C-N 126.342 2.276 . . . . 0.0 108.98 179.706 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.404 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -112.65 138.54 49.29 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 102.946 -2.983 . . . . 0.0 102.946 179.747 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -102.64 164.98 11.33 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.949 -1.101 . . . . 0.0 112.15 -179.53 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -139.42 -178.08 5.22 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 113.52 -1.673 . . . . 0.0 109.293 -179.704 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.5 p -105.06 -39.53 6.19 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 124.883 1.365 . . . . 0.0 108.818 -179.909 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.502 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 55.9 mtt180 -109.7 -177.69 3.34 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 124.438 1.086 . . . . 0.0 111.369 179.965 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.5 p -97.67 -30.44 12.82 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 113.671 -1.604 . . . . 0.0 109.461 -179.879 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -88.41 19.42 3.84 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 122.162 0.982 . . . . 0.0 108.475 179.906 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.502 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.5 m170 -119.45 -24.39 6.34 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 179.529 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.5 tp -93.76 -54.3 3.68 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 114.322 -1.308 . . . . 0.0 110.154 -179.968 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -0.86 12.71 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.821 -179.846 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.0 m -104.5 -36.01 7.68 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 105.299 -2.111 . . . . 0.0 105.299 179.921 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 25.3 t60 -70.33 -53.37 16.98 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 124.041 0.838 . . . . 0.0 108.801 179.727 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 p -37.94 -46.01 0.93 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.129 0.972 . . . . 0.0 111.135 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.3 mmt-85 -43.32 -21.38 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 179.921 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.9 t -73.91 -21.54 60.02 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 123.099 0.249 . . . . 0.0 111.335 -179.548 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 56.6 m-70 . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 179.705 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_exo . . . . . 0 N--CA 1.491 1.351 0 CA-C-O 121.613 0.589 . . . . 0.0 111.906 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.458 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 56.7 m-85 -128.28 163.14 25.42 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 113.586 -1.643 . . . . 0.0 108.783 179.936 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -136.29 153.71 51.09 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 124.148 0.905 . . . . 0.0 110.489 179.775 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.464 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 34.6 t -99.54 124.74 45.01 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 179.664 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -97.88 40.48 1.17 Allowed 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 122.376 1.084 . . . . 0.0 109.101 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.464 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.3 m -124.42 -41.59 2.16 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 112.84 -1.982 . . . . 0.0 105.668 179.633 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 31.8 p -122.31 -36.86 2.89 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 124.097 0.873 . . . . 0.0 110.684 180.0 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 2.9 mp0 92.26 56.81 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.456 0 O-C-N 126.143 2.152 . . . . 0.0 111.434 179.791 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.4 ttt-85 -116.65 161.11 19.71 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 103.897 -2.631 . . . . 0.0 103.897 179.529 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -117.2 163.52 16.18 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 119.773 -0.771 . . . . 0.0 112.951 -179.898 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.605 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 72.2 m-85 -138.35 -175.61 4.17 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 112.711 -2.041 . . . . 0.0 107.935 -179.825 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.0 p -106.2 -33.04 7.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 124.142 0.901 . . . . 0.0 110.609 -179.986 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.462 ' CD ' ' CE1' ' A' ' 17' ' ' HIS . 35.5 mtp180 -120.06 171.08 8.71 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 123.793 0.683 . . . . 0.0 110.623 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.458 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 92.1 p -80.84 -29.07 35.91 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.562 -179.898 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -82.55 -28.23 31.12 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 179.78 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.462 ' CE1' ' CD ' ' A' ' 14' ' ' ARG . 42.9 m170 -68.85 -52.18 32.56 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 101.867 -3.383 . . . . 0.0 101.867 179.275 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 52.6 tp -43.04 -49.04 6.19 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.115 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.403 ' C ' ' HD2' ' A' ' 19' ' ' LYS . 0.2 OUTLIER -56.81 -58.74 6.79 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 179.415 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.7 m -40.18 -38.51 0.77 Allowed 'General case' 0 N--CA 1.503 2.213 0 CA-C-O 121.116 0.484 . . . . 0.0 110.849 179.612 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.605 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 51.3 t60 -75.16 -51.78 12.56 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 113.835 -1.53 . . . . 0.0 114.078 179.592 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.7 p -43.13 -37.26 1.97 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 118.899 0.772 . . . . 0.0 110.459 -179.769 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -43.44 -21.25 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 179.31 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 68.1 p -80.33 -18.87 47.93 Favored 'General case' 0 N--CA 1.509 2.509 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -179.733 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 47.7 m-70 . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 106.117 -1.809 . . . . 0.0 106.117 179.969 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo . . . . . 0 N--CA 1.494 1.534 0 CA-C-O 122.123 0.801 . . . . 0.0 112.911 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -123.15 166.09 15.78 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 112.611 -2.086 . . . . 0.0 107.973 -179.992 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -142.17 152.83 43.54 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 123.954 0.784 . . . . 0.0 109.759 179.558 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.462 ' HA ' HD11 ' A' ' 18' ' ' LEU . 46.2 t -93.24 136.37 33.57 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 179.574 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -104.44 35.32 2.76 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.649 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 58.7 m -127.52 -40.57 1.76 Allowed 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 113.287 -1.779 . . . . 0.0 107.763 179.861 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.4 p -122.52 -38.39 2.67 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 124.14 0.9 . . . . 0.0 110.5 -179.942 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.49 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.2 mp0 91.54 62.3 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 126.22 2.2 . . . . 0.0 110.63 179.793 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -118.73 155.84 30.39 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 102.692 -3.077 . . . . 0.0 102.692 179.624 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.6 mtpt -113.8 163.98 14.33 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 118.841 -1.144 . . . . 0.0 113.169 -179.657 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.437 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 88.7 m-85 -139.96 -178.15 5.31 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 114.348 -1.297 . . . . 0.0 108.28 -179.586 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 55.1 p -103.76 -38.95 6.85 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -179.974 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.465 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 58.8 mtt85 -115.64 178.07 4.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 124.508 1.13 . . . . 0.0 110.4 179.905 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 94.7 p -89.43 -36.61 15.35 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 113.907 -1.497 . . . . 0.0 109.363 -179.759 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -65.69 -34.1 77.43 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 179.953 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.465 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 50.1 m170 -61.5 -61.77 2.29 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 179.587 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' A' ' 5' ' ' CYS . 50.1 tp -42.43 -54.97 3.61 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 124.025 0.828 . . . . 0.0 110.999 179.688 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -50.29 -63.66 1.05 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.801 179.701 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.1 m -41.57 -45.22 3.25 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 124.162 0.913 . . . . 0.0 110.333 179.928 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.437 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 36.9 t60 -63.4 -59.64 4.42 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.366 -1.743 . . . . 0.0 113.204 179.9 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.499 ' C ' ' H ' ' A' ' 24' ' ' THR . 25.0 m -52.71 -25.81 12.17 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 123.784 0.678 . . . . 0.0 112.192 -179.325 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -79.81 38.81 0.4 Allowed 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 122.578 1.18 . . . . 0.0 110.49 179.789 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.499 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.8 t -126.28 -27.44 3.21 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 179.23 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.416 ' H ' ' H ' ' A' ' 24' ' ' THR . 79.4 m-70 . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 179.956 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.488 1.202 0 CA-C-O 122.47 0.946 . . . . 0.0 114.317 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.42 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 58.0 m-85 -134.45 154.88 51.17 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 112.027 -2.351 . . . . 0.0 105.888 179.652 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -142.61 154.92 44.84 Favored 'General case' 0 N--CA 1.501 2.101 0 C-N-CA 118.991 -1.084 . . . . 0.0 111.381 179.715 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 36.6 t -90.92 139.6 30.61 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 179.745 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -102.01 38.21 1.7 Allowed 'General case' 0 N--CA 1.5 2.075 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.478 -179.674 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 56.6 m -135.77 -45.93 0.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 113.808 -1.542 . . . . 0.0 110.302 -179.975 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 28.8 p -121.79 -20.25 6.49 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 124.124 0.89 . . . . 0.0 111.195 -179.601 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 13.3 mp0 75.57 57.73 0.06 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 125.406 1.691 . . . . 0.0 111.307 179.702 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -107.79 148.21 29.81 Favored 'General case' 0 N--CA 1.487 1.414 1 N-CA-C 100.104 -4.036 . . . . 0.0 100.104 179.394 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -112.01 157.18 21.03 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.378 -0.929 . . . . 0.0 110.907 -179.615 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -134.55 -177.51 4.64 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 113.634 -1.621 . . . . 0.0 109.512 -179.622 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 57.9 p -110.85 -34.1 6.34 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 124.631 1.207 . . . . 0.0 109.939 -179.965 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.434 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.9 mtt180 -118.02 -176.54 3.07 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.535 179.731 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.42 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 79.8 p -97.85 -25.31 15.07 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 114.278 -1.328 . . . . 0.0 107.963 -179.986 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 53.9 p30 -91.87 25.62 2.71 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.571 1.177 . . . . 0.0 108.862 179.94 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.434 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 33.1 m170 -122.14 -42.63 2.36 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 102.568 -3.123 . . . . 0.0 102.568 179.688 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -77.53 -50.78 11.89 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 113.353 -1.749 . . . . 0.0 109.705 179.877 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -72.05 5.72 2.55 Favored 'General case' 0 N--CA 1.502 2.139 0 CA-C-O 121.169 0.509 . . . . 0.0 112.136 -179.861 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 79.5 m -106.53 -43.78 4.65 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 102.896 -3.001 . . . . 0.0 102.896 179.582 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 54.4 t60 -60.35 -58.26 9.28 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.477 -1.692 . . . . 0.0 111.256 179.7 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 20.0 p -46.83 -18.87 0.08 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -179.639 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 mtp-105 -67.61 -8.6 35.82 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.239 -179.905 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.3 t -89.95 -7.24 54.54 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.992 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 CA--C 1.542 0.876 0 CA-C-O 121.685 0.619 . . . . 0.0 112.253 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.4 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 42.6 m-85 -126.93 163.39 23.77 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 113.653 -1.612 . . . . 0.0 106.907 179.671 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -133.05 149.48 52.17 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 123.711 0.632 . . . . 0.0 111.923 -179.778 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.6 t -99.59 139.85 34.65 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 179.444 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -106.46 40.99 1.51 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 122.416 1.103 . . . . 0.0 109.557 179.948 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 62.6 m -135.99 -39.02 0.7 Allowed 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 113.05 -1.886 . . . . 0.0 108.434 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.3 p -123.21 -43.09 2.22 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 119.135 -1.026 . . . . 0.0 108.871 -179.876 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.7 mm100 100.19 59.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 O-C-N 126.726 2.516 . . . . 0.0 108.94 179.831 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 ttt-85 -115.82 157.04 25.01 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 179.741 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -112.77 164.4 13.43 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.113 179.977 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.545 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 95.7 m-85 -139.2 -173.8 3.69 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.61 -2.087 . . . . 0.0 109.771 -179.893 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.1 p -106.72 -35.79 6.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 124.477 1.111 . . . . 0.0 110.187 -179.959 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.492 ' HB2' ' CG ' ' A' ' 17' ' ' HIS . 46.2 mtt85 -121.46 -179.71 4.17 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 123.808 0.692 . . . . 0.0 112.173 179.8 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.4 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 64.5 p -90.48 -40.05 12.24 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 114.47 -1.241 . . . . 0.0 107.886 -179.932 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.35 -33.21 74.76 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 104.682 -2.34 . . . . 0.0 104.682 179.786 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.492 ' CG ' ' HB2' ' A' ' 14' ' ' ARG . 49.7 m170 -66.61 -56.65 9.75 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 179.433 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.9 tp -46.02 -55.62 6.63 Favored 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.9 tttm -46.56 -59.44 3.0 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 122.049 0.14 . . . . 0.0 110.899 179.582 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.9 m -45.14 -44.65 10.84 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.616 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.545 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 61.1 t60 -67.42 -52.9 34.12 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 114.162 -1.381 . . . . 0.0 114.705 179.716 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.2 p -49.1 -39.8 29.56 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 118.908 0.776 . . . . 0.0 109.945 -179.602 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.5 mtt-85 -68.61 19.76 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 179.94 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.2 p -108.39 -6.99 15.96 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.223 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 61.3 m-70 . . . . . 0 C--N 1.302 -1.481 1 N-CA-C 100.036 -4.061 . . . . 0.0 100.036 179.203 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.491 1.334 0 CA-C-O 121.689 0.62 . . . . 0.0 113.26 . . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -128.92 157.37 41.79 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 113.283 -1.78 . . . . 0.0 107.025 179.596 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -139.95 154.61 47.24 Favored 'General case' 0 N--CA 1.5 2.075 0 C-N-CA 119.956 -0.698 . . . . 0.0 111.78 179.649 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.46 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 15.7 t -104.31 122.74 46.06 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 105.029 -2.212 . . . . 0.0 105.029 179.44 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -97.86 46.41 1.02 Allowed 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 122.999 1.38 . . . . 0.0 109.045 -179.851 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.46 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.4 m -129.3 -43.88 1.28 Allowed 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 111.77 -2.468 . . . . 0.0 105.682 179.693 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.4 p -122.49 -24.29 5.0 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.292 0.995 . . . . 0.0 112.166 -179.932 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.4 mm100 84.43 53.92 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 O-C-N 124.871 1.357 . . . . 0.0 108.66 179.866 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.473 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 17.7 ttm180 -113.97 156.38 24.15 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 104.496 -2.409 . . . . 0.0 104.496 179.968 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.512 ' HD3' ' H ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -120.75 161.54 21.27 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 119.073 -1.051 . . . . 0.0 111.488 -179.829 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.449 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 75.7 m-85 -136.68 179.29 6.46 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.316 -1.765 . . . . 0.0 110.442 -179.58 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.2 p -104.9 -30.33 9.9 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 124.907 1.38 . . . . 0.0 110.731 -179.847 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.537 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 65.6 mtt85 -124.09 177.79 5.64 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 123.992 0.808 . . . . 0.0 111.314 179.974 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 84.4 p -94.15 -35.28 12.59 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 114.288 -1.324 . . . . 0.0 108.43 179.996 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -65.44 -34.61 78.69 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 104.03 -2.581 . . . . 0.0 104.03 179.805 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.537 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 36.5 m170 -62.77 -64.0 1.05 Allowed 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.418 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.2 tp -42.59 -52.56 4.76 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 123.534 0.521 . . . . 0.0 110.927 179.515 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -50.84 -48.35 59.94 Favored 'General case' 0 N--CA 1.508 2.442 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 179.69 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 87.2 m -65.73 -37.53 86.64 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.236 179.738 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.473 ' CE1' ' HD2' ' A' ' 10' ' ' ARG . 68.9 t60 -62.95 -53.71 49.85 Favored 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.799 179.743 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.446 ' C ' ' H ' ' A' ' 24' ' ' THR . 25.1 p -61.02 -7.43 2.49 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.086 179.687 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.4 32.02 1.1 Allowed 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 105.555 -2.017 . . . . 0.0 105.555 179.858 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.446 ' H ' ' C ' ' A' ' 22' ' ' THR . 92.9 m -127.0 -27.37 3.02 Favored 'General case' 0 N--CA 1.491 1.625 0 CA-C-N 113.287 -1.779 . . . . 0.0 106.896 -179.947 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 . . . . . 0 N--CA 1.493 1.69 0 CA-C-N 114.715 -1.13 . . . . 0.0 111.79 -179.695 . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo . . . . . 0 N--CA 1.49 1.306 0 CA-C-O 122.503 0.96 . . . . 0.0 113.935 . . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -127.78 145.73 50.82 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-N 111.819 -2.446 . . . . 0.0 105.168 179.658 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -132.27 150.09 52.23 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.371 179.811 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.518 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 13.4 t -100.93 102.8 13.9 Favored 'General case' 0 C--N 1.305 -1.342 1 N-CA-C 99.989 -4.078 . . . . 0.0 99.989 179.533 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -87.88 39.58 0.9 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 -179.404 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.518 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 40.8 m -116.19 -42.34 3.06 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 104.49 -2.411 . . . . 0.0 104.49 179.713 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 28.9 p -124.68 -24.6 4.13 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 124.053 0.846 . . . . 0.0 111.172 179.89 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 3.9 mp0 86.44 59.21 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 126.548 1.939 . . . . 0.0 111.924 179.952 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -118.29 152.35 35.94 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 102.971 -2.974 . . . . 0.0 102.971 179.52 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.464 ' H ' ' HD2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -118.13 160.81 20.91 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 119.107 -1.037 . . . . 0.0 112.594 -179.681 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -139.98 175.77 9.31 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 112.818 -1.992 . . . . 0.0 107.512 -179.753 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.7 p -110.83 -19.89 12.67 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 124.219 0.949 . . . . 0.0 109.803 -179.862 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.3 mtp-105 -125.79 178.55 5.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 124.082 0.864 . . . . 0.0 109.193 179.838 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 89.1 p -94.89 -28.15 15.34 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 114.051 -1.432 . . . . 0.0 108.174 -179.978 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -84.15 14.31 4.37 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 121.78 0.8 . . . . 0.0 109.367 -179.949 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -114.96 -62.09 1.65 Allowed 'General case' 0 C--N 1.307 -1.252 1 N-CA-C 99.759 -4.163 . . . . 0.0 99.759 179.362 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.5 tp -44.24 -53.02 6.99 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.424 179.528 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -57.69 -66.78 0.41 Allowed 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 119.735 -0.786 . . . . 0.0 110.103 179.953 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.7 m -33.63 -47.9 0.25 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 124.649 1.218 . . . . 0.0 110.769 179.634 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -64.59 -58.5 6.17 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 112.909 -1.95 . . . . 0.0 113.043 179.727 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.517 ' C ' ' H ' ' A' ' 24' ' ' THR . 87.4 m -52.76 -20.35 3.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 123.782 0.676 . . . . 0.0 111.718 -179.376 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.508 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 4.8 mmp_? -82.32 38.68 0.56 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 122.422 1.106 . . . . 0.0 109.129 179.411 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.517 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.8 t -128.23 -10.03 5.28 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 104.887 -2.264 . . . . 0.0 104.887 179.36 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 57.4 m-70 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 103.698 -2.704 . . . . 0.0 103.698 179.894 . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo . . . . . 0 N--CA 1.488 1.19 0 CA-C-O 122.597 0.999 . . . . 0.0 113.301 . . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.563 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 76.0 m-85 -128.15 141.92 51.34 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 179.561 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -129.29 152.95 48.3 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 119.089 -1.044 . . . . 0.0 110.353 179.935 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 22.8 t -90.64 140.21 29.98 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 179.599 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -102.2 39.33 1.51 Allowed 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 122.049 0.928 . . . . 0.0 108.948 -179.805 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.5 m -133.27 -44.27 0.85 Allowed 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 113.419 -1.719 . . . . 0.0 110.2 179.913 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 27.0 p -118.65 -35.34 3.74 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 124.056 0.848 . . . . 0.0 110.407 -179.71 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 6.2 mp0 88.24 55.93 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.052 0 O-C-N 126.522 2.389 . . . . 0.0 109.458 179.845 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -107.74 151.22 25.98 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 100.706 -3.813 . . . . 0.0 100.706 179.466 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -116.33 159.79 21.42 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 118.743 -1.183 . . . . 0.0 110.428 -179.559 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.4 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 75.7 m-85 -133.71 -177.06 4.38 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.842 -1.526 . . . . 0.0 110.253 -179.653 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.5 p -98.35 -41.29 7.9 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.023 -179.814 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.51 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.0 mtt85 -117.56 179.41 4.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 124.395 1.06 . . . . 0.0 111.093 179.877 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.563 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 88.6 p -91.73 -36.21 13.71 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.391 -179.974 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 41.8 p-10 -68.74 -24.71 64.49 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.902 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.51 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 48.3 m170 -71.34 -58.96 3.04 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 179.665 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -48.06 -46.27 33.27 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 121.449 0.642 . . . . 0.0 109.907 179.489 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -54.85 -52.67 62.05 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.887 -0.508 . . . . 0.0 110.453 179.603 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 84.9 m -56.17 -42.09 76.53 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.698 -0.801 . . . . 0.0 108.845 179.609 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.4 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 62.4 t60 -58.12 -61.79 2.29 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.885 179.912 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.418 ' C ' ' H ' ' A' ' 24' ' ' THR . 13.3 p -42.3 -27.15 0.13 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.675 1.19 . . . . 0.0 112.052 -179.649 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -85.61 43.48 1.03 Allowed 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 123.257 1.503 . . . . 0.0 110.158 179.708 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.418 ' H ' ' C ' ' A' ' 22' ' ' THR . 12.4 t -126.47 -26.83 3.24 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 111.936 -2.393 . . . . 0.0 105.044 179.637 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 105.48 -2.045 . . . . 0.0 105.48 179.89 . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.498 1.778 0 N-CA-C 117.594 2.113 . . . . 0.0 117.594 . . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.474 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 77.6 m-85 -123.42 162.76 22.18 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.285 -2.234 . . . . 0.0 108.843 -179.795 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -142.74 156.72 45.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 123.914 0.759 . . . . 0.0 110.093 179.576 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.486 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 29.4 t -100.49 125.69 46.84 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 179.617 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.683 ' H ' ' HD2' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -97.83 40.58 1.16 Allowed 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 122.492 1.139 . . . . 0.0 108.629 -179.846 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.486 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 23.4 m -127.25 -42.48 1.69 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 112.671 -2.059 . . . . 0.0 107.662 179.836 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 31.4 p -122.61 -39.91 2.5 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 123.788 0.68 . . . . 0.0 109.833 179.986 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.507 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 1.8 mp0 99.78 58.12 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 126.722 2.514 . . . . 0.0 111.538 179.781 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.8 ttt85 -112.72 158.11 20.46 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 103.188 -2.893 . . . . 0.0 103.188 179.437 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -117.04 160.62 20.69 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 119.472 -0.891 . . . . 0.0 112.39 -179.668 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.434 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 84.3 m-85 -137.9 176.04 9.05 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 113.841 -1.527 . . . . 0.0 107.314 -179.935 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.0 p -120.59 -22.56 6.34 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 116.64 2.089 . . . . 0.0 116.64 -179.495 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.409 ' HD3' ' NE2' ' A' ' 17' ' ' HIS . 40.0 mtp180 -101.48 -54.6 2.72 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 -179.071 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 95.0 p 130.23 -40.41 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 128.551 2.74 . . . . 0.0 108.364 -179.879 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -63.27 -33.85 76.39 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 103.75 -2.685 . . . . 0.0 103.75 179.688 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.409 ' NE2' ' HD3' ' A' ' 14' ' ' ARG . 42.6 m170 -58.26 -60.88 3.08 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 104.524 -2.399 . . . . 0.0 104.524 179.348 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.1 tp -45.43 -56.61 4.82 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.086 179.577 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -49.79 -56.61 9.68 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 179.871 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.1 m -51.08 -44.95 61.29 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 122.019 0.914 . . . . 0.0 109.117 179.64 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.434 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 70.9 t60 -63.1 -47.28 83.5 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-N 113.769 -1.56 . . . . 0.0 112.656 -179.886 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 p -67.56 -11.27 57.66 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.351 -0.843 . . . . 0.0 110.993 179.773 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 50.4 mmt-85 -106.07 45.14 0.99 Allowed 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 179.353 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 89.8 m -127.79 -46.69 1.41 Allowed 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 110.299 -3.137 . . . . 0.0 102.674 179.759 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 . . . . . 0 N--CA 1.493 1.708 0 N-CA-C 104.4 -2.444 . . . . 0.0 104.4 179.562 . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo . . . . . 0 N--CA 1.499 1.805 0 N-CA-C 114.324 0.855 . . . . 0.0 114.324 . . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 79.9 m-85 -116.79 104.18 11.08 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 112.976 -1.92 . . . . 0.0 107.529 -179.934 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.414 ' HA ' ' HA ' ' A' ' 11' ' ' LYS . 8.6 tt0 -102.65 159.66 15.26 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 122.871 1.319 . . . . 0.0 113.635 -179.444 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.521 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 26.3 t -105.0 109.32 21.28 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 111.569 -2.56 . . . . 0.0 105.119 -179.989 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -94.83 48.43 1.19 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 123.386 1.565 . . . . 0.0 107.165 -179.812 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.521 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 23.8 m -123.45 -41.62 2.27 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 102.735 -3.061 . . . . 0.0 102.735 179.591 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.6 p -123.49 -35.7 2.89 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 124.187 0.929 . . . . 0.0 111.593 179.797 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 28.0 mm100 100.52 57.11 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.576 0 O-C-N 126.055 2.097 . . . . 0.0 109.011 -179.916 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.471 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 22.1 ttt180 -119.28 144.92 46.53 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 179.978 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 4' ' ' GLN . 63.8 pttt -111.86 165.87 11.7 Favored 'General case' 0 N--CA 1.502 2.158 0 C-N-CA 119.189 -1.005 . . . . 0.0 111.274 -179.777 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -139.35 176.15 8.96 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 124.22 0.95 . . . . 0.0 111.162 -179.563 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.0 p -97.34 -36.47 10.38 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 125.409 1.693 . . . . 0.0 109.785 -179.751 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.559 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 59.1 mtt85 -114.32 174.02 6.16 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 124.377 1.048 . . . . 0.0 109.871 179.858 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.49 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 97.7 p -102.15 11.36 38.43 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.726 -179.978 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.04 -32.53 6.01 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 105.497 -2.038 . . . . 0.0 105.497 179.607 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.559 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.7 m170 -67.97 -28.14 67.19 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 179.373 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.5 tp -76.69 -48.13 19.86 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 114.264 -1.334 . . . . 0.0 108.542 179.837 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -52.92 -62.92 1.34 Allowed 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.5 m -43.49 -43.26 5.3 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 124.716 1.26 . . . . 0.0 110.665 179.887 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.471 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 56.1 t60 -64.37 -56.53 13.76 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 113.712 -1.585 . . . . 0.0 114.23 179.992 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.471 ' C ' ' H ' ' A' ' 24' ' ' THR . 33.8 m -58.37 -10.91 2.33 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 112.297 0.481 . . . . 0.0 112.297 -179.446 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.424 ' HA ' HH11 ' A' ' 23' ' ' ARG . 15.9 mmm180 -90.2 38.8 0.94 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 179.537 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.471 ' H ' ' C ' ' A' ' 22' ' ' THR . 87.7 m -131.03 -13.65 3.54 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-N 111.831 -2.44 . . . . 0.0 105.538 179.72 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 104.323 -2.473 . . . . 0.0 104.323 179.744 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm . . . . . 0 N--CA 1.492 1.664 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -76.46 143.77 24.93 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 122.912 2.408 . . . . 0.0 111.069 -174.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -124.46 156.9 36.42 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 113.378 -1.737 . . . . 0.0 108.551 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -133.42 145.19 50.05 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 124.572 1.17 . . . . 0.0 108.481 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.475 ' HA ' HD11 ' A' ' 18' ' ' LEU . 41.6 t -91.29 133.12 35.68 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 104.25 -2.5 . . . . 0.0 104.25 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.402 ' HZ2' ' HB2' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -101.52 34.87 2.45 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 124.412 1.07 . . . . 0.0 108.226 -179.649 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -128.33 -40.74 1.61 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 113.744 -1.571 . . . . 0.0 109.058 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.4 p -123.37 -41.85 2.27 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.482 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 102.39 64.43 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.16 0 O-C-N 126.452 2.345 . . . . 0.0 109.951 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -120.85 152.75 38.02 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 103.578 -2.749 . . . . 0.0 103.578 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -111.91 163.23 14.46 Favored 'General case' 0 N--CA 1.503 2.176 0 C-N-CA 118.668 -1.213 . . . . 0.0 112.382 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.46 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 92.9 m-85 -142.12 176.86 8.64 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 125.079 1.487 . . . . 0.0 109.079 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.8 p -107.52 -25.76 11.23 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 124.373 1.046 . . . . 0.0 111.273 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.569 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 64.6 mtt85 -123.94 164.67 18.83 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 123.88 0.737 . . . . 0.0 110.24 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.9 p -78.59 -33.63 47.41 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -70.66 -32.82 70.24 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 106.411 -1.699 . . . . 0.0 106.411 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.569 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 29.7 m170 -66.16 -62.16 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 105.532 -2.025 . . . . 0.0 105.532 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.475 HD11 ' HA ' ' A' ' 5' ' ' CYS . 43.5 tp -40.53 -56.18 2.13 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 124.34 1.025 . . . . 0.0 110.416 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -51.16 -64.85 0.68 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.247 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.1 m -41.96 -42.53 2.83 Favored 'General case' 0 N--CA 1.504 2.258 0 CA-C-O 121.734 0.778 . . . . 0.0 111.138 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.46 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 40.5 t60 -67.99 -58.01 5.23 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 113.648 -1.615 . . . . 0.0 113.748 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.425 ' C ' ' H ' ' A' ' 24' ' ' THR . 11.9 m -52.1 -38.51 57.55 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.172 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -71.6 24.31 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 117.804 -1.558 . . . . 0.0 114.563 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.425 ' H ' ' C ' ' A' ' 22' ' ' THR . 5.2 t -113.48 -3.72 13.66 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -91.35 -48.68 6.77 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.489 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.6 m -117.08 -37.13 3.62 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 114.424 -1.262 . . . . 0.0 110.24 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 33.26 37.36 0.06 OUTLIER Glycine 0 N--CA 1.503 3.112 0 O-C-N 125.677 1.861 . . . . 0.0 114.316 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.443 ' N ' ' CD ' ' A' ' 28' ' ' GLU . 0.5 OUTLIER -18.67 -62.22 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 125.932 1.693 . . . . 0.0 114.047 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 56.3 pttt . . . . . 0 N--CA 1.494 1.774 0 CA-C-N 112.53 -2.123 . . . . 0.0 110.64 -179.824 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 95.1 mttt . . . . . 0 N--CA 1.493 1.724 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -95.33 166.79 1.51 Allowed 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 122.931 2.42 . . . . 0.0 111.598 165.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -123.49 160.99 25.75 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 112.805 -1.998 . . . . 0.0 106.355 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -137.31 153.03 50.36 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.507 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.406 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 36.0 t -97.69 133.8 41.73 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -99.19 38.55 1.39 Allowed 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.406 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 39.4 m -131.78 -42.62 1.01 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 113.858 -1.519 . . . . 0.0 109.744 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.0 p -121.4 -26.66 4.96 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 123.872 0.732 . . . . 0.0 111.139 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 85.17 51.04 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.198 0 O-C-N 125.36 1.663 . . . . 0.0 109.8 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.9 ttt-85 -110.49 156.71 20.49 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 103.189 -2.893 . . . . 0.0 103.189 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -119.13 163.56 16.85 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 119.074 -1.05 . . . . 0.0 112.389 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.441 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 86.5 m-85 -137.65 -174.95 3.91 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 113.793 -1.549 . . . . 0.0 110.054 -179.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.8 p -106.47 -41.84 5.18 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 124.419 1.075 . . . . 0.0 111.559 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.535 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 7.7 mtt180 -113.47 175.96 5.23 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 124.18 0.925 . . . . 0.0 110.114 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.7 p -87.82 -38.28 15.84 Favored 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.036 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -66.57 -29.89 70.06 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.535 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 49.4 m170 -65.07 -59.03 4.57 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.9 tp -45.25 -53.47 8.28 Favored 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -48.68 -61.21 2.15 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.1 m -43.57 -43.76 5.78 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.441 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 72.5 t60 -66.46 -53.32 36.71 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 114.884 -1.053 . . . . 0.0 113.015 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 82.8 p -44.0 -28.93 0.52 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 119.682 1.128 . . . . 0.0 110.604 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.442 ' N ' ' HD2' ' A' ' 23' ' ' ARG . 2.1 mpt_? -80.91 44.9 0.78 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 122.958 1.361 . . . . 0.0 113.715 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.419 ' H ' ' H ' ' A' ' 25' ' ' HIS . 29.8 p -131.3 -26.28 2.11 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.419 ' H ' ' H ' ' A' ' 24' ' ' THR . 63.3 m-70 -100.12 -49.07 4.41 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 103.774 -2.676 . . . . 0.0 103.774 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 56.6 p -108.21 44.97 1.05 Allowed 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -122.04 67.79 0.45 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 106.778 -2.529 . . . . 0.0 106.778 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -100.31 -54.3 2.9 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? . . . . . 0 N--CA 1.502 2.167 0 O-C-N 126.319 2.262 . . . . 0.0 115.013 179.914 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 68.0 mttm . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -63.22 159.71 38.09 Favored 'Trans proline' 0 N--CA 1.489 1.25 0 C-N-CA 122.821 2.348 . . . . 0.0 109.72 149.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.484 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 93.9 m-85 -114.76 143.59 44.83 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 101.908 -3.367 . . . . 0.0 101.908 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -128.54 154.89 45.69 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 119.837 -0.745 . . . . 0.0 111.35 -179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.447 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 8.2 t -101.02 136.44 40.86 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 103.572 -2.751 . . . . 0.0 103.572 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.9 mmmm -100.55 41.48 1.17 Allowed 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 122.163 0.982 . . . . 0.0 109.253 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.518 HG21 ' CG ' ' A' ' 25' ' ' HIS . 46.0 m -135.92 -48.38 0.67 Allowed 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.138 -1.846 . . . . 0.0 110.262 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 32.0 p -123.64 -16.81 6.62 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 124.257 0.973 . . . . 0.0 110.006 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 69.7 64.31 0.25 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 124.059 1.885 . . . . 0.0 109.764 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.447 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 28.5 ttt180 -116.1 120.06 37.82 Favored 'General case' 0 C--N 1.304 -1.386 1 N-CA-C 100.019 -4.067 . . . . 0.0 100.019 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.6 ' H ' ' HD2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -93.71 165.49 12.68 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 118.959 -1.096 . . . . 0.0 111.014 -179.662 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -136.48 174.29 10.77 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 113.628 -1.624 . . . . 0.0 109.737 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.4 p -96.85 -39.26 9.5 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 124.926 1.391 . . . . 0.0 107.896 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.469 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 5.5 mtt-85 -111.5 -179.18 3.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 124.921 1.388 . . . . 0.0 108.357 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.484 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 91.4 p -99.28 -21.92 15.84 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.871 -1.513 . . . . 0.0 107.843 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -91.39 26.85 2.12 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 122.419 1.104 . . . . 0.0 108.388 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.469 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 49.1 m170 -125.36 -40.18 2.13 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.6 tp -75.13 -52.0 12.06 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 106.387 -1.709 . . . . 0.0 106.387 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -68.34 -15.75 63.68 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.259 0.349 . . . . 0.0 110.363 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 84.8 m -95.82 -9.01 32.69 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 43.2 t60 -97.35 -55.72 2.75 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.17 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.473 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.3 p -44.02 -21.13 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.081 1.353 . . . . 0.0 113.542 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 20.7 ptt85 -77.07 27.2 0.14 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 124.089 0.868 . . . . 0.0 111.518 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.473 ' H ' ' C ' ' A' ' 22' ' ' THR . 8.9 t -117.08 -22.39 8.42 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.518 ' CG ' HG21 ' A' ' 7' ' ' THR . 66.0 m-70 -104.62 -45.97 4.47 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 113.882 -1.508 . . . . 0.0 107.525 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.3 m -112.77 46.16 1.24 Allowed 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -128.16 -49.29 0.15 Allowed Glycine 0 N--CA 1.49 2.286 0 CA-C-N 112.887 -1.961 . . . . 0.0 109.277 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -123.29 -58.36 1.63 Allowed 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 114.396 -0.902 . . . . 0.0 111.676 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp . . . . . 0 N--CA 1.501 2.083 0 CA-C-N 114.288 -1.324 . . . . 0.0 110.67 -179.891 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 29.1 tptp . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -64.55 168.79 12.38 Favored 'Trans proline' 0 C--N 1.314 -1.258 0 C-N-CA 122.201 1.934 . . . . 0.0 111.857 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.441 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 51.0 m-85 -132.0 112.29 12.26 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 112.458 -2.155 . . . . 0.0 106.386 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -108.39 157.49 18.36 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.469 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 38.0 t -97.07 112.82 24.42 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 103.753 -2.684 . . . . 0.0 103.753 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.1 29.42 0.83 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 124.472 1.108 . . . . 0.0 109.513 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.469 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.7 m -115.34 -41.9 3.23 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 113.597 -1.638 . . . . 0.0 108.518 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.9 p -119.27 -34.62 3.79 Favored 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.592 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 97.2 58.66 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.347 0 O-C-N 126.096 2.122 . . . . 0.0 109.978 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.456 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 48.3 ttt180 -118.94 146.54 44.88 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -112.91 162.51 15.74 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.588 -0.845 . . . . 0.0 112.45 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -138.94 179.61 6.39 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-N 113.219 -1.81 . . . . 0.0 109.51 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 88.6 p -102.44 -33.82 9.39 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 124.379 1.049 . . . . 0.0 108.969 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.544 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.0 mtt85 -119.41 171.66 8.17 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.587 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.441 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 94.3 p -85.16 -35.38 21.74 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.71 -39.77 94.21 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 104.209 -2.515 . . . . 0.0 104.209 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.544 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 37.7 m170 -56.39 -60.15 3.94 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.7 tp -42.82 -56.4 3.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 124.109 0.881 . . . . 0.0 109.74 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -48.57 -60.98 2.27 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.441 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.4 m -41.0 -46.09 2.76 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.712 0.768 . . . . 0.0 110.62 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.456 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 57.2 t60 -66.94 -55.36 14.94 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.668 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.2 p -45.51 -25.64 0.47 Allowed 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 48.8 mtt180 -52.87 -18.05 1.71 Allowed 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.0 t -87.02 -4.68 59.19 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -114.29 -40.97 3.55 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 30.9 m -109.78 39.84 2.03 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-N 114.519 -1.219 . . . . 0.0 110.227 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -123.53 51.33 0.81 Allowed Glycine 0 N--CA 1.498 2.795 0 N-CA-C 108.184 -1.967 . . . . 0.0 108.184 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -114.81 177.28 4.71 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 115.01 -0.595 . . . . 0.0 109.908 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 122.638 1.209 . . . . 0.0 110.001 -179.947 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.3 pttm . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 119.865 -0.112 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -69.22 150.04 71.04 Favored 'Trans proline' 0 N--CA 1.491 1.36 0 C-N-CA 123.17 2.58 . . . . 0.0 111.327 167.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.467 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 88.6 m-85 -122.46 152.61 40.1 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 105.176 -2.157 . . . . 0.0 105.176 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -140.2 154.17 46.83 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.496 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.517 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 40.2 t -98.44 117.23 32.38 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -92.26 37.56 0.99 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.517 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 57.2 m -123.39 -43.9 2.16 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 113.339 -1.755 . . . . 0.0 107.31 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 p -118.33 -36.86 3.45 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 123.921 0.763 . . . . 0.0 111.019 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 99.41 55.77 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 126.269 2.23 . . . . 0.0 109.079 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.0 157.42 18.69 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 103.225 -2.88 . . . . 0.0 103.225 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -120.34 158.47 27.05 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.812 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -138.31 171.53 14.25 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.888 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.4 p -96.67 -36.73 10.6 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.108 -1.86 . . . . 0.0 108.273 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.565 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 60.5 mtt85 -116.1 175.99 5.3 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 124.708 1.255 . . . . 0.0 110.96 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.467 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 90.1 p -95.38 -34.25 12.19 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 113.474 -1.694 . . . . 0.0 106.542 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.78 -38.28 90.44 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 104.659 -2.349 . . . . 0.0 104.659 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.565 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 31.5 m170 -59.94 -58.62 7.77 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.6 tp -44.6 -55.52 5.12 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.747 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -51.05 -58.8 5.16 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.193 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.9 m -43.86 -46.17 7.8 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 121.822 0.82 . . . . 0.0 110.159 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -64.32 -56.55 13.7 Favored 'General case' 0 N--CA 1.488 1.438 0 CA-C-N 113.182 -1.827 . . . . 0.0 114.046 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.419 ' C ' ' H ' ' A' ' 24' ' ' THR . 37.9 p -44.07 -30.68 0.78 Allowed 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.253 0.621 . . . . 0.0 110.414 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.04 39.43 0.37 Allowed 'General case' 0 N--CA 1.487 1.42 0 CA-C-N 114.112 -1.404 . . . . 0.0 111.319 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.419 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.5 t -124.37 -27.17 3.81 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 104.687 -2.338 . . . . 0.0 104.687 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.403 ' H ' ' H ' ' A' ' 24' ' ' THR . 70.9 m-70 -97.85 -47.53 5.53 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 103.363 -2.828 . . . . 0.0 103.363 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.5 m -111.36 59.2 0.62 Allowed 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -109.92 73.6 0.21 Allowed Glycine 0 N--CA 1.494 2.546 0 N-CA-C 106.594 -2.602 . . . . 0.0 106.594 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -1.1 130.59 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 128.064 2.545 . . . . 0.0 117.554 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.9 mmtm . . . . . 0 N--CA 1.497 1.917 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.309 -179.633 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 120.841 0.353 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -65.01 172.95 6.51 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 123.21 2.607 . . . . 0.0 110.325 148.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.535 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 81.1 m-85 -127.72 159.45 34.72 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 114.011 -1.449 . . . . 0.0 109.228 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -134.82 151.64 51.1 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 119.545 -0.862 . . . . 0.0 113.282 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 40.8 t -94.73 133.1 38.77 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 113.337 -1.756 . . . . 0.0 106.448 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -100.05 40.36 1.25 Allowed 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.422 HG21 ' CG ' ' A' ' 25' ' ' HIS . 53.3 m -134.84 -47.12 0.73 Allowed 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 113.026 -1.897 . . . . 0.0 108.453 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.447 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 29.9 p -125.33 4.15 7.75 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 123.891 0.744 . . . . 0.0 111.461 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 53.54 52.78 12.65 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 122.752 1.263 . . . . 0.0 110.328 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.447 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 19.4 ttt180 -105.34 154.39 20.35 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 102.666 -3.087 . . . . 0.0 102.666 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -116.93 158.87 23.34 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.903 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -135.91 -176.07 4.18 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 123.723 0.64 . . . . 0.0 110.075 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.5 p -103.09 -41.13 6.19 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 124.67 1.231 . . . . 0.0 110.255 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.498 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 28.7 mtt180 -114.89 163.83 14.99 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 124.169 0.918 . . . . 0.0 109.942 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.535 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 88.4 p -78.5 -33.65 47.98 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -69.49 -35.03 75.17 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 105.64 -1.985 . . . . 0.0 105.64 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.498 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 33.7 m170 -63.06 -59.01 5.37 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.7 tp -42.88 -53.94 4.43 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.857 0.723 . . . . 0.0 109.667 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -53.79 -57.64 10.15 Favored 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 119.875 -0.73 . . . . 0.0 111.468 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.0 m -41.34 -46.46 3.3 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 121.795 0.807 . . . . 0.0 110.142 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.1 t60 -65.49 -56.7 10.93 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 112.974 -1.921 . . . . 0.0 113.507 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.427 ' C ' ' H ' ' A' ' 24' ' ' THR . 45.4 p -52.26 -29.22 21.94 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.8 ttp180 -82.81 42.19 0.77 Allowed 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 123.032 1.396 . . . . 0.0 110.579 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.427 ' H ' ' C ' ' A' ' 22' ' ' THR . 5.9 t -131.52 -22.36 2.45 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 105.556 -2.016 . . . . 0.0 105.556 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.426 ' H ' ' H ' ' A' ' 24' ' ' THR . 78.3 m-70 -99.23 -48.19 4.92 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 104.832 -2.284 . . . . 0.0 104.832 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 40.7 p -114.45 56.04 0.73 Allowed 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 113.964 -1.471 . . . . 0.0 107.229 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -119.53 -49.07 0.32 Allowed Glycine 0 N--CA 1.496 2.635 0 N-CA-C 108.374 -1.89 . . . . 0.0 108.374 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -91.36 -13.6 32.21 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.071 -1.064 . . . . 0.0 110.17 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.4 tttt . . . . . 0 N--CA 1.495 1.82 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 179.884 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.8 OUTLIER -34.35 154.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 124.432 3.422 . . . . 0.0 114.95 172.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.435 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 85.8 m-85 -121.34 157.8 29.62 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 113.384 -1.735 . . . . 0.0 109.64 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -130.73 145.12 51.86 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 124.297 0.998 . . . . 0.0 108.795 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.407 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 40.4 t -92.97 138.89 31.08 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -105.24 36.1 2.6 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.8 m -131.57 -38.18 1.17 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 114.476 -1.238 . . . . 0.0 109.3 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.3 p -125.25 -39.04 2.24 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.538 -0.865 . . . . 0.0 109.406 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 98.33 60.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 126.587 2.429 . . . . 0.0 109.81 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.407 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 39.2 ttt-85 -112.51 159.43 18.79 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 103.503 -2.777 . . . . 0.0 103.503 179.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -115.91 158.18 23.39 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.167 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.482 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 93.9 m-85 -139.59 179.65 6.44 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 124.157 0.911 . . . . 0.0 110.051 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.9 p -107.33 -39.75 5.58 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 124.735 1.272 . . . . 0.0 110.313 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.38 171.11 7.71 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.435 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 65.4 p -84.73 -40.16 17.64 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -62.75 -29.71 70.89 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -66.34 -60.84 2.39 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.8 tp -43.6 -47.25 7.46 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 123.752 0.658 . . . . 0.0 111.365 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -58.05 -67.24 0.36 Allowed 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 119.685 -0.806 . . . . 0.0 109.624 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.2 m -35.39 -48.02 0.46 Allowed 'General case' 0 N--CA 1.504 2.231 0 O-C-N 124.641 1.213 . . . . 0.0 110.325 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.482 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 30.1 t60 -57.42 -61.17 2.68 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.654 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.473 ' C ' ' H ' ' A' ' 24' ' ' THR . 56.9 m -52.9 -12.74 0.35 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 124.255 0.972 . . . . 0.0 111.913 -179.648 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -90.46 40.29 1.01 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 123.373 1.559 . . . . 0.0 107.035 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.473 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.3 t -126.09 -26.11 3.45 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 103.585 -2.746 . . . . 0.0 103.585 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -96.2 -55.47 2.94 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 105.287 -2.116 . . . . 0.0 105.287 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 30.3 p -124.52 57.69 1.24 Allowed 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 113.831 -1.531 . . . . 0.0 110.684 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -122.7 -28.56 1.4 Allowed Glycine 0 N--CA 1.497 2.72 0 N-CA-C 108.434 -1.866 . . . . 0.0 108.434 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.481 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.4 mp0 -103.32 47.82 0.87 Allowed 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? . . . . . 0 N--CA 1.493 1.724 0 CA-C-N 113.869 -1.514 . . . . 0.0 108.74 -179.831 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -73.42 161.44 42.52 Favored 'Trans proline' 0 N--CA 1.493 1.476 0 C-N-CA 122.641 2.227 . . . . 0.0 113.148 -173.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 88.8 m-85 -131.31 162.24 30.52 Favored 'General case' 0 N--CA 1.499 2.0 0 CA-C-N 113.013 -1.903 . . . . 0.0 108.937 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -139.99 152.45 46.3 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.975 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.432 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 35.7 t -99.56 129.71 45.74 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 105.955 -1.868 . . . . 0.0 105.955 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -99.18 34.31 2.18 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 122.011 0.91 . . . . 0.0 109.445 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.432 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 53.5 m -123.17 -39.7 2.46 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.42 -1.718 . . . . 0.0 107.871 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -124.02 -40.78 2.26 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.292 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 104.41 51.74 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.72 0 O-C-N 126.299 2.249 . . . . 0.0 110.799 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 40.9 ttt85 -110.94 148.87 31.57 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 104.592 -2.373 . . . . 0.0 104.592 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -112.6 165.16 12.51 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.159 -1.016 . . . . 0.0 110.095 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -138.26 178.5 7.09 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.683 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 38.7 p -101.9 -40.25 6.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 125.175 1.547 . . . . 0.0 109.514 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.19 175.37 5.5 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.304 1.003 . . . . 0.0 109.55 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.442 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 74.8 p -89.84 -34.77 16.0 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.298 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.1 p-10 -65.05 -30.75 71.74 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -62.6 -61.54 2.35 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 106.063 -1.829 . . . . 0.0 106.063 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.2 tp -44.75 -50.99 9.78 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 124.115 0.884 . . . . 0.0 109.655 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -53.47 -60.27 3.52 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.802 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -47.55 -42.33 23.3 Favored 'General case' 0 N--CA 1.5 2.07 0 CA-C-O 121.646 0.736 . . . . 0.0 110.626 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -65.41 -57.65 7.81 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 113.781 -1.554 . . . . 0.0 114.233 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.9 p -45.03 -39.2 5.45 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.602 0.761 . . . . 0.0 111.651 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -82.85 39.02 0.6 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 116.939 -1.905 . . . . 0.0 112.98 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.0 t -121.23 -5.92 9.41 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -96.1 -23.47 16.75 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -115.82 -40.52 3.33 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 124.445 1.091 . . . . 0.0 108.374 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -116.54 49.37 0.86 Allowed Glycine 0 N--CA 1.496 2.693 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.716 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -23.91 114.85 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.175 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt . . . . . 0 N--CA 1.508 2.44 0 N-CA-C 116.543 2.053 . . . . 0.0 116.543 -179.952 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.497 ' HB2' ' HD2' ' A' ' 2' ' ' PRO . 18.6 ptpt . . . . . 0 N--CA 1.496 1.864 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.497 ' HD2' ' HB2' ' A' ' 1' ' ' LYS . 18.4 Cg_endo -88.12 129.28 2.38 Favored 'Trans proline' 0 C--N 1.32 -0.971 0 C-N-CA 121.926 1.751 . . . . 0.0 112.145 -173.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.528 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 96.6 m-85 -120.72 160.27 23.66 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -147.22 160.61 42.27 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 117.773 -1.571 . . . . 0.0 111.959 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.411 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 43.2 t -93.68 142.41 27.38 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.8 ttpp -107.07 32.76 4.37 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 125.123 1.515 . . . . 0.0 107.606 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.411 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 57.9 m -127.57 -38.31 1.92 Allowed 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 114.514 -1.221 . . . . 0.0 109.378 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.6 p -122.42 -41.03 2.42 Favored 'General case' 0 N--CA 1.499 2.014 0 C-N-CA 119.861 -0.736 . . . . 0.0 111.193 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 101.58 52.36 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 O-C-N 126.53 2.394 . . . . 0.0 109.975 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.22 148.0 33.78 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 103.48 -2.785 . . . . 0.0 103.48 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -112.74 160.68 17.7 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 118.347 -1.341 . . . . 0.0 111.619 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.418 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 83.2 m-85 -131.34 178.89 6.37 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-N 112.615 -2.084 . . . . 0.0 111.131 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 p -103.24 -31.55 10.04 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 125.383 1.677 . . . . 0.0 112.171 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.9 mtp180 -116.5 179.12 4.09 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 124.637 1.211 . . . . 0.0 107.876 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.528 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 89.6 p -108.7 20.74 18.15 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.973 0.892 . . . . 0.0 110.695 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.93 -35.06 3.57 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 55.7 m170 -59.8 -54.25 48.4 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 103.483 -2.784 . . . . 0.0 103.483 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.407 HD11 ' HA ' ' A' ' 5' ' ' CYS . 63.9 tp -36.83 -55.12 0.91 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 113.267 -1.788 . . . . 0.0 111.561 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.9 tptt -60.28 -59.18 5.83 Favored 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 m -42.68 -31.19 0.44 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 124.511 1.132 . . . . 0.0 111.376 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.418 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 16.2 t60 -82.28 -56.75 3.72 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 113.415 -1.721 . . . . 0.0 112.633 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.433 ' C ' ' H ' ' A' ' 24' ' ' THR . 14.6 m -43.86 -31.53 0.87 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 124.132 0.895 . . . . 0.0 111.522 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.42 43.13 0.53 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 118.5 -1.28 . . . . 0.0 112.453 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.433 ' H ' ' C ' ' A' ' 22' ' ' THR . 8.7 t -120.77 -24.92 5.56 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 103.053 -2.943 . . . . 0.0 103.053 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.407 ' H ' ' H ' ' A' ' 24' ' ' THR . 68.9 m-70 -90.11 -43.94 10.13 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 103.888 -2.634 . . . . 0.0 103.888 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.8 m -118.43 54.78 0.92 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 104.522 -2.399 . . . . 0.0 104.522 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -6.72 -63.33 0.01 OUTLIER Glycine 0 N--CA 1.502 3.071 0 CA-C-N 112.822 -1.99 . . . . 0.0 116.183 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -99.56 83.12 2.74 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm . . . . . 0 N--CA 1.506 2.338 0 O-C-N 126.396 2.31 . . . . 0.0 108.686 179.782 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt . . . . . 0 N--CA 1.493 1.716 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -94.48 160.57 1.95 Allowed 'Trans proline' 0 C--N 1.314 -1.262 0 C-N-CA 123.047 2.498 . . . . 0.0 111.954 171.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -120.26 157.11 29.84 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 105.564 -2.013 . . . . 0.0 105.564 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -135.8 148.09 48.59 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 120.122 -0.631 . . . . 0.0 112.35 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.469 ' HA ' HD11 ' A' ' 18' ' ' LEU . 16.7 t -99.15 133.67 43.11 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 101.936 -3.357 . . . . 0.0 101.936 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.532 ' HD3' ' N ' ' A' ' 6' ' ' LYS . 3.3 mppt? -105.9 35.27 2.96 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.247 0.967 . . . . 0.0 109.063 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.8 m -123.67 -40.86 2.29 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 113.158 -1.837 . . . . 0.0 106.699 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.423 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 24.8 p -130.2 -10.18 4.22 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 123.889 0.743 . . . . 0.0 111.196 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.6 mp0 67.65 60.87 0.45 Allowed 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 123.066 1.412 . . . . 0.0 111.018 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.423 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 21.0 ttt180 -116.13 145.1 43.33 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 102.04 -3.318 . . . . 0.0 102.04 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -107.77 162.33 14.09 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.865 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -140.74 -179.9 6.32 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.565 1.165 . . . . 0.0 110.158 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 64.6 p -102.75 -36.78 8.16 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.13 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.44 -176.9 3.32 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 124.307 1.004 . . . . 0.0 111.366 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 95.6 p -98.53 -37.01 9.73 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.488 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -61.02 -29.46 69.73 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -66.31 -67.89 0.41 Allowed 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.469 HD11 ' HA ' ' A' ' 5' ' ' CYS . 62.1 tp -38.62 -48.28 1.43 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 123.871 0.732 . . . . 0.0 112.373 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -53.82 -67.83 0.23 Allowed 'General case' 0 N--CA 1.499 2.0 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.882 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.2 m -46.71 -36.33 7.04 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 114.183 -1.372 . . . . 0.0 110.624 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 39.8 t60 -66.91 -60.2 2.85 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-N 114.77 -1.105 . . . . 0.0 112.03 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.5 m -50.7 -25.14 3.94 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 121.203 0.525 . . . . 0.0 112.407 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.446 ' HB3' ' NH2' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -58.69 -8.2 1.22 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.446 179.374 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 t -91.46 -3.83 56.2 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.069 0.462 . . . . 0.0 110.205 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 -110.66 -47.22 3.28 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 114.595 -1.184 . . . . 0.0 107.807 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.3 t -108.59 -25.82 10.7 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 116.465 2.024 . . . . 0.0 116.465 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -102.03 59.21 0.59 Allowed Glycine 0 N--CA 1.498 2.828 0 C-N-CA 120.342 -0.932 . . . . 0.0 114.777 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -118.59 51.05 1.12 Allowed 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm . . . . . 0 N--CA 1.494 1.734 0 CA-C-N 113.542 -1.663 . . . . 0.0 109.808 -179.828 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -63.53 174.29 3.68 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 123.672 2.915 . . . . 0.0 113.756 -175.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -121.92 163.43 19.28 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 112.608 -2.087 . . . . 0.0 106.974 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -136.62 146.96 46.63 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.908 0.755 . . . . 0.0 110.952 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.412 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 12.6 t -104.03 130.91 51.72 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 101.342 -3.577 . . . . 0.0 101.342 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -106.47 42.97 1.19 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 122.316 1.055 . . . . 0.0 108.817 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.412 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 94.7 m -126.71 -40.58 1.9 Allowed 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 p -121.4 -32.19 3.91 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 123.987 0.805 . . . . 0.0 108.845 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 89.35 55.83 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 126.25 2.219 . . . . 0.0 109.448 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 44.4 ttt-85 -115.36 154.66 28.79 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HD3' ' H ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -114.5 167.65 10.55 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 118.852 -1.139 . . . . 0.0 110.349 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.424 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 88.6 m-85 -139.93 -179.76 6.14 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 114.297 -1.319 . . . . 0.0 109.159 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.8 p -104.06 -44.89 4.88 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 124.475 1.11 . . . . 0.0 110.094 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.587 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 23.7 mtt180 -109.96 -176.33 2.97 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.437 1.085 . . . . 0.0 109.428 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.6 p -95.19 -29.93 14.28 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.008 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -76.65 -4.31 42.4 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.587 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 46.1 m170 -97.16 -10.3 26.19 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 124.973 1.421 . . . . 0.0 107.903 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.7 tp -106.46 -54.22 2.51 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.359 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -66.13 -2.08 3.84 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.5 m -105.55 -39.96 5.93 Favored 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 104.254 -2.498 . . . . 0.0 104.254 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.424 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 50.1 t60 -58.54 -57.16 14.19 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.455 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.435 ' C ' ' H ' ' A' ' 24' ' ' THR . 7.7 p -37.26 -40.86 0.36 Allowed 'General case' 0 C--N 1.308 -1.218 0 O-C-N 125.282 1.614 . . . . 0.0 111.55 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.515 ' HA ' ' H ' ' A' ' 27' ' ' GLY . 36.7 mtt180 -76.93 37.97 0.2 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 125.117 1.511 . . . . 0.0 113.066 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.435 ' H ' ' C ' ' A' ' 22' ' ' THR . 11.2 t -115.96 -24.59 8.04 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 103.585 -2.746 . . . . 0.0 103.585 179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -95.74 -34.56 11.87 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 100.705 -3.813 . . . . 0.0 100.705 179.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.484 ' O ' ' N ' ' A' ' 28' ' ' GLU . 92.3 m 114.48 46.39 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 129.977 3.311 . . . . 0.0 106.771 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.515 ' H ' ' HA ' ' A' ' 23' ' ' ARG . . . 16.13 44.79 0.01 OUTLIER Glycine 0 N--CA 1.502 3.099 0 CA-C-N 110.804 -2.907 . . . . 0.0 114.399 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.579 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -73.5 158.59 34.62 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 112.101 -2.049 . . . . 0.0 111.906 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm . . . . . 0 N--CA 1.495 1.808 0 CA-C-N 113.765 -1.561 . . . . 0.0 109.508 -179.925 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.456 0.169 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -57.56 165.66 5.78 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 123.661 2.907 . . . . 0.0 112.984 157.007 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.427 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 64.6 m-85 -124.32 163.47 21.63 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-N 113.087 -1.87 . . . . 0.0 108.066 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.7 tp-100 -139.7 137.52 35.24 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.884 0.74 . . . . 0.0 109.486 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.462 ' HA ' HD11 ' A' ' 18' ' ' LEU . 44.0 t -84.4 144.21 28.94 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 179.501 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -105.87 32.57 4.27 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 124.743 1.277 . . . . 0.0 108.997 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 97.2 m -135.08 -39.51 0.76 Allowed 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 114.317 -1.31 . . . . 0.0 111.188 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.7 p -119.95 -45.71 2.46 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 119.465 -0.894 . . . . 0.0 109.475 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 103.48 61.51 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 126.942 2.651 . . . . 0.0 110.474 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.6 ttt85 -115.29 158.84 21.79 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 103.273 -2.862 . . . . 0.0 103.273 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.695 ' HB2' ' HZ3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -113.72 163.74 14.62 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 119.231 -0.988 . . . . 0.0 109.759 -179.767 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.488 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 99.2 m-85 -139.98 -179.41 5.94 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 124.553 1.158 . . . . 0.0 110.696 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.3 p -104.43 -37.18 7.29 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 113.637 -1.619 . . . . 0.0 110.57 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.18 -172.32 2.2 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 124.175 0.922 . . . . 0.0 110.567 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 80.2 p -97.4 -33.48 11.39 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -86.54 10.35 15.65 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.465 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -115.87 -18.18 10.81 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' A' ' 5' ' ' CYS . 36.2 tp -93.46 -57.51 2.57 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.374 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.421 ' NZ ' ' HB2' ' A' ' 19' ' ' LYS . 3.7 ttmp? -53.1 -64.19 0.9 Allowed 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.2 m -38.93 -43.65 0.98 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.257 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.488 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 22.0 t60 -69.68 -58.5 3.85 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 113.7 -1.591 . . . . 0.0 112.336 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.405 ' N ' ' CD2' ' A' ' 21' ' ' HIS . 21.8 m -45.78 -40.38 9.54 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 121.753 0.787 . . . . 0.0 110.356 -179.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.6 ttp85 -85.11 52.28 2.4 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-O 123.867 1.794 . . . . 0.0 111.865 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.9 t -137.01 -19.78 1.28 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 111.363 -2.653 . . . . 0.0 105.397 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 -71.33 -39.21 71.5 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.8 m -106.4 -49.23 3.39 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 105.572 -2.01 . . . . 0.0 105.572 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.71 -58.73 0.62 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 108.957 -1.657 . . . . 0.0 108.957 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -115.12 129.07 56.58 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 113.472 -1.364 . . . . 0.0 109.127 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.9 mttm . . . . . 0 N--CA 1.496 1.837 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.151 -179.976 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -52.15 139.72 52.36 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 123.192 2.595 . . . . 0.0 116.227 -157.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 79.0 m-85 -128.66 158.89 37.28 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 112.688 -2.051 . . . . 0.0 107.492 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -142.76 155.81 44.9 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.73 0.776 . . . . 0.0 110.857 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.508 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 15.1 t -104.31 107.89 19.02 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 179.385 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.13 33.58 0.68 Allowed 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 122.514 1.15 . . . . 0.0 110.132 -179.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.508 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 35.0 m -112.71 -41.67 3.77 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 112.688 -2.051 . . . . 0.0 106.507 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 32.1 p -121.48 -29.34 4.44 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 124.041 0.838 . . . . 0.0 109.66 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 3.2 mp0 90.03 60.27 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 O-C-N 125.851 1.97 . . . . 0.0 110.831 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.4 ttt180 -121.05 151.68 39.52 Favored 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 104.627 -2.361 . . . . 0.0 104.627 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -116.28 161.14 19.45 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.417 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 90.3 m-85 -138.22 176.54 8.61 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 113.078 -1.874 . . . . 0.0 109.283 -179.62 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.7 p -102.71 -32.71 9.71 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 124.302 1.001 . . . . 0.0 110.573 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.4 ' CD ' ' CE1' ' A' ' 17' ' ' HIS . 32.7 mtp85 -116.54 176.3 5.17 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 124.484 1.115 . . . . 0.0 110.085 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 81.7 p -90.25 -36.58 14.65 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -66.16 -40.27 90.4 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 104.194 -2.521 . . . . 0.0 104.194 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.4 ' CE1' ' CD ' ' A' ' 14' ' ' ARG . 39.3 m170 -54.94 -58.92 5.66 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.2 tp -45.47 -52.82 9.7 Favored 'General case' 0 N--CA 1.502 2.132 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -52.54 -55.45 22.07 Favored 'General case' 0 N--CA 1.503 2.189 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.53 ' HA ' ' CZ ' ' A' ' 23' ' ' ARG . 52.9 m -42.94 -46.63 5.47 Favored 'General case' 0 N--CA 1.505 2.313 0 CA-C-O 121.612 0.72 . . . . 0.0 109.775 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.417 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 61.2 t60 -64.72 -56.81 11.37 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 113.359 -1.746 . . . . 0.0 114.588 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 48.7 p -43.77 -34.63 1.6 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.53 ' CZ ' ' HA ' ' A' ' 20' ' ' THR . 66.9 mtt85 -42.85 -23.62 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 179.511 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.2 t -95.29 19.6 10.48 Favored 'General case' 0 N--CA 1.512 2.631 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 31.2 m-70 -124.17 -43.17 2.09 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 104.226 -2.509 . . . . 0.0 104.226 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 64.5 m -72.14 -48.34 44.31 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 104.286 -2.487 . . . . 0.0 104.286 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -108.18 47.38 1.05 Allowed Glycine 0 N--CA 1.488 2.102 1 N-CA-C 101.405 -4.678 . . . . 0.0 101.405 179.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -13.98 -94.47 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 111.088 -2.556 . . . . 0.0 117.325 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.5 pttt . . . . . 0 N--CA 1.493 1.682 0 O-C-N 124.852 1.345 . . . . 0.0 110.804 -179.752 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.4 ptmm? . . . . . 0 N--CA 1.492 1.642 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -73.01 167.17 28.08 Favored 'Trans proline' 0 N--CA 1.49 1.301 0 C-N-CA 122.783 2.322 . . . . 0.0 110.32 167.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.471 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 57.4 m-85 -123.67 161.25 25.47 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 113.577 -1.647 . . . . 0.0 107.631 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -130.43 149.27 52.18 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 124.188 0.93 . . . . 0.0 111.149 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.457 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 42.1 t -99.16 125.83 44.8 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 103.814 -2.661 . . . . 0.0 103.814 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -97.18 40.47 1.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 122.476 1.131 . . . . 0.0 108.644 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.457 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.7 m -131.6 -46.98 0.97 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 112.534 -2.121 . . . . 0.0 107.045 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 p -129.52 7.18 5.28 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 123.94 0.775 . . . . 0.0 112.731 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 51.36 57.51 6.53 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-O 122.735 1.255 . . . . 0.0 111.765 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.413 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 21.5 ttt180 -118.08 140.94 49.03 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 103.123 -2.918 . . . . 0.0 103.123 179.694 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -105.52 165.97 10.77 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -179.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -140.76 -171.46 3.24 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 113.428 -1.715 . . . . 0.0 110.446 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.6 p -106.38 -39.17 5.98 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 124.438 1.086 . . . . 0.0 110.571 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.403 ' HB2' ' CG ' ' A' ' 17' ' ' HIS . 3.7 mtp-105 -119.09 179.94 4.01 Favored 'General case' 0 N--CA 1.5 2.071 0 CA-C-O 121.78 0.8 . . . . 0.0 109.77 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.471 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 80.3 p -94.08 -33.09 13.51 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -76.49 -3.39 37.06 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.403 ' CG ' ' HB2' ' A' ' 14' ' ' ARG . 41.3 m170 -95.9 -56.03 2.8 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 101.575 -3.491 . . . . 0.0 101.575 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.411 HD11 ' HA ' ' A' ' 5' ' ' CYS . 69.1 tp -46.47 -50.48 16.87 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -52.06 -64.72 0.72 Allowed 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.5 m -40.22 -43.61 1.72 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.329 0.585 . . . . 0.0 110.68 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 41.0 t60 -64.64 -59.36 4.37 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 114.103 -1.408 . . . . 0.0 112.33 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.8 p -45.35 -34.57 3.08 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -43.07 -25.01 0.09 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.1 t -92.38 9.57 33.61 Favored 'General case' 0 N--CA 1.511 2.586 0 N-CA-C 116.165 1.913 . . . . 0.0 116.165 -179.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.418 ' CG ' HG21 ' A' ' 7' ' ' THR . 27.5 m-70 -107.1 -38.78 5.91 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 104.55 -2.389 . . . . 0.0 104.55 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 25.5 p -83.5 -54.58 4.85 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 113.319 -1.764 . . . . 0.0 108.934 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.1 -46.69 1.35 Allowed Glycine 0 N--CA 1.491 2.355 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.973 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -105.82 -41.49 5.41 Favored 'General case' 0 N--CA 1.496 1.863 0 CA-C-N 114.076 -1.062 . . . . 0.0 111.92 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt . . . . . 0 N--CA 1.499 1.993 0 O-C-N 124.457 1.098 . . . . 0.0 109.933 -179.838 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 120.991 0.424 . . . . 0.0 110.94 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -61.64 145.25 97.73 Favored 'Trans proline' 0 N--CA 1.491 1.357 0 C-N-CA 122.326 2.017 . . . . 0.0 109.481 170.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.5 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 81.7 m-85 -120.56 155.17 34.24 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -141.0 154.96 46.27 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.19 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.7 t -92.55 140.81 29.18 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 114.149 -1.387 . . . . 0.0 107.806 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.615 ' HD3' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -100.38 29.1 4.55 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 114.759 -1.109 . . . . 0.0 109.851 -179.727 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.513 HG21 ' CG ' ' A' ' 25' ' ' HIS . 56.0 m -129.6 -43.0 1.27 Allowed 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 114.097 -1.41 . . . . 0.0 110.764 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.1 p -125.25 -0.83 7.68 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 119.568 -0.853 . . . . 0.0 110.027 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 54.35 60.37 3.61 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 122.948 1.356 . . . . 0.0 110.556 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -112.44 149.97 31.83 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 103.302 -2.851 . . . . 0.0 103.302 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -110.99 160.22 17.01 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 119.085 -1.046 . . . . 0.0 112.025 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -137.58 175.41 9.63 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 114.495 -1.229 . . . . 0.0 109.528 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.2 p -98.58 -40.81 8.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 124.708 1.255 . . . . 0.0 110.41 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.47 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 42.6 mtt180 -113.77 167.24 10.79 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 124.258 0.974 . . . . 0.0 110.09 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.5 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 84.3 p -81.64 -36.15 29.2 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -64.92 -30.72 71.73 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.47 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.7 m170 -66.97 -60.38 2.68 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 tp -43.29 -52.52 5.71 Favored 'General case' 0 N--CA 1.503 2.191 0 CA-C-O 121.303 0.573 . . . . 0.0 110.603 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -49.45 -65.4 0.57 Allowed 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.832 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 85.8 m -43.82 -44.74 7.0 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.853 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -58.71 -60.29 4.06 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.4 m -45.35 -21.9 0.11 Allowed 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 114.861 -1.063 . . . . 0.0 113.734 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.1 ptt-85 -50.12 -24.6 2.84 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.3 t -82.24 7.17 14.47 Favored 'General case' 0 N--CA 1.505 2.28 0 CA-C-O 121.45 0.643 . . . . 0.0 112.183 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.513 ' CG ' HG21 ' A' ' 7' ' ' THR . 59.8 m-70 -124.26 -50.9 1.77 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.198 -1.365 . . . . 0.0 109.958 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.4 m -101.86 -29.54 11.79 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-N 112.696 -2.047 . . . . 0.0 114.065 -179.145 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -99.84 34.71 5.27 Favored Glycine 0 N--CA 1.5 2.945 0 C-N-CA 119.996 -1.097 . . . . 0.0 112.209 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -132.72 -59.1 0.91 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.3 pttm . . . . . 0 N--CA 1.497 1.884 0 CA-C-N 112.984 -1.916 . . . . 0.0 109.773 179.899 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -73.6 161.91 41.01 Favored 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 122.736 2.291 . . . . 0.0 112.053 174.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -125.66 155.78 40.3 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 112.238 -2.255 . . . . 0.0 106.19 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -136.2 152.08 50.4 Favored 'General case' 0 N--CA 1.499 1.975 0 C-N-CA 119.221 -0.992 . . . . 0.0 112.212 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.501 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 27.0 t -101.11 109.12 20.97 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.58 ' H ' ' HD2' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -88.06 39.68 0.91 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.501 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 27.6 m -122.76 -39.8 2.49 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 113.195 -1.82 . . . . 0.0 106.808 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.428 ' O ' ' CB ' ' A' ' 9' ' ' GLN . 31.4 p -125.21 -32.74 2.94 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.428 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 9.8 tp60 93.72 57.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 126.358 2.286 . . . . 0.0 110.201 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.45 155.83 29.0 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -118.71 161.43 20.11 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.497 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 82.5 m-85 -137.94 -175.49 4.11 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.357 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.5 p -105.03 -37.51 6.92 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 124.24 0.963 . . . . 0.0 111.246 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.516 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 54.7 mtt85 -118.69 -175.7 2.94 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 123.804 0.69 . . . . 0.0 110.423 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 88.6 p -93.07 -33.51 14.05 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -76.51 3.21 11.8 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.516 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 39.1 m170 -103.04 -42.22 5.86 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.7 tp -65.56 -49.45 68.8 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.155 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -55.61 -64.43 0.85 Allowed 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 47.3 m -41.07 -38.42 1.02 Allowed 'General case' 0 N--CA 1.503 2.19 0 O-C-N 124.278 0.986 . . . . 0.0 111.968 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 46.5 t60 -73.36 -55.33 6.53 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.5 m -49.48 -23.34 1.52 Allowed 'General case' 0 N--CA 1.508 2.453 0 CA-C-O 120.931 0.396 . . . . 0.0 112.04 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -48.64 -26.95 2.52 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.098 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.0 p -79.66 5.48 13.14 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -122.43 -56.86 1.78 Allowed 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.3 m -127.0 57.03 1.48 Allowed 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 113.183 -1.826 . . . . 0.0 111.053 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -121.55 57.34 0.61 Allowed Glycine 0 N--CA 1.497 2.764 0 N-CA-C 109.044 -1.622 . . . . 0.0 109.044 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -117.91 60.68 0.77 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 88.3 tttt . . . . . 0 N--CA 1.497 1.911 0 CA-C-N 114.528 -1.214 . . . . 0.0 109.181 -179.796 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 120.405 0.145 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -76.99 146.97 26.3 Favored 'Trans proline' 0 C--N 1.315 -1.194 0 C-N-CA 122.804 2.336 . . . . 0.0 107.521 162.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.427 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 38.8 m-85 -119.95 157.09 29.53 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -139.89 155.62 47.1 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.958 -0.697 . . . . 0.0 109.887 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.441 ' HA ' HD11 ' A' ' 18' ' ' LEU . 43.6 t -91.68 142.52 27.52 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.4 ' NZ ' ' HB3' ' A' ' 6' ' ' LYS . 3.8 mmmp? -104.71 38.4 1.91 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 115.107 -0.951 . . . . 0.0 108.999 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.8 m -136.14 -43.12 0.64 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 113.266 -1.788 . . . . 0.0 110.223 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.1 p -118.34 -40.83 2.89 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 124.123 0.89 . . . . 0.0 110.09 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 3.9 mp0 93.86 56.61 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.976 0 O-C-N 126.778 2.549 . . . . 0.0 110.57 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.531 ' NH1' ' CE1' ' A' ' 12' ' ' PHE . 41.2 ttt-85 -107.5 157.98 17.58 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 101.034 -3.691 . . . . 0.0 101.034 179.352 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.66 167.38 10.27 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 118.647 -1.221 . . . . 0.0 113.041 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.531 ' CE1' ' NH1' ' A' ' 10' ' ' ARG . 94.5 m-85 -144.96 177.03 9.04 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 113.612 -1.631 . . . . 0.0 108.12 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 81.8 p -104.61 -34.04 8.31 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.593 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 31.6 mtt180 -119.86 -173.86 2.63 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 113.744 -1.571 . . . . 0.0 111.697 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.427 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 38.3 p -95.71 -33.81 12.17 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.859 -1.519 . . . . 0.0 108.374 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -70.35 -35.18 73.41 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.593 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 36.7 m170 -64.74 -13.77 56.24 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 124.512 1.133 . . . . 0.0 110.742 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.441 HD11 ' HA ' ' A' ' 5' ' ' CYS . 51.5 tp -100.08 -50.8 3.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 123.973 0.796 . . . . 0.0 109.733 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.31 -32.35 64.54 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 119.799 -0.761 . . . . 0.0 112.009 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.0 m -74.63 -42.11 59.18 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.437 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 43.5 t60 -56.2 -58.15 9.17 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.405 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.0 p -42.16 -24.45 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.566 1.547 . . . . 0.0 113.795 -179.696 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.4 mtt85 -70.84 10.3 0.54 Allowed 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 114.627 -1.169 . . . . 0.0 111.358 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.405 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.3 t -106.95 -2.36 21.29 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -108.28 -54.17 2.54 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.2 m -124.92 47.65 2.11 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.59 -41.38 0.07 OUTLIER Glycine 0 N--CA 1.493 2.436 0 CA-C-N 113.55 -1.659 . . . . 0.0 110.373 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.69 -56.5 2.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.081 0.518 . . . . 0.0 109.719 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.506 2.333 0 N-CA-C 117.463 2.394 . . . . 0.0 117.463 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 68.9 mttm . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -49.33 155.06 3.46 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.682 2.921 . . . . 0.0 114.078 177.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -127.31 153.08 46.62 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 112.586 -2.097 . . . . 0.0 106.883 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -130.21 139.46 50.81 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.465 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 44.8 t -91.35 105.12 17.55 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 101.537 -3.505 . . . . 0.0 101.537 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.1 pttt -90.34 42.95 1.12 Allowed 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 123.021 1.391 . . . . 0.0 108.29 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.465 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 26.1 m -124.34 -42.77 2.09 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 111.686 -2.506 . . . . 0.0 105.164 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 21.4 p -123.32 -35.98 2.88 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 123.838 0.711 . . . . 0.0 109.757 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.481 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 2.5 mp0 94.38 66.0 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 O-C-N 126.307 2.254 . . . . 0.0 111.711 179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.4 ttt85 -122.1 153.89 38.08 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 104.029 -2.582 . . . . 0.0 104.029 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -112.51 156.41 22.66 Favored 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 119.647 -0.821 . . . . 0.0 112.671 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -140.94 -179.55 6.14 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 113.919 -1.492 . . . . 0.0 108.417 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 56.3 p -108.28 -37.42 6.01 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 124.147 0.904 . . . . 0.0 110.139 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.512 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 52.9 mtt85 -118.92 179.09 4.25 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 124.606 1.191 . . . . 0.0 111.719 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.423 ' C ' ' H ' ' A' ' 17' ' ' HIS . 92.8 p -94.38 -29.01 15.22 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 113.283 -1.78 . . . . 0.0 107.134 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -83.26 13.52 4.2 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.512 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 35.9 m170 -113.34 -57.58 2.27 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 101.111 -3.662 . . . . 0.0 101.111 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.9 tp -47.65 -46.26 28.75 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -51.26 -65.69 0.51 Allowed 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.3 m -39.74 -46.05 1.83 Allowed 'General case' 0 N--CA 1.502 2.135 0 CA-C-O 121.793 0.806 . . . . 0.0 111.016 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.5 t60 -63.67 -55.47 23.21 Favored 'General case' 0 N--CA 1.495 1.786 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.495 ' C ' ' H ' ' A' ' 24' ' ' THR . 21.6 p -47.77 -16.19 0.07 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -179.534 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -75.01 23.16 0.1 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.542 -1.263 . . . . 0.0 111.68 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.495 ' H ' ' C ' ' A' ' 22' ' ' THR . 25.5 p -114.47 -14.37 12.15 Favored 'General case' 0 N--CA 1.498 1.928 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 -111.39 -44.67 3.5 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 55.4 m -113.01 60.98 0.64 Allowed 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 114.16 -1.382 . . . . 0.0 107.326 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -113.41 55.5 0.51 Allowed Glycine 0 N--CA 1.495 2.57 0 N-CA-C 108.451 -1.859 . . . . 0.0 108.451 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -118.01 155.84 29.59 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.9 mmmp? . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 122.634 1.207 . . . . 0.0 109.561 -179.908 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 120.771 0.32 . . . . 0.0 110.731 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.456 ' HB3' ' HZ3' ' A' ' 11' ' ' LYS . 38.5 Cg_exo -44.75 160.56 0.1 Allowed 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 123.582 2.855 . . . . 0.0 113.948 165.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.406 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 78.6 m-85 -121.79 153.24 38.57 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 112.577 -2.102 . . . . 0.0 106.548 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -135.41 152.94 51.89 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 119.574 -0.85 . . . . 0.0 109.298 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 28.9 t -91.79 146.66 23.59 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 114.656 -1.156 . . . . 0.0 108.57 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -105.48 36.89 2.36 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 121.905 0.859 . . . . 0.0 109.612 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.537 HG21 ' CG ' ' A' ' 25' ' ' HIS . 90.0 m -134.12 -45.15 0.78 Allowed 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 113.491 -1.686 . . . . 0.0 110.149 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 28.0 p -120.85 -24.34 5.69 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 124.218 0.949 . . . . 0.0 110.272 -179.679 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.415 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 11.7 mp0 75.79 56.69 0.06 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 125.308 1.63 . . . . 0.0 109.556 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.7 ttt85 -109.63 153.47 24.16 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 101.481 -3.526 . . . . 0.0 101.481 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HZ3' ' HB3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -114.67 163.79 14.95 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 118.708 -1.197 . . . . 0.0 112.624 -179.79 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.448 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 84.4 m-85 -138.17 177.83 7.58 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.801 -1.545 . . . . 0.0 108.01 -179.576 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 p -101.72 -35.14 9.18 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 124.042 0.839 . . . . 0.0 111.534 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.4 mtp-105 -118.14 179.13 4.19 Favored 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.406 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 85.5 p -89.38 -40.42 12.76 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -62.09 -22.85 66.13 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -75.11 -58.8 3.06 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 105.739 -1.948 . . . . 0.0 105.739 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.5 tp -43.98 -48.74 8.72 Favored 'General case' 0 N--CA 1.504 2.236 0 CA-C-O 121.312 0.577 . . . . 0.0 110.019 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -54.82 -59.49 4.65 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 73.1 m -45.43 -43.56 11.46 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-O 121.285 0.564 . . . . 0.0 110.649 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.448 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 68.1 t60 -63.3 -61.68 2.2 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 114.108 -1.405 . . . . 0.0 113.38 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.9 p -43.82 -31.91 0.94 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.456 ' CZ ' ' HA ' ' A' ' 23' ' ' ARG . 0.2 OUTLIER -44.35 -29.01 0.61 Allowed 'General case' 0 N--CA 1.489 1.48 0 CA-C-N 114.396 -1.275 . . . . 0.0 113.631 179.429 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.4 t -86.22 9.51 17.39 Favored 'General case' 0 N--CA 1.507 2.412 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -179.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.537 ' CG ' HG21 ' A' ' 7' ' ' THR . 39.8 m-70 -119.66 -47.92 2.4 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 60.3 m -56.44 -48.99 75.88 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-N 113.629 -1.623 . . . . 0.0 111.541 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 25.27 48.14 0.03 OUTLIER Glycine 0 N--CA 1.496 2.647 0 O-C-N 126.416 2.323 . . . . 0.0 112.868 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 11.5 mp0 8.98 62.92 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 126.858 2.063 . . . . 0.0 116.329 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.1 tptt . . . . . 0 N--CA 1.499 2.016 0 CA-C-N 113.759 -1.564 . . . . 0.0 109.513 179.83 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -77.72 152.54 29.22 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 123.022 2.482 . . . . 0.0 109.978 165.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.461 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 70.8 m-85 -128.95 161.41 29.97 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-N 112.963 -1.926 . . . . 0.0 108.138 179.703 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -138.08 156.76 47.46 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 123.717 0.636 . . . . 0.0 111.017 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 44.3 t -97.34 136.04 38.37 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -100.89 36.93 1.83 Allowed 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 122.03 0.919 . . . . 0.0 109.191 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 59.6 m -131.72 -43.57 1.0 Allowed 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.594 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 29.7 p -118.98 -26.42 6.0 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 123.92 0.763 . . . . 0.0 110.188 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 9.9 mp0 78.87 56.68 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 125.359 1.662 . . . . 0.0 109.278 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.06 157.82 22.04 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 103.286 -2.857 . . . . 0.0 103.286 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -117.27 163.2 16.68 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 118.924 -1.11 . . . . 0.0 113.042 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.42 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 81.6 m-85 -140.01 -177.61 5.07 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 113.522 -1.672 . . . . 0.0 108.824 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.1 p -107.59 -24.02 11.92 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.188 0.93 . . . . 0.0 111.721 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.8 mtp180 -125.18 170.08 11.59 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 123.569 0.543 . . . . 0.0 110.182 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.461 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 82.8 p -96.93 15.79 21.27 Favored 'General case' 0 N--CA 1.503 2.182 0 CA-C-O 121.667 0.746 . . . . 0.0 110.066 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.76 -29.41 4.34 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -67.79 -50.74 55.29 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 100.223 -3.991 . . . . 0.0 100.223 179.079 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.9 tp -57.26 -46.17 83.32 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 113.873 -1.512 . . . . 0.0 109.144 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 ttmm -64.69 -9.81 22.55 Favored 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.4 m -99.31 -41.58 7.38 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 103.567 -2.753 . . . . 0.0 103.567 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.42 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 55.1 t60 -54.67 -57.66 10.58 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 113.975 -1.466 . . . . 0.0 111.27 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.481 ' C ' ' H ' ' A' ' 24' ' ' THR . 9.9 p -42.33 -24.56 0.05 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 125.426 1.49 . . . . 0.0 113.185 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.4 mtt180 -81.36 34.21 0.37 Allowed 'General case' 0 N--CA 1.486 1.37 0 O-C-N 124.459 1.1 . . . . 0.0 110.536 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.481 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.7 t -124.54 -10.47 7.38 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 -111.7 -56.29 2.4 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.484 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.9 m -119.2 51.79 1.11 Allowed 'General case' 0 N--CA 1.501 2.096 0 CA-C-O 122.623 1.202 . . . . 0.0 109.216 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -125.6 56.93 0.7 Allowed Glycine 0 N--CA 1.493 2.47 0 N-CA-C 105.881 -2.888 . . . . 0.0 105.881 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -122.1 -60.24 1.59 Allowed 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt . . . . . 0 N--CA 1.509 2.48 0 O-C-N 125.658 1.849 . . . . 0.0 115.844 -179.638 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.464 ' HB2' ' HD2' ' A' ' 2' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.833 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 . . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.464 ' HD2' ' HB2' ' A' ' 1' ' ' LYS . 18.3 Cg_endo -46.6 161.56 0.18 Allowed 'Trans proline' 0 N--CA 1.503 2.068 0 C-N-CA 121.9 1.733 . . . . 0.0 112.906 167.307 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.45 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 61.8 m-85 -122.41 164.02 18.77 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 113.695 -1.593 . . . . 0.0 109.367 -179.829 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -135.25 151.07 50.24 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 124.495 1.122 . . . . 0.0 108.334 179.458 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.487 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 42.9 t -98.99 130.57 45.34 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -102.37 40.34 1.37 Allowed 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 122.731 1.253 . . . . 0.0 108.856 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.487 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 32.8 m -126.69 -41.07 1.87 Allowed 'General case' 0 N--CA 1.485 1.325 0 CA-C-N 112.32 -2.218 . . . . 0.0 105.727 179.481 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.497 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 28.4 p -122.93 -44.95 2.17 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 123.904 0.752 . . . . 0.0 111.375 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 104.22 57.67 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 127.523 2.329 . . . . 0.0 107.794 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.497 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 33.2 ttt180 -112.48 162.66 15.36 Favored 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 179.796 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -122.44 159.83 26.77 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.598 -0.841 . . . . 0.0 112.423 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.1 m-85 -140.63 -173.89 3.82 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 124.405 1.065 . . . . 0.0 109.596 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.4 p -108.39 -40.26 5.19 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.575 -179.803 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.578 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.2 mtt180 -112.41 179.54 3.96 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 124.142 0.901 . . . . 0.0 110.112 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.45 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 87.7 p -100.38 0.56 40.16 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 114.411 -1.268 . . . . 0.0 107.658 179.791 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.424 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 1.4 p30 -112.03 7.86 19.94 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 179.485 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.578 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 39.5 m170 -114.44 -14.8 12.14 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.4 tp -92.27 -34.67 14.15 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 179.852 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.424 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 0.1 OUTLIER -80.2 -40.96 26.12 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.85 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.8 m -66.27 -8.78 26.94 Favored 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 179.564 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.543 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 13.0 t60 -98.34 -56.07 2.58 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.377 179.38 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 94.2 m -54.06 -17.81 3.03 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -179.458 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.8 ptt180 -66.34 4.78 0.66 Allowed 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 119.299 -0.96 . . . . 0.0 113.323 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 72.9 p -105.42 0.14 26.57 Favored 'General case' 0 N--CA 1.505 2.299 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.569 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 -106.99 -46.49 3.91 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 179.964 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 28.0 m -101.15 -26.9 13.51 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.656 -179.647 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -98.98 53.01 1.08 Allowed Glycine 0 N--CA 1.5 2.905 0 N-CA-C 106.828 -2.509 . . . . 0.0 106.828 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 29' ' ' LYS . 32.7 tt0 -132.41 179.35 6.18 Favored 'General case' 0 N--CA 1.499 2.011 0 CA-C-N 113.088 -1.556 . . . . 0.0 110.066 -179.715 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.402 ' H ' ' HG2' ' A' ' 28' ' ' GLU . 25.2 mmmt . . . . . 0 N--CA 1.501 2.118 0 CA-C-O 122.193 0.997 . . . . 0.0 108.93 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.5 OUTLIER -86.52 163.73 9.46 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 123.514 2.809 . . . . 0.0 111.971 -175.535 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -125.69 164.29 20.94 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 113.501 -1.681 . . . . 0.0 107.54 179.784 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.7 tp-100 -135.27 152.08 51.17 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 123.818 0.699 . . . . 0.0 110.118 -179.995 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.474 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 32.0 t -100.33 136.54 40.06 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 179.511 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -105.33 36.97 2.32 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 124.908 1.38 . . . . 0.0 108.25 -179.939 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.3 m -130.25 -42.23 1.22 Allowed 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 113.358 -1.747 . . . . 0.0 108.947 -179.948 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.9 p -120.28 -45.9 2.42 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.953 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.0 mm100 105.55 60.75 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 126.983 2.677 . . . . 0.0 110.51 179.933 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.474 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 45.9 ttt-85 -114.16 154.45 27.82 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 102.878 -3.008 . . . . 0.0 102.878 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -111.29 163.44 13.95 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.299 -0.961 . . . . 0.0 110.421 -179.758 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.498 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 92.9 m-85 -141.24 -173.72 3.82 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 124.532 1.145 . . . . 0.0 109.639 -179.725 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.4 p -108.87 -38.86 5.49 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 124.604 1.19 . . . . 0.0 109.702 -179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.424 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 46.9 mtt180 -119.16 -176.95 3.23 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 124.102 0.876 . . . . 0.0 110.67 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 81.1 p -95.0 -36.97 11.35 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.182 -179.908 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -64.84 -33.97 77.27 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 104.036 -2.579 . . . . 0.0 104.036 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.424 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 47.6 m170 -59.83 -57.22 13.85 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 106.279 -1.749 . . . . 0.0 106.279 179.491 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.1 tp -47.03 -47.81 22.23 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.037 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.6 mttp -60.21 -50.66 72.8 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 118.354 -1.338 . . . . 0.0 110.834 179.473 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.5 m -47.59 -46.25 28.08 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 179.545 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.498 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 62.7 t60 -60.58 -56.44 21.29 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 113.221 -1.809 . . . . 0.0 114.406 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.485 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.1 p -50.46 -14.44 0.18 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -89.52 39.59 0.95 Allowed 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 179.717 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.485 ' H ' ' C ' ' A' ' 22' ' ' THR . 95.5 m -131.75 -11.72 3.42 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 112.487 -2.142 . . . . 0.0 107.481 179.839 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 50.4 m-70 -107.22 -44.8 4.26 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 179.843 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 63.8 p -100.64 -15.43 17.76 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 114.071 -1.422 . . . . 0.0 109.536 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -116.39 54.06 0.6 Allowed Glycine 0 N--CA 1.498 2.812 0 N-CA-C 108.884 -1.686 . . . . 0.0 108.884 179.87 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -132.79 172.4 12.62 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-N 114.541 -0.83 . . . . 0.0 110.007 -179.908 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.407 ' H ' ' HD2' ' A' ' 29' ' ' LYS . 14.6 mptt . . . . . 0 N--CA 1.511 2.596 0 N-CA-C 116.434 2.012 . . . . 0.0 116.434 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.811 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -66.97 159.46 51.77 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 123.147 2.565 . . . . 0.0 113.226 -177.063 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.405 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 70.8 m-85 -127.23 161.17 29.19 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 112.942 -1.935 . . . . 0.0 107.257 179.738 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.499 HE22 ' HB3' ' A' ' 11' ' ' LYS . 9.9 tp-100 -140.08 149.57 43.26 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.427 179.908 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.467 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 37.0 t -98.36 121.37 40.21 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 103.785 -2.672 . . . . 0.0 103.785 179.439 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -95.57 41.27 1.1 Allowed 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.467 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 22.4 m -128.95 -42.13 1.41 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 113.406 -1.725 . . . . 0.0 108.55 -179.935 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.3 p -120.25 -42.32 2.58 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 123.96 0.788 . . . . 0.0 109.119 -179.957 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.8 mm100 102.75 57.66 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.975 0 O-C-N 126.888 2.617 . . . . 0.0 111.163 179.777 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.07 155.34 26.13 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 103.171 -2.9 . . . . 0.0 103.171 179.45 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.499 ' HB3' HE22 ' A' ' 4' ' ' GLN . 25.7 pttm -113.47 163.08 15.35 Favored 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.8 -179.737 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.412 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.2 m-85 -140.97 -178.09 5.4 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 124.264 0.978 . . . . 0.0 109.135 -179.802 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.0 p -105.85 -37.19 6.77 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 124.955 1.409 . . . . 0.0 111.002 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.8 mtp-105 -118.66 -178.85 3.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 124.424 1.078 . . . . 0.0 109.942 179.975 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.405 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 74.1 p -93.6 -34.82 13.17 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.14 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -74.96 0.54 15.45 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -97.61 -52.82 3.63 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 102.051 -3.315 . . . . 0.0 102.051 179.493 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.8 tp -52.26 -47.52 65.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 124.157 0.911 . . . . 0.0 108.917 179.547 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -59.5 -55.75 30.68 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.585 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 65.8 m -52.87 -25.25 11.04 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.025 0.441 . . . . 0.0 111.173 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.412 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 66.4 t60 -82.98 -55.87 4.13 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.341 179.677 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.407 ' C ' ' H ' ' A' ' 24' ' ' THR . 8.1 p -45.95 -37.28 6.27 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.174 0.99 . . . . 0.0 112.602 -179.544 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -64.02 10.95 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 118.693 -1.203 . . . . 0.0 114.013 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.407 ' H ' ' C ' ' A' ' 22' ' ' THR . 11.8 t -105.06 -7.14 19.37 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.682 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 -102.95 -55.67 2.38 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.7 m -128.55 47.08 2.49 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 124.349 1.031 . . . . 0.0 108.904 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -140.81 -43.52 0.07 OUTLIER Glycine 0 N--CA 1.497 2.755 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 179.822 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -103.37 165.39 11.06 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 113.454 -1.373 . . . . 0.0 109.313 -179.853 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.5 pttt . . . . . 0 N--CA 1.495 1.778 0 CA-C-N 113.988 -1.46 . . . . 0.0 111.788 -179.646 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -50.63 163.44 0.71 Allowed 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 122.829 2.353 . . . . 0.0 112.472 169.355 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.414 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 64.7 m-85 -129.05 149.95 50.65 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.665 -1.607 . . . . 0.0 107.159 179.907 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -124.54 141.82 51.81 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 123.971 0.794 . . . . 0.0 109.415 179.97 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.414 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 49.6 t -91.73 119.71 31.82 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 101.82 -3.4 . . . . 0.0 101.82 179.49 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -95.05 39.27 1.11 Allowed 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 -179.688 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.414 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 24.0 m -128.7 -44.62 1.34 Allowed 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 113.106 -1.861 . . . . 0.0 108.234 179.963 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 29.9 p -119.65 -34.05 3.87 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 119.759 -0.777 . . . . 0.0 109.403 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 4.3 mp0 91.77 64.33 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 126.38 2.3 . . . . 0.0 111.359 179.712 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.56 152.84 36.34 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 104.058 -2.571 . . . . 0.0 104.058 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -113.56 155.07 26.07 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 119.187 -1.005 . . . . 0.0 110.553 -179.691 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -135.4 -172.03 2.97 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.184 -179.694 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.1 p -108.98 -42.8 4.35 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 113.605 -1.634 . . . . 0.0 111.458 -179.84 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.545 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 55.5 mtt180 -114.6 170.28 8.43 Favored 'General case' 0 N--CA 1.506 2.342 0 CA-C-O 121.839 0.828 . . . . 0.0 111.815 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.414 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 69.3 p -82.39 -39.16 23.08 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 179.939 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.47 -27.55 67.12 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 179.864 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.545 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 45.7 m170 -71.16 -60.29 2.31 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 104.418 -2.438 . . . . 0.0 104.418 179.491 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.5 tp -41.44 -52.05 3.68 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 123.801 0.688 . . . . 0.0 109.431 179.41 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -47.04 -69.02 0.14 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.713 0.633 . . . . 0.0 110.796 179.471 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.47 ' HA ' ' NH1' ' A' ' 23' ' ' ARG . 56.0 m -42.66 -42.03 3.32 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.936 -179.91 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -66.46 -61.81 1.8 Allowed 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 113.915 -1.493 . . . . 0.0 113.611 179.983 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.3 m -41.85 -45.69 3.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 124.382 1.051 . . . . 0.0 111.605 -178.925 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.47 ' NH1' ' HA ' ' A' ' 20' ' ' THR . 37.6 ttp180 -34.7 -31.9 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 O-C-N 125.97 2.044 . . . . 0.0 114.792 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.3 t -77.18 14.39 0.92 Allowed 'General case' 0 N--CA 1.506 2.329 0 CA-C-O 121.765 0.793 . . . . 0.0 112.667 -179.659 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.0 m-70 -112.73 -2.17 14.54 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 114.039 -1.437 . . . . 0.0 107.784 179.562 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -120.06 -46.29 2.43 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.933 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 15.1 48.49 0.01 OUTLIER Glycine 0 N--CA 1.498 2.819 0 O-C-N 126.288 2.243 . . . . 0.0 117.329 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -116.07 129.58 56.41 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 179.58 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.7 pttm . . . . . 0 N--CA 1.51 2.532 0 N-CA-C 116.852 2.167 . . . . 0.0 116.852 -179.849 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 59.1 tttp . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -81.83 153.47 17.27 Favored 'Trans proline' 0 N--CA 1.49 1.277 0 C-N-CA 123.501 2.801 . . . . 0.0 109.554 173.894 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -121.9 159.9 25.9 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 113.05 -1.886 . . . . 0.0 107.055 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -140.31 150.49 44.07 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.489 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.42 ' HA ' HD11 ' A' ' 18' ' ' LEU . 31.9 t -87.25 144.59 26.74 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 179.596 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -102.54 32.16 3.73 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.162 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 39.9 m -131.57 -40.88 1.08 Allowed 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 114.124 -1.398 . . . . 0.0 110.178 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 26.9 p -121.34 -42.13 2.47 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 124.011 0.819 . . . . 0.0 111.259 -179.671 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.5 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 2.6 mp0 99.62 58.5 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 126.811 2.569 . . . . 0.0 108.955 179.97 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.45 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 16.8 ttt180 -104.6 159.31 15.86 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 101.373 -3.566 . . . . 0.0 101.373 179.477 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -114.49 161.18 18.34 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 119.197 -1.001 . . . . 0.0 112.165 -179.41 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.429 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.9 m-85 -144.04 176.26 9.43 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 124.44 1.087 . . . . 0.0 109.348 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 43.5 p -106.19 -40.52 5.61 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.653 1.221 . . . . 0.0 110.598 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.552 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 58.2 mtt85 -112.27 171.57 7.43 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 124.579 1.174 . . . . 0.0 110.053 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 88.8 p -85.51 -36.63 20.4 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 179.864 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.26 -32.78 74.28 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 179.978 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.552 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 41.6 m170 -67.1 -60.78 2.33 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 179.666 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.42 HD11 ' HA ' ' A' ' 5' ' ' CYS . 44.6 tp -40.14 -51.77 2.61 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 123.758 0.661 . . . . 0.0 110.721 179.451 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -54.81 -60.37 3.46 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.644 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.5 m -42.35 -40.81 2.63 Favored 'General case' 0 N--CA 1.501 2.103 0 CA-C-O 121.489 0.661 . . . . 0.0 111.767 179.723 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.45 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 53.3 t60 -71.57 -57.37 4.46 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 113.92 -1.491 . . . . 0.0 114.191 179.666 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.7 p -44.01 -35.92 2.28 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.591 0.757 . . . . 0.0 112.306 -179.127 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -81.73 44.88 0.85 Allowed 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 118.457 -1.297 . . . . 0.0 111.766 179.765 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.0 t -124.14 -21.78 4.95 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 179.495 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -87.15 -52.39 5.44 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 114.107 -1.406 . . . . 0.0 110.249 -179.6 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.5 m -125.02 -19.52 5.18 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 124.203 0.939 . . . . 0.0 113.393 -179.773 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -101.27 42.82 1.84 Allowed Glycine 0 N--CA 1.497 2.733 0 C-N-CA 119.89 -1.148 . . . . 0.0 110.783 -179.745 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -120.91 63.78 0.86 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 179.915 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.572 ' H ' ' HD3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.975 0 CA-C-N 113.854 -1.521 . . . . 0.0 109.952 -179.824 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -58.46 158.13 24.26 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.747 2.298 . . . . 0.0 113.335 -172.101 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.422 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 58.9 m-85 -127.74 167.6 16.25 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 113.005 -1.907 . . . . 0.0 107.746 179.982 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -148.06 153.18 38.58 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.846 179.493 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.475 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 34.7 t -94.79 127.75 41.02 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 179.819 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.467 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -95.42 38.78 1.14 Allowed 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 -179.585 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.475 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 29.2 m -130.68 -44.59 1.08 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 113.887 -1.506 . . . . 0.0 109.89 179.932 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 32.0 p -120.71 -26.58 5.25 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 123.75 0.656 . . . . 0.0 110.789 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.469 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 6.8 mp0 85.82 57.91 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 125.93 2.018 . . . . 0.0 112.304 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.68 151.86 34.26 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 179.35 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -113.96 162.88 15.86 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.149 -1.02 . . . . 0.0 112.216 -179.799 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -137.11 -173.81 3.56 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.699 -1.591 . . . . 0.0 109.485 -179.575 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 80.7 p -111.24 -37.58 5.26 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 124.313 1.008 . . . . 0.0 108.452 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.509 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.4 mtt85 -116.09 -178.16 3.34 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.913 -179.939 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.422 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 87.1 p -97.17 -24.19 15.85 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 113.689 -1.596 . . . . 0.0 107.418 179.95 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -90.29 19.01 5.42 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 122.483 1.135 . . . . 0.0 108.549 179.808 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.509 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 22.7 m170 -120.27 -19.71 7.58 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 112.275 -2.239 . . . . 0.0 105.147 179.514 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.8 tp -101.12 -48.77 4.3 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 114.405 -1.271 . . . . 0.0 109.405 -179.809 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -71.81 3.8 3.87 Favored 'General case' 0 N--CA 1.504 2.25 0 CA-C-O 121.121 0.486 . . . . 0.0 111.412 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.4 m -105.51 -43.17 5.02 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 103.781 -2.674 . . . . 0.0 103.781 179.536 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -61.71 -56.92 14.51 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 113.484 -1.689 . . . . 0.0 111.73 179.832 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.467 ' C ' ' H ' ' A' ' 24' ' ' THR . 17.1 p -45.06 -23.63 0.17 Allowed 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 124.686 1.194 . . . . 0.0 112.6 -179.872 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.8 mmm-85 -78.85 32.83 0.21 Allowed 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.75 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.467 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.0 t -124.58 -23.48 4.39 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 179.746 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.1 m-70 -97.79 -43.51 7.11 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.169 -179.748 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.7 t -105.54 -28.15 10.96 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 124.398 1.061 . . . . 0.0 113.178 -179.777 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -110.77 51.45 0.7 Allowed Glycine 0 N--CA 1.499 2.862 0 C-N-CA 120.312 -0.947 . . . . 0.0 111.976 -179.771 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -14.35 105.37 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.353 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 179.848 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.5 tptp . . . . . 0 N--CA 1.496 1.843 0 O-C-N 124.256 0.973 . . . . 0.0 110.136 -179.941 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.1 tptt . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 107.351 -1.351 . . . . 0.0 107.351 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -47.11 157.2 0.65 Allowed 'Trans proline' 0 N--CA 1.494 1.545 0 C-N-CA 123.535 2.823 . . . . 0.0 115.346 -174.584 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.408 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 76.9 m-85 -125.49 155.67 40.17 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 112.02 -2.355 . . . . 0.0 108.018 -179.941 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -135.45 152.37 51.3 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.226 179.415 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.44 ' HA ' HD11 ' A' ' 18' ' ' LEU . 44.5 t -91.17 128.8 37.14 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 179.624 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.3 pttm -99.59 38.89 1.37 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.375 -179.72 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.408 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 54.7 m -130.88 -42.73 1.11 Allowed 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 112.251 -2.25 . . . . 0.0 107.353 179.62 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.3 p -124.91 -30.79 3.21 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 124.06 0.85 . . . . 0.0 111.806 -179.875 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.494 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.0 mp0 88.0 62.81 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.325 0 O-C-N 125.64 1.838 . . . . 0.0 110.443 179.839 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.414 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 21.4 ttm-85 -115.68 154.19 29.96 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 102.725 -3.065 . . . . 0.0 102.725 179.696 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -114.51 155.66 26.02 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 119.153 -1.019 . . . . 0.0 112.535 -179.47 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.428 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 85.2 m-85 -136.56 -179.63 5.8 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 114.393 -1.276 . . . . 0.0 109.059 -179.733 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 76.3 p -106.37 -34.69 7.36 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 124.417 1.073 . . . . 0.0 110.122 -179.861 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.404 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 52.5 mtt85 -117.41 169.73 9.28 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 124.838 1.337 . . . . 0.0 111.413 -179.796 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.408 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 96.7 p -85.99 -37.04 19.4 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 179.913 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -64.27 -30.01 71.07 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 179.782 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.404 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 1.7 m-70 -71.48 -60.62 2.14 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 105.858 -1.904 . . . . 0.0 105.858 179.685 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.44 HD11 ' HA ' ' A' ' 5' ' ' CYS . 62.9 tp -40.61 -52.4 2.88 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 124.073 0.858 . . . . 0.0 111.175 179.608 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -55.06 -64.39 0.85 Allowed 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 118.922 -0.561 . . . . 0.0 110.306 179.626 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.0 m -39.2 -45.47 1.35 Allowed 'General case' 0 N--CA 1.504 2.246 0 O-C-N 124.231 0.957 . . . . 0.0 110.292 179.763 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.428 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 44.9 t60 -60.33 -60.99 2.94 Favored 'General case' 0 N--CA 1.489 1.502 0 CA-C-N 113.878 -1.51 . . . . 0.0 111.24 179.591 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.5 m -47.53 -23.32 0.61 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 123.751 0.657 . . . . 0.0 112.735 -179.581 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 mmm180 -53.57 -21.47 6.64 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.196 179.484 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.7 t -88.21 17.16 5.35 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-O 121.778 0.799 . . . . 0.0 110.81 -179.884 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 36.3 m-70 -125.47 -53.81 1.58 Allowed 'General case' 0 N--CA 1.492 1.651 0 CA-C-N 113.652 -1.613 . . . . 0.0 108.731 179.705 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.4 m -122.36 3.57 9.72 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -179.677 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.88 -48.94 9.29 Favored Glycine 0 N--CA 1.499 2.849 0 N-CA-C 108.75 -1.74 . . . . 0.0 108.75 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.56 -10.94 60.49 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 114.133 -1.033 . . . . 0.0 111.969 179.712 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.7 tttt . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 122.752 1.263 . . . . 0.0 109.228 -179.848 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt . . . . . 0 N--CA 1.493 1.719 0 CA-C-O 118.807 -0.616 . . . . 0.0 109.434 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -66.61 165.2 26.13 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.417 2.078 . . . . 0.0 112.865 165.688 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.457 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 50.1 m-85 -129.17 168.04 16.73 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 113.635 -1.621 . . . . 0.0 108.93 179.826 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.8 tp-100 -133.82 149.37 51.39 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 124.165 0.915 . . . . 0.0 111.752 -179.806 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.496 ' HA ' HD11 ' A' ' 18' ' ' LEU . 41.7 t -99.34 141.4 32.17 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 104.616 -2.364 . . . . 0.0 104.616 179.304 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.471 ' HD3' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -105.32 19.31 20.8 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 124.748 1.28 . . . . 0.0 109.183 -179.843 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.9 m -114.81 -42.86 3.19 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 114.09 -1.414 . . . . 0.0 108.214 179.919 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.534 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 22.4 p -130.9 10.28 5.02 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 119.576 -0.85 . . . . 0.0 112.355 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 47.16 59.39 4.08 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 122.747 1.26 . . . . 0.0 111.226 -179.825 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.534 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 15.4 ttt180 -117.04 157.42 25.87 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 103.934 -2.617 . . . . 0.0 103.934 179.812 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 pttp -114.91 165.39 12.9 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 118.32 -1.352 . . . . 0.0 112.149 -179.938 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.497 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 98.9 m-85 -140.84 -170.67 3.08 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 113.896 -1.502 . . . . 0.0 110.448 -179.768 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.8 p -108.36 -35.41 6.52 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 124.737 1.273 . . . . 0.0 109.495 179.923 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.419 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 5.6 mtp85 -127.12 174.61 8.77 Favored 'General case' 0 N--CA 1.504 2.227 0 CA-C-O 121.658 0.742 . . . . 0.0 110.371 179.497 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.457 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 90.3 p -82.55 -41.87 19.08 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.447 -1.251 . . . . 0.0 108.549 -179.891 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -67.86 -28.52 67.61 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 -179.992 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.419 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 53.9 m170 -69.16 -61.53 1.75 Allowed 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 104.625 -2.361 . . . . 0.0 104.625 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.496 HD11 ' HA ' ' A' ' 5' ' ' CYS . 40.0 tp -39.21 -52.63 1.94 Allowed 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 121.808 0.813 . . . . 0.0 110.179 179.318 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -49.07 -68.43 0.18 Allowed 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.151 179.584 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.4 m -39.83 -45.2 1.74 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 124.635 1.21 . . . . 0.0 110.284 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 8.2 t60 -57.06 -61.18 2.63 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.174 -1.376 . . . . 0.0 111.265 179.797 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.484 ' C ' ' H ' ' A' ' 24' ' ' THR . 12.5 m -41.54 -26.49 0.07 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.985 1.428 . . . . 0.0 111.238 -179.68 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.411 ' HA ' HH11 ' A' ' 23' ' ' ARG . 14.9 mmm180 -79.42 36.65 0.31 Allowed 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 114.849 -1.068 . . . . 0.0 110.47 179.797 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.484 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.7 t -125.77 -12.08 6.59 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 104.882 -2.266 . . . . 0.0 104.882 179.496 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -95.67 -41.23 9.0 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.801 -179.895 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.4 m -110.73 -35.95 5.85 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 124.55 1.156 . . . . 0.0 114.036 -179.739 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -114.2 60.32 0.38 Allowed Glycine 0 N--CA 1.5 2.963 0 O-C-N 124.374 1.046 . . . . 0.0 112.054 -179.499 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 29' ' ' LYS . 2.8 tp10 -57.39 162.82 2.61 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 124.486 0.757 . . . . 0.0 109.992 179.878 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.409 ' N ' ' HG3' ' A' ' 28' ' ' GLU . 25.2 pttm . . . . . 0 N--CA 1.499 1.979 0 CA-C-O 122.441 1.115 . . . . 0.0 110.448 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 67.1 mttm . . . . . 0 N--CA 1.492 1.651 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -79.96 124.02 5.39 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 C-N-CA 122.891 2.394 . . . . 0.0 110.564 177.061 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -114.92 145.14 42.52 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 105.172 -2.158 . . . . 0.0 105.172 179.669 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -127.61 151.13 49.32 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.25 0.969 . . . . 0.0 109.768 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.5 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 32.2 t -99.59 136.25 39.8 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 103.254 -2.869 . . . . 0.0 103.254 179.587 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -99.11 23.6 8.88 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.408 -0.917 . . . . 0.0 111.714 -179.422 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.502 HG21 ' CG ' ' A' ' 25' ' ' HIS . 18.7 m -119.84 -44.56 2.52 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 179.296 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.561 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 27.2 p -127.25 10.32 6.82 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 48.57 57.7 6.01 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-O 123.372 1.558 . . . . 0.0 109.71 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.561 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 55.7 ttm-85 -116.22 130.04 56.59 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 111.101 -2.772 . . . . 0.0 103.909 -179.929 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -103.68 163.09 12.55 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.062 -1.055 . . . . 0.0 113.576 -179.352 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -138.49 175.3 9.68 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 112.932 -1.94 . . . . 0.0 110.345 -179.385 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 84.9 p -101.7 -27.35 13.1 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.57 1.169 . . . . 0.0 110.719 -179.875 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 57.1 mtt85 -118.2 165.85 13.31 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 124.546 1.153 . . . . 0.0 111.007 -179.936 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 61.8 p -85.16 -38.98 18.38 Favored 'General case' 0 N--CA 1.492 1.631 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.432 -179.953 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.4 -36.42 82.26 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 179.921 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -66.37 -62.23 1.58 Allowed 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 179.708 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 39.2 tp -40.1 -55.18 2.15 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.087 0.867 . . . . 0.0 111.478 179.613 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -54.01 -62.0 1.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 124.045 0.841 . . . . 0.0 112.376 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.8 m -45.26 -43.43 10.46 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 123.893 0.746 . . . . 0.0 111.014 179.889 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.462 ' CE1' ' HD2' ' A' ' 10' ' ' ARG . 63.6 t60 -61.82 -63.62 1.2 Allowed 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.535 179.842 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -51.25 -42.47 61.07 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -179.439 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -34.12 -31.57 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 125.453 1.721 . . . . 0.0 112.992 179.454 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.5 t -78.73 -47.95 15.87 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.364 -179.72 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.502 ' CG ' HG21 ' A' ' 7' ' ' THR . 0.8 OUTLIER -124.77 42.73 3.2 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 179.866 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.7 m -140.17 -44.24 0.42 Allowed 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 114.164 -1.38 . . . . 0.0 108.303 179.642 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -120.32 53.81 0.68 Allowed Glycine 0 N--CA 1.498 2.828 0 CA-C-N 113.941 -1.481 . . . . 0.0 109.493 -179.973 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -125.76 66.19 1.18 Allowed 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -179.875 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp . . . . . 0 N--CA 1.501 2.115 0 CA-C-O 122.651 1.215 . . . . 0.0 110.932 -179.755 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.8 tptp . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -88.69 159.94 6.33 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 C-N-CA 122.65 2.234 . . . . 0.0 111.966 176.999 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -122.44 154.56 37.61 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 112.258 -2.246 . . . . 0.0 105.964 179.76 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.8 tp-100 -132.14 147.9 52.45 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 123.847 0.717 . . . . 0.0 110.592 -179.864 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.491 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 18.3 t -95.46 135.36 37.2 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 103.169 -2.9 . . . . 0.0 103.169 179.491 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 7.8 mptt -99.76 33.44 2.54 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 125.124 1.515 . . . . 0.0 108.539 -179.576 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.484 HG21 ' CG ' ' A' ' 25' ' ' HIS . 69.9 m -131.76 -46.48 0.96 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.393 179.946 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.2 p -125.58 5.97 7.55 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.674 -179.75 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 53.1 58.71 5.03 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-O 122.941 1.353 . . . . 0.0 111.062 179.878 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.491 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 20.6 ttt180 -111.79 148.94 32.47 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 102.613 -3.106 . . . . 0.0 102.613 179.67 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -115.58 162.53 17.09 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 119.088 -1.045 . . . . 0.0 112.22 -179.8 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -140.98 177.47 8.03 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-N 114.085 -1.416 . . . . 0.0 108.599 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 80.5 p -106.83 -30.48 8.89 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 124.29 0.994 . . . . 0.0 110.642 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.503 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 51.9 mtt85 -119.96 -178.85 3.75 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.901 -179.757 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 99.8 p -98.19 -33.57 11.07 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -64.17 -22.71 67.04 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.503 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 32.4 m170 -80.25 -42.68 22.72 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 179.731 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.86 -47.42 83.41 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 179.763 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.37 -61.25 2.43 Favored 'General case' 0 N--CA 1.503 2.214 0 CA-C-N 118.928 0.785 . . . . 0.0 110.388 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.5 m -48.11 -26.22 1.77 Allowed 'General case' 0 N--CA 1.502 2.17 0 CA-C-O 120.959 0.409 . . . . 0.0 112.088 179.73 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.479 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 71.3 t60 -84.61 -56.13 3.76 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.633 179.612 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.474 ' C ' ' H ' ' A' ' 24' ' ' THR . 19.2 p -50.26 -33.59 20.32 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.417 1.087 . . . . 0.0 113.383 -179.464 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -65.63 14.28 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.643 -1.223 . . . . 0.0 113.888 179.744 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.474 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.4 t -109.75 -10.51 14.79 Favored 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 179.554 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.484 ' CG ' HG21 ' A' ' 7' ' ' THR . 40.7 m-70 -107.59 -41.51 5.02 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 104.731 -2.322 . . . . 0.0 104.731 179.857 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.8 m -75.47 -40.26 57.61 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 179.618 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -105.62 61.72 0.35 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 104.525 -3.43 . . . . 0.0 104.525 179.651 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -121.68 169.61 10.54 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 112.864 -1.668 . . . . 0.0 109.531 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 122.145 0.974 . . . . 0.0 109.786 179.776 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.0 tttp . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 107.057 -1.461 . . . . 0.0 107.057 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -78.25 161.31 29.1 Favored 'Trans proline' 0 C--N 1.316 -1.178 0 C-N-CA 122.719 2.279 . . . . 0.0 111.167 -171.694 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -124.95 154.82 40.58 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 112.678 -2.055 . . . . 0.0 106.571 179.798 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -135.87 145.04 45.94 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 124.084 0.865 . . . . 0.0 109.394 179.93 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.2 t -93.56 140.52 29.51 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 104.891 -2.262 . . . . 0.0 104.891 179.619 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -104.63 37.62 2.09 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -179.672 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.9 m -131.93 -44.31 0.96 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 113.7 -1.591 . . . . 0.0 109.059 179.992 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.497 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.0 p -118.93 -34.22 3.97 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 123.896 0.747 . . . . 0.0 109.832 -179.933 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.497 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 6.5 mp0 88.77 56.68 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.196 0 O-C-N 126.342 2.276 . . . . 0.0 108.98 179.706 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.404 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -112.65 138.54 49.29 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 102.946 -2.983 . . . . 0.0 102.946 179.747 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -102.64 164.98 11.33 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.949 -1.101 . . . . 0.0 112.15 -179.53 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -139.42 -178.08 5.22 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 113.52 -1.673 . . . . 0.0 109.293 -179.704 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.5 p -105.06 -39.53 6.19 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 124.883 1.365 . . . . 0.0 108.818 -179.909 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.502 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 55.9 mtt180 -109.7 -177.69 3.34 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 124.438 1.086 . . . . 0.0 111.369 179.965 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.5 p -97.67 -30.44 12.82 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 113.671 -1.604 . . . . 0.0 109.461 -179.879 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -88.41 19.42 3.84 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 122.162 0.982 . . . . 0.0 108.475 179.906 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.502 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.5 m170 -119.45 -24.39 6.34 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 179.529 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.5 tp -93.76 -54.3 3.68 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 114.322 -1.308 . . . . 0.0 110.154 -179.968 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -0.86 12.71 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.821 -179.846 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.0 m -104.5 -36.01 7.68 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 105.299 -2.111 . . . . 0.0 105.299 179.921 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 25.3 t60 -70.33 -53.37 16.98 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 124.041 0.838 . . . . 0.0 108.801 179.727 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 p -37.94 -46.01 0.93 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.129 0.972 . . . . 0.0 111.135 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.3 mmt-85 -43.32 -21.38 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 179.921 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.9 t -73.91 -21.54 60.02 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 123.099 0.249 . . . . 0.0 111.335 -179.548 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 56.6 m-70 -99.11 25.39 6.83 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 179.705 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 45.4 m -137.28 -55.01 0.7 Allowed 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 -179.723 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -121.2 25.19 7.12 Favored Glycine 0 N--CA 1.496 2.685 0 CA-C-N 114.294 -1.321 . . . . 0.0 113.218 -179.542 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -130.42 -70.94 0.6 Allowed 'General case' 0 N--CA 1.501 2.079 0 C-N-CA 119.038 -1.065 . . . . 0.0 108.797 179.673 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp . . . . . 0 N--CA 1.491 1.596 0 CA-C-N 114.574 -1.193 . . . . 0.0 108.19 179.93 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt . . . . . 0 N--CA 1.493 1.69 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_exo -54.46 154.9 18.09 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 122.316 2.011 . . . . 0.0 111.906 168.219 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.458 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 56.7 m-85 -128.28 163.14 25.42 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 113.586 -1.643 . . . . 0.0 108.783 179.936 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -136.29 153.71 51.09 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 124.148 0.905 . . . . 0.0 110.489 179.775 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.464 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 34.6 t -99.54 124.74 45.01 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 179.664 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -97.88 40.48 1.17 Allowed 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 122.376 1.084 . . . . 0.0 109.101 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.464 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.3 m -124.42 -41.59 2.16 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 112.84 -1.982 . . . . 0.0 105.668 179.633 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 31.8 p -122.31 -36.86 2.89 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 124.097 0.873 . . . . 0.0 110.684 180.0 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 2.9 mp0 92.26 56.81 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.456 0 O-C-N 126.143 2.152 . . . . 0.0 111.434 179.791 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.4 ttt-85 -116.65 161.11 19.71 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 103.897 -2.631 . . . . 0.0 103.897 179.529 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -117.2 163.52 16.18 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 119.773 -0.771 . . . . 0.0 112.951 -179.898 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.605 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 72.2 m-85 -138.35 -175.61 4.17 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 112.711 -2.041 . . . . 0.0 107.935 -179.825 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.0 p -106.2 -33.04 7.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 124.142 0.901 . . . . 0.0 110.609 -179.986 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.462 ' CD ' ' CE1' ' A' ' 17' ' ' HIS . 35.5 mtp180 -120.06 171.08 8.71 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 123.793 0.683 . . . . 0.0 110.623 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.458 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 92.1 p -80.84 -29.07 35.91 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.562 -179.898 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -82.55 -28.23 31.12 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 179.78 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.462 ' CE1' ' CD ' ' A' ' 14' ' ' ARG . 42.9 m170 -68.85 -52.18 32.56 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 101.867 -3.383 . . . . 0.0 101.867 179.275 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 52.6 tp -43.04 -49.04 6.19 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.115 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.403 ' C ' ' HD2' ' A' ' 19' ' ' LYS . 0.2 OUTLIER -56.81 -58.74 6.79 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 179.415 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.7 m -40.18 -38.51 0.77 Allowed 'General case' 0 N--CA 1.503 2.213 0 CA-C-O 121.116 0.484 . . . . 0.0 110.849 179.612 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.605 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 51.3 t60 -75.16 -51.78 12.56 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 113.835 -1.53 . . . . 0.0 114.078 179.592 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.7 p -43.13 -37.26 1.97 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 118.899 0.772 . . . . 0.0 110.459 -179.769 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -43.44 -21.25 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 179.31 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 68.1 p -80.33 -18.87 47.93 Favored 'General case' 0 N--CA 1.509 2.509 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -179.733 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 47.7 m-70 -97.49 -40.75 8.51 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 106.117 -1.809 . . . . 0.0 106.117 179.969 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -107.44 34.47 3.5 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 124.306 1.004 . . . . 0.0 112.39 -179.87 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -120.76 57.27 0.59 Allowed Glycine 0 N--CA 1.5 2.956 0 N-CA-C 106.02 -2.832 . . . . 0.0 106.02 179.501 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -104.42 -175.55 2.83 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.1 -1.05 . . . . 0.0 109.191 -179.665 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? . . . . . 0 N--CA 1.503 2.188 0 CA-C-O 122.322 1.058 . . . . 0.0 110.234 179.986 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.5 tttp . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -55.85 164.46 4.64 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 122.933 2.422 . . . . 0.0 112.911 176.694 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -123.15 166.09 15.78 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 112.611 -2.086 . . . . 0.0 107.973 -179.992 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -142.17 152.83 43.54 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 123.954 0.784 . . . . 0.0 109.759 179.558 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.462 ' HA ' HD11 ' A' ' 18' ' ' LEU . 46.2 t -93.24 136.37 33.57 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 179.574 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -104.44 35.32 2.76 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.649 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 58.7 m -127.52 -40.57 1.76 Allowed 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 113.287 -1.779 . . . . 0.0 107.763 179.861 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.4 p -122.52 -38.39 2.67 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 124.14 0.9 . . . . 0.0 110.5 -179.942 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.49 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.2 mp0 91.54 62.3 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 126.22 2.2 . . . . 0.0 110.63 179.793 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -118.73 155.84 30.39 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 102.692 -3.077 . . . . 0.0 102.692 179.624 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.6 mtpt -113.8 163.98 14.33 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 118.841 -1.144 . . . . 0.0 113.169 -179.657 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.437 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 88.7 m-85 -139.96 -178.15 5.31 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 114.348 -1.297 . . . . 0.0 108.28 -179.586 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 55.1 p -103.76 -38.95 6.85 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -179.974 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.465 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 58.8 mtt85 -115.64 178.07 4.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 124.508 1.13 . . . . 0.0 110.4 179.905 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 94.7 p -89.43 -36.61 15.35 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 113.907 -1.497 . . . . 0.0 109.363 -179.759 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -65.69 -34.1 77.43 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 179.953 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.465 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 50.1 m170 -61.5 -61.77 2.29 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 179.587 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' A' ' 5' ' ' CYS . 50.1 tp -42.43 -54.97 3.61 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 124.025 0.828 . . . . 0.0 110.999 179.688 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -50.29 -63.66 1.05 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.801 179.701 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.1 m -41.57 -45.22 3.25 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 124.162 0.913 . . . . 0.0 110.333 179.928 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.437 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 36.9 t60 -63.4 -59.64 4.42 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.366 -1.743 . . . . 0.0 113.204 179.9 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.499 ' C ' ' H ' ' A' ' 24' ' ' THR . 25.0 m -52.71 -25.81 12.17 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 123.784 0.678 . . . . 0.0 112.192 -179.325 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -79.81 38.81 0.4 Allowed 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 122.578 1.18 . . . . 0.0 110.49 179.789 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.499 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.8 t -126.28 -27.44 3.21 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 179.23 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.416 ' H ' ' H ' ' A' ' 24' ' ' THR . 79.4 m-70 -86.0 -45.5 11.4 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 179.956 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.0 m -71.05 -56.51 6.0 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 113.92 -1.491 . . . . 0.0 107.539 -179.943 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.93 -52.01 0.82 Allowed Glycine 0 N--CA 1.49 2.251 0 CA-C-N 113.773 -1.558 . . . . 0.0 111.206 179.749 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 2.95 67.93 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.225 0 N-CA-C 118.085 2.624 . . . . 0.0 118.085 -179.862 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.4 mttm . . . . . 0 N--CA 1.509 2.485 0 CA-C-O 122.097 0.951 . . . . 0.0 109.876 179.92 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp . . . . . 0 N--CA 1.495 1.776 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -80.54 159.82 22.28 Favored 'Trans proline' 0 C--N 1.315 -1.207 0 C-N-CA 123.087 2.525 . . . . 0.0 114.317 -159.055 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.42 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 58.0 m-85 -134.45 154.88 51.17 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 112.027 -2.351 . . . . 0.0 105.888 179.652 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -142.61 154.92 44.84 Favored 'General case' 0 N--CA 1.501 2.101 0 C-N-CA 118.991 -1.084 . . . . 0.0 111.381 179.715 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 36.6 t -90.92 139.6 30.61 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 179.745 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -102.01 38.21 1.7 Allowed 'General case' 0 N--CA 1.5 2.075 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.478 -179.674 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 56.6 m -135.77 -45.93 0.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 113.808 -1.542 . . . . 0.0 110.302 -179.975 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 28.8 p -121.79 -20.25 6.49 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 124.124 0.89 . . . . 0.0 111.195 -179.601 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 13.3 mp0 75.57 57.73 0.06 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 125.406 1.691 . . . . 0.0 111.307 179.702 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -107.79 148.21 29.81 Favored 'General case' 0 N--CA 1.487 1.414 1 N-CA-C 100.104 -4.036 . . . . 0.0 100.104 179.394 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -112.01 157.18 21.03 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.378 -0.929 . . . . 0.0 110.907 -179.615 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -134.55 -177.51 4.64 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 113.634 -1.621 . . . . 0.0 109.512 -179.622 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 57.9 p -110.85 -34.1 6.34 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 124.631 1.207 . . . . 0.0 109.939 -179.965 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.434 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.9 mtt180 -118.02 -176.54 3.07 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.535 179.731 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.42 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 79.8 p -97.85 -25.31 15.07 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 114.278 -1.328 . . . . 0.0 107.963 -179.986 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 53.9 p30 -91.87 25.62 2.71 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.571 1.177 . . . . 0.0 108.862 179.94 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.434 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 33.1 m170 -122.14 -42.63 2.36 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 102.568 -3.123 . . . . 0.0 102.568 179.688 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -77.53 -50.78 11.89 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 113.353 -1.749 . . . . 0.0 109.705 179.877 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -72.05 5.72 2.55 Favored 'General case' 0 N--CA 1.502 2.139 0 CA-C-O 121.169 0.509 . . . . 0.0 112.136 -179.861 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 79.5 m -106.53 -43.78 4.65 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 102.896 -3.001 . . . . 0.0 102.896 179.582 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 54.4 t60 -60.35 -58.26 9.28 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.477 -1.692 . . . . 0.0 111.256 179.7 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 20.0 p -46.83 -18.87 0.08 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -179.639 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 mtp-105 -67.61 -8.6 35.82 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.239 -179.905 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.3 t -89.95 -7.24 54.54 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -110.47 -53.7 2.66 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 30.1 m -132.99 50.7 2.21 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 123.916 0.76 . . . . 0.0 110.962 -179.822 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -129.18 -3.62 5.24 Favored Glycine 0 N--CA 1.503 3.118 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.6 179.765 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -116.99 -38.92 3.31 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -179.942 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.54 ' H ' ' HD2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 CA-C-N 113.58 -1.646 . . . . 0.0 109.723 -179.97 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.1 mttm . . . . . 0 N--CA 1.496 1.84 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -93.5 165.66 2.32 Favored 'Trans proline' 0 C--N 1.318 -1.068 0 C-N-CA 122.546 2.164 . . . . 0.0 112.253 166.125 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.4 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 42.6 m-85 -126.93 163.39 23.77 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 113.653 -1.612 . . . . 0.0 106.907 179.671 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -133.05 149.48 52.17 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 123.711 0.632 . . . . 0.0 111.923 -179.778 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.6 t -99.59 139.85 34.65 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 179.444 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -106.46 40.99 1.51 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 122.416 1.103 . . . . 0.0 109.557 179.948 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 62.6 m -135.99 -39.02 0.7 Allowed 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 113.05 -1.886 . . . . 0.0 108.434 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.3 p -123.21 -43.09 2.22 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 119.135 -1.026 . . . . 0.0 108.871 -179.876 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.7 mm100 100.19 59.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 O-C-N 126.726 2.516 . . . . 0.0 108.94 179.831 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 ttt-85 -115.82 157.04 25.01 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 179.741 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -112.77 164.4 13.43 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.113 179.977 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.545 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 95.7 m-85 -139.2 -173.8 3.69 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.61 -2.087 . . . . 0.0 109.771 -179.893 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.1 p -106.72 -35.79 6.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 124.477 1.111 . . . . 0.0 110.187 -179.959 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.492 ' HB2' ' CG ' ' A' ' 17' ' ' HIS . 46.2 mtt85 -121.46 -179.71 4.17 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 123.808 0.692 . . . . 0.0 112.173 179.8 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.4 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 64.5 p -90.48 -40.05 12.24 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 114.47 -1.241 . . . . 0.0 107.886 -179.932 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.35 -33.21 74.76 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 104.682 -2.34 . . . . 0.0 104.682 179.786 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.492 ' CG ' ' HB2' ' A' ' 14' ' ' ARG . 49.7 m170 -66.61 -56.65 9.75 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 179.433 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.9 tp -46.02 -55.62 6.63 Favored 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.9 tttm -46.56 -59.44 3.0 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 122.049 0.14 . . . . 0.0 110.899 179.582 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.9 m -45.14 -44.65 10.84 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.616 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.545 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 61.1 t60 -67.42 -52.9 34.12 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 114.162 -1.381 . . . . 0.0 114.705 179.716 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.2 p -49.1 -39.8 29.56 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 118.908 0.776 . . . . 0.0 109.945 -179.602 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.5 mtt-85 -68.61 19.76 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 179.94 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.2 p -108.39 -6.99 15.96 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.223 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 61.3 m-70 -99.49 -39.61 8.26 Favored 'General case' 0 C--N 1.302 -1.481 1 N-CA-C 100.036 -4.061 . . . . 0.0 100.036 179.203 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 57.1 p 111.19 39.48 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.14 1 C-N-CA 133.068 4.547 . . . . 0.0 102.264 179.746 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 97.97 -56.87 1.1 Allowed Glycine 0 N--CA 1.486 2.004 1 N-CA-C 102.118 -4.393 . . . . 0.0 102.118 -179.303 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -128.04 148.18 50.54 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-N 112.657 -1.771 . . . . 0.0 109.495 179.797 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 122.466 1.127 . . . . 0.0 109.488 179.663 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 24.0 tptm . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 . . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 1' ' ' LYS . 3.0 Cg_exo -80.84 147.91 17.26 Favored 'Trans proline' 0 N--CA 1.491 1.334 0 C-N-CA 122.41 2.073 . . . . 0.0 113.26 177.195 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -128.92 157.37 41.79 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 113.283 -1.78 . . . . 0.0 107.025 179.596 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -139.95 154.61 47.24 Favored 'General case' 0 N--CA 1.5 2.075 0 C-N-CA 119.956 -0.698 . . . . 0.0 111.78 179.649 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.46 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 15.7 t -104.31 122.74 46.06 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 105.029 -2.212 . . . . 0.0 105.029 179.44 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -97.86 46.41 1.02 Allowed 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 122.999 1.38 . . . . 0.0 109.045 -179.851 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.46 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.4 m -129.3 -43.88 1.28 Allowed 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 111.77 -2.468 . . . . 0.0 105.682 179.693 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.4 p -122.49 -24.29 5.0 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.292 0.995 . . . . 0.0 112.166 -179.932 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.4 mm100 84.43 53.92 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 O-C-N 124.871 1.357 . . . . 0.0 108.66 179.866 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.473 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 17.7 ttm180 -113.97 156.38 24.15 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 104.496 -2.409 . . . . 0.0 104.496 179.968 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.512 ' HD3' ' H ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -120.75 161.54 21.27 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 119.073 -1.051 . . . . 0.0 111.488 -179.829 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.449 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 75.7 m-85 -136.68 179.29 6.46 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.316 -1.765 . . . . 0.0 110.442 -179.58 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.2 p -104.9 -30.33 9.9 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 124.907 1.38 . . . . 0.0 110.731 -179.847 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.537 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 65.6 mtt85 -124.09 177.79 5.64 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 123.992 0.808 . . . . 0.0 111.314 179.974 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 84.4 p -94.15 -35.28 12.59 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 114.288 -1.324 . . . . 0.0 108.43 179.996 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -65.44 -34.61 78.69 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 104.03 -2.581 . . . . 0.0 104.03 179.805 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.537 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 36.5 m170 -62.77 -64.0 1.05 Allowed 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.418 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.2 tp -42.59 -52.56 4.76 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 123.534 0.521 . . . . 0.0 110.927 179.515 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -50.84 -48.35 59.94 Favored 'General case' 0 N--CA 1.508 2.442 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 179.69 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 87.2 m -65.73 -37.53 86.64 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.236 179.738 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.473 ' CE1' ' HD2' ' A' ' 10' ' ' ARG . 68.9 t60 -62.95 -53.71 49.85 Favored 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.799 179.743 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.446 ' C ' ' H ' ' A' ' 24' ' ' THR . 25.1 p -61.02 -7.43 2.49 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.086 179.687 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.4 32.02 1.1 Allowed 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 105.555 -2.017 . . . . 0.0 105.555 179.858 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.446 ' H ' ' C ' ' A' ' 22' ' ' THR . 92.9 m -127.0 -27.37 3.02 Favored 'General case' 0 N--CA 1.491 1.625 0 CA-C-N 113.287 -1.779 . . . . 0.0 106.896 -179.947 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 -97.05 -48.83 5.24 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 114.715 -1.13 . . . . 0.0 111.79 -179.695 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 74.9 m -122.8 56.12 1.16 Allowed 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 -179.801 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -4.1 -67.09 0.0 OUTLIER Glycine 0 N--CA 1.497 2.742 0 CA-C-N 112.131 -2.304 . . . . 0.0 115.577 179.969 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -126.55 146.57 50.09 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.02 179.82 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.6 tttp . . . . . 0 N--CA 1.493 1.688 0 CA-C-N 114.29 -1.323 . . . . 0.0 108.459 179.756 . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.6 pttp . . . . . 0 N--CA 1.494 1.747 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -85.1 149.76 10.71 Favored 'Trans proline' 0 N--CA 1.49 1.306 0 C-N-CA 122.76 2.307 . . . . 0.0 113.935 -168.973 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -127.78 145.73 50.82 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-N 111.819 -2.446 . . . . 0.0 105.168 179.658 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -132.27 150.09 52.23 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.371 179.811 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.518 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 13.4 t -100.93 102.8 13.9 Favored 'General case' 0 C--N 1.305 -1.342 1 N-CA-C 99.989 -4.078 . . . . 0.0 99.989 179.533 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -87.88 39.58 0.9 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 -179.404 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.518 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 40.8 m -116.19 -42.34 3.06 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 104.49 -2.411 . . . . 0.0 104.49 179.713 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 28.9 p -124.68 -24.6 4.13 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 124.053 0.846 . . . . 0.0 111.172 179.89 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 3.9 mp0 86.44 59.21 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 126.548 1.939 . . . . 0.0 111.924 179.952 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -118.29 152.35 35.94 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 102.971 -2.974 . . . . 0.0 102.971 179.52 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.464 ' H ' ' HD2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -118.13 160.81 20.91 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 119.107 -1.037 . . . . 0.0 112.594 -179.681 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -139.98 175.77 9.31 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 112.818 -1.992 . . . . 0.0 107.512 -179.753 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.7 p -110.83 -19.89 12.67 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 124.219 0.949 . . . . 0.0 109.803 -179.862 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.3 mtp-105 -125.79 178.55 5.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 124.082 0.864 . . . . 0.0 109.193 179.838 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 89.1 p -94.89 -28.15 15.34 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 114.051 -1.432 . . . . 0.0 108.174 -179.978 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -84.15 14.31 4.37 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 121.78 0.8 . . . . 0.0 109.367 -179.949 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -114.96 -62.09 1.65 Allowed 'General case' 0 C--N 1.307 -1.252 1 N-CA-C 99.759 -4.163 . . . . 0.0 99.759 179.362 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.5 tp -44.24 -53.02 6.99 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.424 179.528 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -57.69 -66.78 0.41 Allowed 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 119.735 -0.786 . . . . 0.0 110.103 179.953 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.7 m -33.63 -47.9 0.25 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 124.649 1.218 . . . . 0.0 110.769 179.634 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -64.59 -58.5 6.17 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 112.909 -1.95 . . . . 0.0 113.043 179.727 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.517 ' C ' ' H ' ' A' ' 24' ' ' THR . 87.4 m -52.76 -20.35 3.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 123.782 0.676 . . . . 0.0 111.718 -179.376 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.508 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 4.8 mmp_? -82.32 38.68 0.56 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 122.422 1.106 . . . . 0.0 109.129 179.411 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.517 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.8 t -128.23 -10.03 5.28 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 104.887 -2.264 . . . . 0.0 104.887 179.36 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 57.4 m-70 -105.87 -46.51 4.1 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 103.698 -2.704 . . . . 0.0 103.698 179.894 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 96.8 m -86.43 -40.26 15.53 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 113.81 -1.541 . . . . 0.0 107.814 179.744 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -106.54 66.21 0.25 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 107.322 -2.311 . . . . 0.0 107.322 179.844 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -110.13 -55.68 2.42 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 114.144 -1.028 . . . . 0.0 108.32 -179.764 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.635 ' H ' ' HD3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.916 0 CA-C-N 113.808 -1.542 . . . . 0.0 110.455 179.971 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm . . . . . 0 N--CA 1.493 1.675 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -78.84 162.06 26.89 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 C-N-CA 123.479 2.786 . . . . 0.0 113.301 -165.918 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.563 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 76.0 m-85 -128.15 141.92 51.34 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 179.561 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -129.29 152.95 48.3 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 119.089 -1.044 . . . . 0.0 110.353 179.935 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 22.8 t -90.64 140.21 29.98 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 179.599 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -102.2 39.33 1.51 Allowed 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 122.049 0.928 . . . . 0.0 108.948 -179.805 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.5 m -133.27 -44.27 0.85 Allowed 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 113.419 -1.719 . . . . 0.0 110.2 179.913 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 27.0 p -118.65 -35.34 3.74 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 124.056 0.848 . . . . 0.0 110.407 -179.71 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 6.2 mp0 88.24 55.93 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.052 0 O-C-N 126.522 2.389 . . . . 0.0 109.458 179.845 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -107.74 151.22 25.98 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 100.706 -3.813 . . . . 0.0 100.706 179.466 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -116.33 159.79 21.42 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 118.743 -1.183 . . . . 0.0 110.428 -179.559 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.4 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 75.7 m-85 -133.71 -177.06 4.38 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.842 -1.526 . . . . 0.0 110.253 -179.653 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.5 p -98.35 -41.29 7.9 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.023 -179.814 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.51 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.0 mtt85 -117.56 179.41 4.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 124.395 1.06 . . . . 0.0 111.093 179.877 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.563 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 88.6 p -91.73 -36.21 13.71 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.391 -179.974 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 41.8 p-10 -68.74 -24.71 64.49 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.902 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.51 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 48.3 m170 -71.34 -58.96 3.04 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 179.665 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -48.06 -46.27 33.27 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 121.449 0.642 . . . . 0.0 109.907 179.489 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -54.85 -52.67 62.05 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.887 -0.508 . . . . 0.0 110.453 179.603 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 84.9 m -56.17 -42.09 76.53 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.698 -0.801 . . . . 0.0 108.845 179.609 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.4 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 62.4 t60 -58.12 -61.79 2.29 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.885 179.912 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.418 ' C ' ' H ' ' A' ' 24' ' ' THR . 13.3 p -42.3 -27.15 0.13 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.675 1.19 . . . . 0.0 112.052 -179.649 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -85.61 43.48 1.03 Allowed 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 123.257 1.503 . . . . 0.0 110.158 179.708 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.418 ' H ' ' C ' ' A' ' 22' ' ' THR . 12.4 t -126.47 -26.83 3.24 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 111.936 -2.393 . . . . 0.0 105.044 179.637 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -100.32 -46.89 5.12 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 105.48 -2.045 . . . . 0.0 105.48 179.89 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.1 p -109.29 56.2 0.62 Allowed 'General case' 0 N--CA 1.497 1.896 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.252 -179.89 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -109.76 60.37 0.33 Allowed Glycine 0 N--CA 1.499 2.86 0 N-CA-C 109.074 -1.611 . . . . 0.0 109.074 -179.91 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -26.7 149.07 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 119.734 3.235 . . . . 0.0 119.734 -179.959 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 pttp . . . . . 0 N--CA 1.502 2.132 0 CA-C-N 112.104 -2.316 . . . . 0.0 116.007 179.471 . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 27.6 tptp . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.6 OUTLIER -30.23 142.98 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.778 0 C-N-CA 125.289 3.993 . . . . 0.0 117.594 -165.185 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.474 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 77.6 m-85 -123.42 162.76 22.18 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.285 -2.234 . . . . 0.0 108.843 -179.795 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -142.74 156.72 45.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 123.914 0.759 . . . . 0.0 110.093 179.576 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.486 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 29.4 t -100.49 125.69 46.84 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 179.617 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.683 ' H ' ' HD2' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -97.83 40.58 1.16 Allowed 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 122.492 1.139 . . . . 0.0 108.629 -179.846 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.486 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 23.4 m -127.25 -42.48 1.69 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 112.671 -2.059 . . . . 0.0 107.662 179.836 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 31.4 p -122.61 -39.91 2.5 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 123.788 0.68 . . . . 0.0 109.833 179.986 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.507 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 1.8 mp0 99.78 58.12 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 126.722 2.514 . . . . 0.0 111.538 179.781 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.8 ttt85 -112.72 158.11 20.46 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 103.188 -2.893 . . . . 0.0 103.188 179.437 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -117.04 160.62 20.69 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 119.472 -0.891 . . . . 0.0 112.39 -179.668 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.434 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 84.3 m-85 -137.9 176.04 9.05 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 113.841 -1.527 . . . . 0.0 107.314 -179.935 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.0 p -120.59 -22.56 6.34 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 116.64 2.089 . . . . 0.0 116.64 -179.495 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.409 ' HD3' ' NE2' ' A' ' 17' ' ' HIS . 40.0 mtp180 -101.48 -54.6 2.72 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 -179.071 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 95.0 p 130.23 -40.41 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 128.551 2.74 . . . . 0.0 108.364 -179.879 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -63.27 -33.85 76.39 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 103.75 -2.685 . . . . 0.0 103.75 179.688 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.409 ' NE2' ' HD3' ' A' ' 14' ' ' ARG . 42.6 m170 -58.26 -60.88 3.08 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 104.524 -2.399 . . . . 0.0 104.524 179.348 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.1 tp -45.43 -56.61 4.82 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.086 179.577 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -49.79 -56.61 9.68 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 179.871 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.1 m -51.08 -44.95 61.29 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 122.019 0.914 . . . . 0.0 109.117 179.64 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.434 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 70.9 t60 -63.1 -47.28 83.5 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-N 113.769 -1.56 . . . . 0.0 112.656 -179.886 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 p -67.56 -11.27 57.66 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.351 -0.843 . . . . 0.0 110.993 179.773 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 50.4 mmt-85 -106.07 45.14 0.99 Allowed 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 179.353 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 89.8 m -127.79 -46.69 1.41 Allowed 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 110.299 -3.137 . . . . 0.0 102.674 179.759 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -71.6 -29.5 64.76 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 104.4 -2.444 . . . . 0.0 104.4 179.562 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 25.0 m -96.12 -51.97 4.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 105.186 -2.153 . . . . 0.0 105.186 179.781 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.39 -61.0 0.42 Allowed Glycine 0 N--CA 1.492 2.382 0 N-CA-C 107.903 -2.079 . . . . 0.0 107.903 179.821 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -7.71 73.56 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 -179.962 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.1 mttp . . . . . 0 N--CA 1.498 1.962 0 CA-C-N 114.076 -1.42 . . . . 0.0 108.167 179.745 . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -54.26 166.07 1.87 Allowed 'Trans proline' 0 N--CA 1.499 1.805 0 C-N-CA 123.47 2.78 . . . . 0.0 114.324 -177.079 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 79.9 m-85 -116.79 104.18 11.08 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 112.976 -1.92 . . . . 0.0 107.529 -179.934 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.414 ' HA ' ' HA ' ' A' ' 11' ' ' LYS . 8.6 tt0 -102.65 159.66 15.26 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 122.871 1.319 . . . . 0.0 113.635 -179.444 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.521 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 26.3 t -105.0 109.32 21.28 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 111.569 -2.56 . . . . 0.0 105.119 -179.989 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -94.83 48.43 1.19 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 123.386 1.565 . . . . 0.0 107.165 -179.812 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.521 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 23.8 m -123.45 -41.62 2.27 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 102.735 -3.061 . . . . 0.0 102.735 179.591 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.6 p -123.49 -35.7 2.89 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 124.187 0.929 . . . . 0.0 111.593 179.797 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 28.0 mm100 100.52 57.11 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.576 0 O-C-N 126.055 2.097 . . . . 0.0 109.011 -179.916 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.471 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 22.1 ttt180 -119.28 144.92 46.53 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 179.978 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 4' ' ' GLN . 63.8 pttt -111.86 165.87 11.7 Favored 'General case' 0 N--CA 1.502 2.158 0 C-N-CA 119.189 -1.005 . . . . 0.0 111.274 -179.777 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -139.35 176.15 8.96 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 124.22 0.95 . . . . 0.0 111.162 -179.563 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.0 p -97.34 -36.47 10.38 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 125.409 1.693 . . . . 0.0 109.785 -179.751 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.559 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 59.1 mtt85 -114.32 174.02 6.16 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 124.377 1.048 . . . . 0.0 109.871 179.858 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.49 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 97.7 p -102.15 11.36 38.43 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.726 -179.978 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.04 -32.53 6.01 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 105.497 -2.038 . . . . 0.0 105.497 179.607 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.559 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.7 m170 -67.97 -28.14 67.19 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 179.373 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.5 tp -76.69 -48.13 19.86 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 114.264 -1.334 . . . . 0.0 108.542 179.837 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -52.92 -62.92 1.34 Allowed 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.5 m -43.49 -43.26 5.3 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 124.716 1.26 . . . . 0.0 110.665 179.887 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.471 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 56.1 t60 -64.37 -56.53 13.76 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 113.712 -1.585 . . . . 0.0 114.23 179.992 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.471 ' C ' ' H ' ' A' ' 24' ' ' THR . 33.8 m -58.37 -10.91 2.33 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 112.297 0.481 . . . . 0.0 112.297 -179.446 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.424 ' HA ' HH11 ' A' ' 23' ' ' ARG . 15.9 mmm180 -90.2 38.8 0.94 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 179.537 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.471 ' H ' ' C ' ' A' ' 22' ' ' THR . 87.7 m -131.03 -13.65 3.54 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-N 111.831 -2.44 . . . . 0.0 105.538 179.72 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 -104.81 -44.13 4.92 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 104.323 -2.473 . . . . 0.0 104.323 179.744 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.5 m -93.79 -33.87 13.41 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-N 113.007 -1.906 . . . . 0.0 108.15 179.899 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -110.27 57.4 0.43 Allowed Glycine 0 N--CA 1.493 2.496 0 O-C-N 124.75 1.281 . . . . 0.0 111.746 -179.843 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.99 168.45 10.28 Favored 'General case' 0 C--N 1.308 -1.231 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.707 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.969 0 CA-C-O 122.317 1.056 . . . . 0.0 111.322 -179.863 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo . . . . . 0 N--CA 1.493 1.462 0 CA-C-O 121.659 0.608 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -124.46 156.9 36.42 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 113.378 -1.737 . . . . 0.0 108.551 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 71.8 tp60 -133.42 145.19 50.05 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 124.572 1.17 . . . . 0.0 108.481 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.475 ' HA ' HD11 ' A' ' 18' ' ' LEU . 41.6 t -91.29 133.12 35.68 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 104.25 -2.5 . . . . 0.0 104.25 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.402 ' HZ2' ' HB2' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -101.52 34.87 2.45 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 124.412 1.07 . . . . 0.0 108.226 -179.649 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -128.33 -40.74 1.61 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 113.744 -1.571 . . . . 0.0 109.058 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.4 p -123.37 -41.85 2.27 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.482 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 102.39 64.43 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.16 0 O-C-N 126.452 2.345 . . . . 0.0 109.951 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -120.85 152.75 38.02 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 103.578 -2.749 . . . . 0.0 103.578 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -111.91 163.23 14.46 Favored 'General case' 0 N--CA 1.503 2.176 0 C-N-CA 118.668 -1.213 . . . . 0.0 112.382 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.46 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 92.9 m-85 -142.12 176.86 8.64 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 125.079 1.487 . . . . 0.0 109.079 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.8 p -107.52 -25.76 11.23 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 124.373 1.046 . . . . 0.0 111.273 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.569 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 64.6 mtt85 -123.94 164.67 18.83 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 123.88 0.737 . . . . 0.0 110.24 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.9 p -78.59 -33.63 47.41 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -70.66 -32.82 70.24 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 106.411 -1.699 . . . . 0.0 106.411 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.569 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 29.7 m170 -66.16 -62.16 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 105.532 -2.025 . . . . 0.0 105.532 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.475 HD11 ' HA ' ' A' ' 5' ' ' CYS . 43.5 tp -40.53 -56.18 2.13 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 124.34 1.025 . . . . 0.0 110.416 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -51.16 -64.85 0.68 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.247 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.1 m -41.96 -42.53 2.83 Favored 'General case' 0 N--CA 1.504 2.258 0 CA-C-O 121.734 0.778 . . . . 0.0 111.138 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.46 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 40.5 t60 -67.99 -58.01 5.23 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 113.648 -1.615 . . . . 0.0 113.748 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.425 ' C ' ' H ' ' A' ' 24' ' ' THR . 11.9 m -52.1 -38.51 57.55 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.172 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -71.6 24.31 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 117.804 -1.558 . . . . 0.0 114.563 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.425 ' H ' ' C ' ' A' ' 22' ' ' THR . 5.2 t -113.48 -3.72 13.66 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 . . . . . 0 N--CA 1.49 1.574 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.489 179.95 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo . . . . . 0 N--CA 1.48 0.692 0 CA-C-O 122.083 0.785 . . . . 0.0 111.598 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -123.49 160.99 25.75 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 112.805 -1.998 . . . . 0.0 106.355 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -137.31 153.03 50.36 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.507 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.406 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 36.0 t -97.69 133.8 41.73 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.423 ' HA ' HE22 ' A' ' 9' ' ' GLN . 95.9 mttt -99.19 38.55 1.39 Allowed 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.406 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 39.4 m -131.78 -42.62 1.01 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 113.858 -1.519 . . . . 0.0 109.744 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.0 p -121.4 -26.66 4.96 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 123.872 0.732 . . . . 0.0 111.139 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.423 HE22 ' HA ' ' A' ' 6' ' ' LYS . 91.2 mm-40 85.17 51.04 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.198 0 O-C-N 125.36 1.663 . . . . 0.0 109.8 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.9 ttt-85 -110.49 156.71 20.49 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 103.189 -2.893 . . . . 0.0 103.189 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -119.13 163.56 16.85 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 119.074 -1.05 . . . . 0.0 112.389 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.441 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 86.5 m-85 -137.65 -174.95 3.91 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 113.793 -1.549 . . . . 0.0 110.054 -179.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.8 p -106.47 -41.84 5.18 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 124.419 1.075 . . . . 0.0 111.559 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.535 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 7.7 mtt180 -113.47 175.96 5.23 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 124.18 0.925 . . . . 0.0 110.114 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.7 p -87.82 -38.28 15.84 Favored 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.036 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -66.57 -29.89 70.06 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.535 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 49.4 m170 -65.07 -59.03 4.57 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.9 tp -45.25 -53.47 8.28 Favored 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -48.68 -61.21 2.15 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.1 m -43.57 -43.76 5.78 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.441 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 72.5 t60 -66.46 -53.32 36.71 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 114.884 -1.053 . . . . 0.0 113.015 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 82.8 p -44.0 -28.93 0.52 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 119.682 1.128 . . . . 0.0 110.604 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.442 ' N ' ' HD2' ' A' ' 23' ' ' ARG . 2.1 mpt_? -80.91 44.9 0.78 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 122.958 1.361 . . . . 0.0 113.715 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.419 ' H ' ' H ' ' A' ' 25' ' ' HIS . 29.8 p -131.3 -26.28 2.11 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.419 ' H ' ' H ' ' A' ' 24' ' ' THR . 63.3 m-70 . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 103.774 -2.676 . . . . 0.0 103.774 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo . . . . . 0 N--CA 1.489 1.25 0 N-CA-C 109.72 -0.916 . . . . 0.0 109.72 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.484 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 93.9 m-85 -114.76 143.59 44.83 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 101.908 -3.367 . . . . 0.0 101.908 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.408 HE21 ' H ' ' A' ' 5' ' ' CYS . 55.1 tp60 -128.54 154.89 45.69 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 119.837 -0.745 . . . . 0.0 111.35 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.447 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 8.2 t -101.02 136.44 40.86 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 103.572 -2.751 . . . . 0.0 103.572 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.9 mmmm -100.55 41.48 1.17 Allowed 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 122.163 0.982 . . . . 0.0 109.253 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.518 HG21 ' CG ' ' A' ' 25' ' ' HIS . 46.0 m -135.92 -48.38 0.67 Allowed 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.138 -1.846 . . . . 0.0 110.262 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 32.0 p -123.64 -16.81 6.62 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 124.257 0.973 . . . . 0.0 110.006 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 69.7 64.31 0.25 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 124.059 1.885 . . . . 0.0 109.764 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.447 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 28.5 ttt180 -116.1 120.06 37.82 Favored 'General case' 0 C--N 1.304 -1.386 1 N-CA-C 100.019 -4.067 . . . . 0.0 100.019 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.6 ' H ' ' HD2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -93.71 165.49 12.68 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 118.959 -1.096 . . . . 0.0 111.014 -179.662 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -136.48 174.29 10.77 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 113.628 -1.624 . . . . 0.0 109.737 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.4 p -96.85 -39.26 9.5 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 124.926 1.391 . . . . 0.0 107.896 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.469 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 5.5 mtt-85 -111.5 -179.18 3.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 124.921 1.388 . . . . 0.0 108.357 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.484 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 91.4 p -99.28 -21.92 15.84 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.871 -1.513 . . . . 0.0 107.843 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -91.39 26.85 2.12 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 122.419 1.104 . . . . 0.0 108.388 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.469 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 49.1 m170 -125.36 -40.18 2.13 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.6 tp -75.13 -52.0 12.06 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 106.387 -1.709 . . . . 0.0 106.387 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -68.34 -15.75 63.68 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.259 0.349 . . . . 0.0 110.363 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 84.8 m -95.82 -9.01 32.69 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 43.2 t60 -97.35 -55.72 2.75 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.17 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.473 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.3 p -44.02 -21.13 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.081 1.353 . . . . 0.0 113.542 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 20.7 ptt85 -77.07 27.2 0.14 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 124.089 0.868 . . . . 0.0 111.518 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.473 ' H ' ' C ' ' A' ' 22' ' ' THR . 8.9 t -117.08 -22.39 8.42 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.518 ' CG ' HG21 ' A' ' 7' ' ' THR . 66.0 m-70 . . . . . 0 N--CA 1.489 1.516 0 CA-C-N 113.882 -1.508 . . . . 0.0 107.525 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo . . . . . 0 N--CA 1.489 1.226 0 CA-C-O 121.853 0.689 . . . . 0.0 111.857 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.441 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 51.0 m-85 -132.0 112.29 12.26 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 112.458 -2.155 . . . . 0.0 106.386 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -108.39 157.49 18.36 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.469 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 38.0 t -97.07 112.82 24.42 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 103.753 -2.684 . . . . 0.0 103.753 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.433 ' HA ' HE22 ' A' ' 9' ' ' GLN . 0.0 OUTLIER -87.1 29.42 0.83 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 124.472 1.108 . . . . 0.0 109.513 -179.619 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.469 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.7 m -115.34 -41.9 3.23 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 113.597 -1.638 . . . . 0.0 108.518 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.9 p -119.27 -34.62 3.79 Favored 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.592 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.433 HE22 ' HA ' ' A' ' 6' ' ' LYS . 88.0 mm-40 97.2 58.66 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.347 0 O-C-N 126.096 2.122 . . . . 0.0 109.978 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.456 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 48.3 ttt180 -118.94 146.54 44.88 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -112.91 162.51 15.74 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.588 -0.845 . . . . 0.0 112.45 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -138.94 179.61 6.39 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-N 113.219 -1.81 . . . . 0.0 109.51 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 88.6 p -102.44 -33.82 9.39 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 124.379 1.049 . . . . 0.0 108.969 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.544 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.0 mtt85 -119.41 171.66 8.17 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.587 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.441 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 94.3 p -85.16 -35.38 21.74 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.71 -39.77 94.21 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 104.209 -2.515 . . . . 0.0 104.209 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.544 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 37.7 m170 -56.39 -60.15 3.94 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.7 tp -42.82 -56.4 3.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 124.109 0.881 . . . . 0.0 109.74 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -48.57 -60.98 2.27 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.441 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.4 m -41.0 -46.09 2.76 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.712 0.768 . . . . 0.0 110.62 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.456 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 57.2 t60 -66.94 -55.36 14.94 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.668 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.2 p -45.51 -25.64 0.47 Allowed 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 48.8 mtt180 -52.87 -18.05 1.71 Allowed 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.0 t -87.02 -4.68 59.19 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 . . . . . 0 N--CA 1.494 1.727 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.987 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo . . . . . 0 N--CA 1.491 1.36 0 CA-C-O 121.637 0.599 . . . . 0.0 111.327 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.467 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 88.6 m-85 -122.46 152.61 40.1 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 105.176 -2.157 . . . . 0.0 105.176 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -140.2 154.17 46.83 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.496 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.517 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 40.2 t -98.44 117.23 32.38 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -92.26 37.56 0.99 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.517 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 57.2 m -123.39 -43.9 2.16 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 113.339 -1.755 . . . . 0.0 107.31 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 p -118.33 -36.86 3.45 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 123.921 0.763 . . . . 0.0 111.019 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 99.41 55.77 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 126.269 2.23 . . . . 0.0 109.079 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.0 157.42 18.69 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 103.225 -2.88 . . . . 0.0 103.225 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -120.34 158.47 27.05 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.812 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -138.31 171.53 14.25 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.888 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.4 p -96.67 -36.73 10.6 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.108 -1.86 . . . . 0.0 108.273 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.565 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 60.5 mtt85 -116.1 175.99 5.3 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 124.708 1.255 . . . . 0.0 110.96 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.467 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 90.1 p -95.38 -34.25 12.19 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 113.474 -1.694 . . . . 0.0 106.542 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.78 -38.28 90.44 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 104.659 -2.349 . . . . 0.0 104.659 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.565 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 31.5 m170 -59.94 -58.62 7.77 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.6 tp -44.6 -55.52 5.12 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.747 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -51.05 -58.8 5.16 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.193 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.9 m -43.86 -46.17 7.8 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 121.822 0.82 . . . . 0.0 110.159 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -64.32 -56.55 13.7 Favored 'General case' 0 N--CA 1.488 1.438 0 CA-C-N 113.182 -1.827 . . . . 0.0 114.046 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.419 ' C ' ' H ' ' A' ' 24' ' ' THR . 37.9 p -44.07 -30.68 0.78 Allowed 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.253 0.621 . . . . 0.0 110.414 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.04 39.43 0.37 Allowed 'General case' 0 N--CA 1.487 1.42 0 CA-C-N 114.112 -1.404 . . . . 0.0 111.319 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.419 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.5 t -124.37 -27.17 3.81 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 104.687 -2.338 . . . . 0.0 104.687 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.403 ' H ' ' H ' ' A' ' 24' ' ' THR . 70.9 m-70 . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 103.363 -2.828 . . . . 0.0 103.363 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 N--CA 1.492 1.405 0 N-CA-C 110.325 -0.683 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.535 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 81.1 m-85 -127.72 159.45 34.72 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 114.011 -1.449 . . . . 0.0 109.228 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -134.82 151.64 51.1 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 119.545 -0.862 . . . . 0.0 113.282 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 40.8 t -94.73 133.1 38.77 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 113.337 -1.756 . . . . 0.0 106.448 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.442 ' HA ' HE22 ' A' ' 9' ' ' GLN . 14.4 mmmm -100.05 40.36 1.25 Allowed 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.422 HG21 ' CG ' ' A' ' 25' ' ' HIS . 53.3 m -134.84 -47.12 0.73 Allowed 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 113.026 -1.897 . . . . 0.0 108.453 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.447 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 29.9 p -125.33 4.15 7.75 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 123.891 0.744 . . . . 0.0 111.461 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.442 HE22 ' HA ' ' A' ' 6' ' ' LYS . 87.0 mm-40 53.54 52.78 12.65 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 122.752 1.263 . . . . 0.0 110.328 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.447 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 19.4 ttt180 -105.34 154.39 20.35 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 102.666 -3.087 . . . . 0.0 102.666 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -116.93 158.87 23.34 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.903 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -135.91 -176.07 4.18 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 123.723 0.64 . . . . 0.0 110.075 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.5 p -103.09 -41.13 6.19 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 124.67 1.231 . . . . 0.0 110.255 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.498 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 28.7 mtt180 -114.89 163.83 14.99 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 124.169 0.918 . . . . 0.0 109.942 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.535 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 88.4 p -78.5 -33.65 47.98 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -69.49 -35.03 75.17 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 105.64 -1.985 . . . . 0.0 105.64 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.498 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 33.7 m170 -63.06 -59.01 5.37 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.7 tp -42.88 -53.94 4.43 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.857 0.723 . . . . 0.0 109.667 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -53.79 -57.64 10.15 Favored 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 119.875 -0.73 . . . . 0.0 111.468 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.0 m -41.34 -46.46 3.3 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 121.795 0.807 . . . . 0.0 110.142 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.1 t60 -65.49 -56.7 10.93 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 112.974 -1.921 . . . . 0.0 113.507 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.427 ' C ' ' H ' ' A' ' 24' ' ' THR . 45.4 p -52.26 -29.22 21.94 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.8 ttp180 -82.81 42.19 0.77 Allowed 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 123.032 1.396 . . . . 0.0 110.579 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.427 ' H ' ' C ' ' A' ' 22' ' ' THR . 5.9 t -131.52 -22.36 2.45 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 105.556 -2.016 . . . . 0.0 105.556 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.426 ' H ' ' H ' ' A' ' 24' ' ' THR . 78.3 m-70 . . . . . 0 N--CA 1.494 1.732 0 N-CA-C 104.832 -2.284 . . . . 0.0 104.832 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.498 1.789 0 N-CA-C 114.95 1.096 . . . . 0.0 114.95 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.435 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 85.8 m-85 -121.34 157.8 29.62 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 113.384 -1.735 . . . . 0.0 109.64 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.425 HE21 ' HA ' ' A' ' 9' ' ' GLN . 72.8 tp60 -130.73 145.12 51.86 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 124.297 0.998 . . . . 0.0 108.795 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.407 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 40.4 t -92.97 138.89 31.08 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.452 ' HA ' HE22 ' A' ' 9' ' ' GLN . 56.3 tttp -105.24 36.1 2.6 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.8 m -131.57 -38.18 1.17 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 114.476 -1.238 . . . . 0.0 109.3 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.3 p -125.25 -39.04 2.24 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.538 -0.865 . . . . 0.0 109.406 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.452 HE22 ' HA ' ' A' ' 6' ' ' LYS . 90.6 mm-40 98.33 60.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 126.587 2.429 . . . . 0.0 109.81 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.407 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 39.2 ttt-85 -112.51 159.43 18.79 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 103.503 -2.777 . . . . 0.0 103.503 179.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -115.91 158.18 23.39 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.167 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.482 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 93.9 m-85 -139.59 179.65 6.44 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 124.157 0.911 . . . . 0.0 110.051 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.9 p -107.33 -39.75 5.58 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 124.735 1.272 . . . . 0.0 110.313 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.38 171.11 7.71 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.435 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 65.4 p -84.73 -40.16 17.64 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -62.75 -29.71 70.89 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -66.34 -60.84 2.39 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.8 tp -43.6 -47.25 7.46 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 123.752 0.658 . . . . 0.0 111.365 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -58.05 -67.24 0.36 Allowed 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 119.685 -0.806 . . . . 0.0 109.624 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.2 m -35.39 -48.02 0.46 Allowed 'General case' 0 N--CA 1.504 2.231 0 O-C-N 124.641 1.213 . . . . 0.0 110.325 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.482 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 30.1 t60 -57.42 -61.17 2.68 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.654 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.473 ' C ' ' H ' ' A' ' 24' ' ' THR . 56.9 m -52.9 -12.74 0.35 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 124.255 0.972 . . . . 0.0 111.913 -179.648 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -90.46 40.29 1.01 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 123.373 1.559 . . . . 0.0 107.035 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.473 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.3 t -126.09 -26.11 3.45 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 103.585 -2.746 . . . . 0.0 103.585 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 105.287 -2.116 . . . . 0.0 105.287 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo . . . . . 0 N--CA 1.493 1.476 0 CA-C-O 121.88 0.7 . . . . 0.0 113.148 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 88.8 m-85 -131.31 162.24 30.52 Favored 'General case' 0 N--CA 1.499 2.0 0 CA-C-N 113.013 -1.903 . . . . 0.0 108.937 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.509 HE21 ' NZ ' ' A' ' 11' ' ' LYS . 50.8 tt0 -139.99 152.45 46.3 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.975 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.432 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 35.7 t -99.56 129.71 45.74 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 105.955 -1.868 . . . . 0.0 105.955 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -99.18 34.31 2.18 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 122.011 0.91 . . . . 0.0 109.445 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.432 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 53.5 m -123.17 -39.7 2.46 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.42 -1.718 . . . . 0.0 107.871 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -124.02 -40.78 2.26 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.292 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 104.41 51.74 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.72 0 O-C-N 126.299 2.249 . . . . 0.0 110.799 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 40.9 ttt85 -110.94 148.87 31.57 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 104.592 -2.373 . . . . 0.0 104.592 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.509 ' NZ ' HE21 ' A' ' 4' ' ' GLN . 2.3 mptp? -112.6 165.16 12.51 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.159 -1.016 . . . . 0.0 110.095 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -138.26 178.5 7.09 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.683 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 38.7 p -101.9 -40.25 6.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 125.175 1.547 . . . . 0.0 109.514 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.19 175.37 5.5 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.304 1.003 . . . . 0.0 109.55 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.442 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 74.8 p -89.84 -34.77 16.0 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.298 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.1 p-10 -65.05 -30.75 71.74 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -62.6 -61.54 2.35 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 106.063 -1.829 . . . . 0.0 106.063 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.2 tp -44.75 -50.99 9.78 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 124.115 0.884 . . . . 0.0 109.655 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -53.47 -60.27 3.52 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.802 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -47.55 -42.33 23.3 Favored 'General case' 0 N--CA 1.5 2.07 0 CA-C-O 121.646 0.736 . . . . 0.0 110.626 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -65.41 -57.65 7.81 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 113.781 -1.554 . . . . 0.0 114.233 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.9 p -45.03 -39.2 5.45 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.602 0.761 . . . . 0.0 111.651 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -82.85 39.02 0.6 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 116.939 -1.905 . . . . 0.0 112.98 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.0 t -121.23 -5.92 9.41 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 . . . . . 0 N--CA 1.488 1.429 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 179.854 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 N--CA 1.483 0.902 0 CA-C-O 121.888 0.703 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.528 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 96.6 m-85 -120.72 160.27 23.66 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -147.22 160.61 42.27 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 117.773 -1.571 . . . . 0.0 111.959 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.411 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 43.2 t -93.68 142.41 27.38 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.8 ttpp -107.07 32.76 4.37 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 125.123 1.515 . . . . 0.0 107.606 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.411 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 57.9 m -127.57 -38.31 1.92 Allowed 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 114.514 -1.221 . . . . 0.0 109.378 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.6 p -122.42 -41.03 2.42 Favored 'General case' 0 N--CA 1.499 2.014 0 C-N-CA 119.861 -0.736 . . . . 0.0 111.193 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 101.58 52.36 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 O-C-N 126.53 2.394 . . . . 0.0 109.975 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.22 148.0 33.78 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 103.48 -2.785 . . . . 0.0 103.48 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -112.74 160.68 17.7 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 118.347 -1.341 . . . . 0.0 111.619 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.418 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 83.2 m-85 -131.34 178.89 6.37 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-N 112.615 -2.084 . . . . 0.0 111.131 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 p -103.24 -31.55 10.04 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 125.383 1.677 . . . . 0.0 112.171 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.9 mtp180 -116.5 179.12 4.09 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 124.637 1.211 . . . . 0.0 107.876 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.528 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 89.6 p -108.7 20.74 18.15 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.973 0.892 . . . . 0.0 110.695 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.93 -35.06 3.57 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 55.7 m170 -59.8 -54.25 48.4 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 103.483 -2.784 . . . . 0.0 103.483 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.407 HD11 ' HA ' ' A' ' 5' ' ' CYS . 63.9 tp -36.83 -55.12 0.91 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 113.267 -1.788 . . . . 0.0 111.561 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.9 tptt -60.28 -59.18 5.83 Favored 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 m -42.68 -31.19 0.44 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 124.511 1.132 . . . . 0.0 111.376 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.418 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 16.2 t60 -82.28 -56.75 3.72 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 113.415 -1.721 . . . . 0.0 112.633 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.433 ' C ' ' H ' ' A' ' 24' ' ' THR . 14.6 m -43.86 -31.53 0.87 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 124.132 0.895 . . . . 0.0 111.522 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.42 43.13 0.53 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 118.5 -1.28 . . . . 0.0 112.453 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.433 ' H ' ' C ' ' A' ' 22' ' ' THR . 8.7 t -120.77 -24.92 5.56 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 103.053 -2.943 . . . . 0.0 103.053 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.407 ' H ' ' H ' ' A' ' 24' ' ' THR . 68.9 m-70 . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 103.888 -2.634 . . . . 0.0 103.888 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.487 1.102 0 CA-C-O 121.897 0.707 . . . . 0.0 111.954 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -120.26 157.11 29.84 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 105.564 -2.013 . . . . 0.0 105.564 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.462 HE21 ' HA ' ' A' ' 9' ' ' GLN . 71.1 tp60 -135.8 148.09 48.59 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 120.122 -0.631 . . . . 0.0 112.35 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.469 ' HA ' HD11 ' A' ' 18' ' ' LEU . 16.7 t -99.15 133.67 43.11 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 101.936 -3.357 . . . . 0.0 101.936 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.532 ' HD3' ' N ' ' A' ' 6' ' ' LYS . 3.3 mppt? -105.9 35.27 2.96 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.247 0.967 . . . . 0.0 109.063 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.8 m -123.67 -40.86 2.29 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 113.158 -1.837 . . . . 0.0 106.699 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.423 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 24.8 p -130.2 -10.18 4.22 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 123.889 0.743 . . . . 0.0 111.196 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.462 ' HA ' HE21 ' A' ' 4' ' ' GLN . 17.6 mp0 67.65 60.87 0.45 Allowed 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 123.066 1.412 . . . . 0.0 111.018 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.423 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 21.0 ttt180 -116.13 145.1 43.33 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 102.04 -3.318 . . . . 0.0 102.04 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -107.77 162.33 14.09 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.865 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -140.74 -179.9 6.32 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.565 1.165 . . . . 0.0 110.158 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 64.6 p -102.75 -36.78 8.16 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.13 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.44 -176.9 3.32 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 124.307 1.004 . . . . 0.0 111.366 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 95.6 p -98.53 -37.01 9.73 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.488 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -61.02 -29.46 69.73 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -66.31 -67.89 0.41 Allowed 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.469 HD11 ' HA ' ' A' ' 5' ' ' CYS . 62.1 tp -38.62 -48.28 1.43 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 123.871 0.732 . . . . 0.0 112.373 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -53.82 -67.83 0.23 Allowed 'General case' 0 N--CA 1.499 2.0 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.882 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.2 m -46.71 -36.33 7.04 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 114.183 -1.372 . . . . 0.0 110.624 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 39.8 t60 -66.91 -60.2 2.85 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-N 114.77 -1.105 . . . . 0.0 112.03 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.5 m -50.7 -25.14 3.94 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 121.203 0.525 . . . . 0.0 112.407 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.446 ' HB3' ' NH2' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -58.69 -8.2 1.22 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.446 179.374 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 t -91.46 -3.83 56.2 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.069 0.462 . . . . 0.0 110.205 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 . . . . . 0 N--CA 1.492 1.658 0 CA-C-N 114.595 -1.184 . . . . 0.0 107.807 -179.88 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 N--CA 1.494 1.537 0 CA-C-O 122.192 0.83 . . . . 0.0 113.756 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -121.92 163.43 19.28 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 112.608 -2.087 . . . . 0.0 106.974 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 73.9 tp60 -136.62 146.96 46.63 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.908 0.755 . . . . 0.0 110.952 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.412 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 12.6 t -104.03 130.91 51.72 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 101.342 -3.577 . . . . 0.0 101.342 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -106.47 42.97 1.19 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 122.316 1.055 . . . . 0.0 108.817 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.412 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 94.7 m -126.71 -40.58 1.9 Allowed 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 p -121.4 -32.19 3.91 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 123.987 0.805 . . . . 0.0 108.845 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 89.35 55.83 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 126.25 2.219 . . . . 0.0 109.448 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 44.4 ttt-85 -115.36 154.66 28.79 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HD3' ' H ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -114.5 167.65 10.55 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 118.852 -1.139 . . . . 0.0 110.349 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.424 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 88.6 m-85 -139.93 -179.76 6.14 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 114.297 -1.319 . . . . 0.0 109.159 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.8 p -104.06 -44.89 4.88 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 124.475 1.11 . . . . 0.0 110.094 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.587 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 23.7 mtt180 -109.96 -176.33 2.97 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.437 1.085 . . . . 0.0 109.428 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.6 p -95.19 -29.93 14.28 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.008 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -76.65 -4.31 42.4 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.587 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 46.1 m170 -97.16 -10.3 26.19 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 124.973 1.421 . . . . 0.0 107.903 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.7 tp -106.46 -54.22 2.51 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.359 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -66.13 -2.08 3.84 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.5 m -105.55 -39.96 5.93 Favored 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 104.254 -2.498 . . . . 0.0 104.254 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.424 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 50.1 t60 -58.54 -57.16 14.19 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.455 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.435 ' C ' ' H ' ' A' ' 24' ' ' THR . 7.7 p -37.26 -40.86 0.36 Allowed 'General case' 0 C--N 1.308 -1.218 0 O-C-N 125.282 1.614 . . . . 0.0 111.55 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.7 mtt180 -76.93 37.97 0.2 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 125.117 1.511 . . . . 0.0 113.066 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.435 ' H ' ' C ' ' A' ' 22' ' ' THR . 11.2 t -115.96 -24.59 8.04 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 103.585 -2.746 . . . . 0.0 103.585 179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 . . . . . 0 C--N 1.308 -1.2 0 N-CA-C 100.705 -3.813 . . . . 0.0 100.705 179.358 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo . . . . . 0 N--CA 1.493 1.445 0 CA-C-O 121.836 0.682 . . . . 0.0 112.984 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.427 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 64.6 m-85 -124.32 163.47 21.63 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-N 113.087 -1.87 . . . . 0.0 108.066 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.0 tp60 -139.7 137.52 35.24 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.884 0.74 . . . . 0.0 109.486 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.462 ' HA ' HD11 ' A' ' 18' ' ' LEU . 44.0 t -84.4 144.21 28.94 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 179.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -105.87 32.57 4.27 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 124.743 1.277 . . . . 0.0 108.997 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 97.2 m -135.08 -39.51 0.76 Allowed 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 114.317 -1.31 . . . . 0.0 111.188 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.7 p -119.95 -45.71 2.46 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 119.465 -0.894 . . . . 0.0 109.475 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 103.48 61.51 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 126.942 2.651 . . . . 0.0 110.474 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.6 ttt85 -115.29 158.84 21.79 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 103.273 -2.862 . . . . 0.0 103.273 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.695 ' HB2' ' HZ3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -113.72 163.74 14.62 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 119.231 -0.988 . . . . 0.0 109.759 -179.767 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.488 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 99.2 m-85 -139.98 -179.41 5.94 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 124.553 1.158 . . . . 0.0 110.696 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.3 p -104.43 -37.18 7.29 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 113.637 -1.619 . . . . 0.0 110.57 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.18 -172.32 2.2 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 124.175 0.922 . . . . 0.0 110.567 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 80.2 p -97.4 -33.48 11.39 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -86.54 10.35 15.65 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.465 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -115.87 -18.18 10.81 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' A' ' 5' ' ' CYS . 36.2 tp -93.46 -57.51 2.57 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.374 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.421 ' NZ ' ' HB2' ' A' ' 19' ' ' LYS . 3.7 ttmp? -53.1 -64.19 0.9 Allowed 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.2 m -38.93 -43.65 0.98 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.257 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.488 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 22.0 t60 -69.68 -58.5 3.85 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 113.7 -1.591 . . . . 0.0 112.336 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.405 ' N ' ' CD2' ' A' ' 21' ' ' HIS . 21.8 m -45.78 -40.38 9.54 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 121.753 0.787 . . . . 0.0 110.356 -179.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.6 ttp85 -85.11 52.28 2.4 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-O 123.867 1.794 . . . . 0.0 111.865 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.9 t -137.01 -19.78 1.28 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 111.363 -2.653 . . . . 0.0 105.397 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 -179.898 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo . . . . . 0 N--CA 1.496 1.664 0 N-CA-C 116.227 1.587 . . . . 0.0 116.227 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 79.0 m-85 -128.66 158.89 37.28 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 112.688 -2.051 . . . . 0.0 107.492 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -142.76 155.81 44.9 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.73 0.776 . . . . 0.0 110.857 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.508 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 15.1 t -104.31 107.89 19.02 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 179.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.13 33.58 0.68 Allowed 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 122.514 1.15 . . . . 0.0 110.132 -179.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.508 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 35.0 m -112.71 -41.67 3.77 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 112.688 -2.051 . . . . 0.0 106.507 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 32.1 p -121.48 -29.34 4.44 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 124.041 0.838 . . . . 0.0 109.66 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.0 mp0 90.03 60.27 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 O-C-N 125.851 1.97 . . . . 0.0 110.831 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.4 ttt180 -121.05 151.68 39.52 Favored 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 104.627 -2.361 . . . . 0.0 104.627 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -116.28 161.14 19.45 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.417 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 90.3 m-85 -138.22 176.54 8.61 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 113.078 -1.874 . . . . 0.0 109.283 -179.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.7 p -102.71 -32.71 9.71 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 124.302 1.001 . . . . 0.0 110.573 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.4 ' CD ' ' CE1' ' A' ' 17' ' ' HIS . 32.7 mtp85 -116.54 176.3 5.17 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 124.484 1.115 . . . . 0.0 110.085 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 81.7 p -90.25 -36.58 14.65 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -66.16 -40.27 90.4 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 104.194 -2.521 . . . . 0.0 104.194 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.4 ' CE1' ' CD ' ' A' ' 14' ' ' ARG . 39.3 m170 -54.94 -58.92 5.66 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.2 tp -45.47 -52.82 9.7 Favored 'General case' 0 N--CA 1.502 2.132 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -52.54 -55.45 22.07 Favored 'General case' 0 N--CA 1.503 2.189 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.53 ' HA ' ' CZ ' ' A' ' 23' ' ' ARG . 52.9 m -42.94 -46.63 5.47 Favored 'General case' 0 N--CA 1.505 2.313 0 CA-C-O 121.612 0.72 . . . . 0.0 109.775 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.417 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 61.2 t60 -64.72 -56.81 11.37 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 113.359 -1.746 . . . . 0.0 114.588 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 48.7 p -43.77 -34.63 1.6 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.53 ' CZ ' ' HA ' ' A' ' 20' ' ' THR . 66.9 mtt85 -42.85 -23.62 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 179.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.2 t -95.29 19.6 10.48 Favored 'General case' 0 N--CA 1.512 2.631 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 31.2 m-70 . . . . . 0 N--CA 1.497 1.889 0 N-CA-C 104.226 -2.509 . . . . 0.0 104.226 179.297 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo . . . . . 0 N--CA 1.49 1.301 0 N-CA-C 110.32 -0.685 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.471 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 57.4 m-85 -123.67 161.25 25.47 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 113.577 -1.647 . . . . 0.0 107.631 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -130.43 149.27 52.18 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 124.188 0.93 . . . . 0.0 111.149 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.457 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 42.1 t -99.16 125.83 44.8 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 103.814 -2.661 . . . . 0.0 103.814 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -97.18 40.47 1.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 122.476 1.131 . . . . 0.0 108.644 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.457 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.7 m -131.6 -46.98 0.97 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 112.534 -2.121 . . . . 0.0 107.045 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 p -129.52 7.18 5.28 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 123.94 0.775 . . . . 0.0 112.731 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.6 mm-40 51.36 57.51 6.53 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-O 122.735 1.255 . . . . 0.0 111.765 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.413 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 21.5 ttt180 -118.08 140.94 49.03 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 103.123 -2.918 . . . . 0.0 103.123 179.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -105.52 165.97 10.77 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -179.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -140.76 -171.46 3.24 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 113.428 -1.715 . . . . 0.0 110.446 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.6 p -106.38 -39.17 5.98 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 124.438 1.086 . . . . 0.0 110.571 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.403 ' HB2' ' CG ' ' A' ' 17' ' ' HIS . 3.7 mtp-105 -119.09 179.94 4.01 Favored 'General case' 0 N--CA 1.5 2.071 0 CA-C-O 121.78 0.8 . . . . 0.0 109.77 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.471 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 80.3 p -94.08 -33.09 13.51 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -76.49 -3.39 37.06 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.403 ' CG ' ' HB2' ' A' ' 14' ' ' ARG . 41.3 m170 -95.9 -56.03 2.8 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 101.575 -3.491 . . . . 0.0 101.575 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.411 HD11 ' HA ' ' A' ' 5' ' ' CYS . 69.1 tp -46.47 -50.48 16.87 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -52.06 -64.72 0.72 Allowed 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.5 m -40.22 -43.61 1.72 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.329 0.585 . . . . 0.0 110.68 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 41.0 t60 -64.64 -59.36 4.37 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 114.103 -1.408 . . . . 0.0 112.33 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.8 p -45.35 -34.57 3.08 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -43.07 -25.01 0.09 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.1 t -92.38 9.57 33.61 Favored 'General case' 0 N--CA 1.511 2.586 0 N-CA-C 116.165 1.913 . . . . 0.0 116.165 -179.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.418 ' CG ' HG21 ' A' ' 7' ' ' THR . 27.5 m-70 . . . . . 0 N--CA 1.497 1.878 0 N-CA-C 104.55 -2.389 . . . . 0.0 104.55 179.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 N--CA 1.491 1.357 0 N-CA-C 109.481 -1.007 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.5 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 81.7 m-85 -120.56 155.17 34.24 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -141.0 154.96 46.27 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.19 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.7 t -92.55 140.81 29.18 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 114.149 -1.387 . . . . 0.0 107.806 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.615 ' HD3' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -100.38 29.1 4.55 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 114.759 -1.109 . . . . 0.0 109.851 -179.727 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.513 HG21 ' CG ' ' A' ' 25' ' ' HIS . 56.0 m -129.6 -43.0 1.27 Allowed 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 114.097 -1.41 . . . . 0.0 110.764 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.1 p -125.25 -0.83 7.68 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 119.568 -0.853 . . . . 0.0 110.027 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 54.35 60.37 3.61 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 122.948 1.356 . . . . 0.0 110.556 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -112.44 149.97 31.83 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 103.302 -2.851 . . . . 0.0 103.302 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -110.99 160.22 17.01 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 119.085 -1.046 . . . . 0.0 112.025 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -137.58 175.41 9.63 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 114.495 -1.229 . . . . 0.0 109.528 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.2 p -98.58 -40.81 8.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 124.708 1.255 . . . . 0.0 110.41 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.47 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 42.6 mtt180 -113.77 167.24 10.79 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 124.258 0.974 . . . . 0.0 110.09 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.5 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 84.3 p -81.64 -36.15 29.2 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -64.92 -30.72 71.73 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.47 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.7 m170 -66.97 -60.38 2.68 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 tp -43.29 -52.52 5.71 Favored 'General case' 0 N--CA 1.503 2.191 0 CA-C-O 121.303 0.573 . . . . 0.0 110.603 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -49.45 -65.4 0.57 Allowed 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.832 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 85.8 m -43.82 -44.74 7.0 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.853 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -58.71 -60.29 4.06 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.4 m -45.35 -21.9 0.11 Allowed 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 114.861 -1.063 . . . . 0.0 113.734 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.1 ptt-85 -50.12 -24.6 2.84 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.3 t -82.24 7.17 14.47 Favored 'General case' 0 N--CA 1.505 2.28 0 CA-C-O 121.45 0.643 . . . . 0.0 112.183 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.513 ' CG ' HG21 ' A' ' 7' ' ' THR . 59.8 m-70 . . . . . 0 N--CA 1.493 1.722 0 CA-C-N 114.198 -1.365 . . . . 0.0 109.958 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.486 1.05 0 CA-C-O 122.259 0.858 . . . . 0.0 112.053 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -125.66 155.78 40.3 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 112.238 -2.255 . . . . 0.0 106.19 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -136.2 152.08 50.4 Favored 'General case' 0 N--CA 1.499 1.975 0 C-N-CA 119.221 -0.992 . . . . 0.0 112.212 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.501 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 27.0 t -101.11 109.12 20.97 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.58 ' H ' ' HD2' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -88.06 39.68 0.91 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.501 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 27.6 m -122.76 -39.8 2.49 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 113.195 -1.82 . . . . 0.0 106.808 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.428 ' O ' ' CB ' ' A' ' 9' ' ' GLN . 31.4 p -125.21 -32.74 2.94 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.428 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 1.0 OUTLIER 93.72 57.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 126.358 2.286 . . . . 0.0 110.201 179.693 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.45 155.83 29.0 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -118.71 161.43 20.11 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.497 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 82.5 m-85 -137.94 -175.49 4.11 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.357 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.5 p -105.03 -37.51 6.92 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 124.24 0.963 . . . . 0.0 111.246 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.516 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 54.7 mtt85 -118.69 -175.7 2.94 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 123.804 0.69 . . . . 0.0 110.423 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 88.6 p -93.07 -33.51 14.05 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -76.51 3.21 11.8 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.516 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 39.1 m170 -103.04 -42.22 5.86 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.7 tp -65.56 -49.45 68.8 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.155 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -55.61 -64.43 0.85 Allowed 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 47.3 m -41.07 -38.42 1.02 Allowed 'General case' 0 N--CA 1.503 2.19 0 O-C-N 124.278 0.986 . . . . 0.0 111.968 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 46.5 t60 -73.36 -55.33 6.53 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.5 m -49.48 -23.34 1.52 Allowed 'General case' 0 N--CA 1.508 2.453 0 CA-C-O 120.931 0.396 . . . . 0.0 112.04 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -48.64 -26.95 2.52 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.098 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.0 p -79.66 5.48 13.14 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.92 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo . . . . . 0 N--CA 1.488 1.17 0 N-CA-C 107.521 -1.761 . . . . 0.0 107.521 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.427 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 38.8 m-85 -119.95 157.09 29.53 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -139.89 155.62 47.1 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.958 -0.697 . . . . 0.0 109.887 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.441 ' HA ' HD11 ' A' ' 18' ' ' LEU . 43.6 t -91.68 142.52 27.52 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.4 ' NZ ' ' HB3' ' A' ' 6' ' ' LYS . 3.8 mmmp? -104.71 38.4 1.91 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 115.107 -0.951 . . . . 0.0 108.999 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.8 m -136.14 -43.12 0.64 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 113.266 -1.788 . . . . 0.0 110.223 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.1 p -118.34 -40.83 2.89 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 124.123 0.89 . . . . 0.0 110.09 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 3.9 mp0 93.86 56.61 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.976 0 O-C-N 126.778 2.549 . . . . 0.0 110.57 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.531 ' NH1' ' CE1' ' A' ' 12' ' ' PHE . 41.2 ttt-85 -107.5 157.98 17.58 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 101.034 -3.691 . . . . 0.0 101.034 179.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.66 167.38 10.27 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 118.647 -1.221 . . . . 0.0 113.041 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.531 ' CE1' ' NH1' ' A' ' 10' ' ' ARG . 94.5 m-85 -144.96 177.03 9.04 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 113.612 -1.631 . . . . 0.0 108.12 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 81.8 p -104.61 -34.04 8.31 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.593 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 31.6 mtt180 -119.86 -173.86 2.63 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 113.744 -1.571 . . . . 0.0 111.697 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.427 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 38.3 p -95.71 -33.81 12.17 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.859 -1.519 . . . . 0.0 108.374 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -70.35 -35.18 73.41 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.593 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 36.7 m170 -64.74 -13.77 56.24 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 124.512 1.133 . . . . 0.0 110.742 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.441 HD11 ' HA ' ' A' ' 5' ' ' CYS . 51.5 tp -100.08 -50.8 3.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 123.973 0.796 . . . . 0.0 109.733 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.31 -32.35 64.54 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 119.799 -0.761 . . . . 0.0 112.009 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.0 m -74.63 -42.11 59.18 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.437 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 43.5 t60 -56.2 -58.15 9.17 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.405 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.0 p -42.16 -24.45 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.566 1.547 . . . . 0.0 113.795 -179.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.4 mtt85 -70.84 10.3 0.54 Allowed 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 114.627 -1.169 . . . . 0.0 111.358 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.405 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.3 t -106.95 -2.36 21.29 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.9 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo . . . . . 0 N--CA 1.495 1.579 0 CA-C-O 122.14 0.808 . . . . 0.0 114.078 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -127.31 153.08 46.62 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 112.586 -2.097 . . . . 0.0 106.883 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -130.21 139.46 50.81 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.465 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 44.8 t -91.35 105.12 17.55 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 101.537 -3.505 . . . . 0.0 101.537 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.1 pttt -90.34 42.95 1.12 Allowed 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 123.021 1.391 . . . . 0.0 108.29 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.465 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 26.1 m -124.34 -42.77 2.09 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 111.686 -2.506 . . . . 0.0 105.164 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 21.4 p -123.32 -35.98 2.88 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 123.838 0.711 . . . . 0.0 109.757 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.481 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 3.1 mp0 94.38 66.0 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 O-C-N 126.307 2.254 . . . . 0.0 111.711 179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.4 ttt85 -122.1 153.89 38.08 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 104.029 -2.582 . . . . 0.0 104.029 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -112.51 156.41 22.66 Favored 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 119.647 -0.821 . . . . 0.0 112.671 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -140.94 -179.55 6.14 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 113.919 -1.492 . . . . 0.0 108.417 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 56.3 p -108.28 -37.42 6.01 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 124.147 0.904 . . . . 0.0 110.139 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.512 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 52.9 mtt85 -118.92 179.09 4.25 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 124.606 1.191 . . . . 0.0 111.719 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.423 ' C ' ' H ' ' A' ' 17' ' ' HIS . 92.8 p -94.38 -29.01 15.22 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 113.283 -1.78 . . . . 0.0 107.134 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -83.26 13.52 4.2 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.512 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 35.9 m170 -113.34 -57.58 2.27 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 101.111 -3.662 . . . . 0.0 101.111 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.9 tp -47.65 -46.26 28.75 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -51.26 -65.69 0.51 Allowed 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.3 m -39.74 -46.05 1.83 Allowed 'General case' 0 N--CA 1.502 2.135 0 CA-C-O 121.793 0.806 . . . . 0.0 111.016 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.5 t60 -63.67 -55.47 23.21 Favored 'General case' 0 N--CA 1.495 1.786 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.495 ' C ' ' H ' ' A' ' 24' ' ' THR . 21.6 p -47.77 -16.19 0.07 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -179.534 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -75.01 23.16 0.1 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.542 -1.263 . . . . 0.0 111.68 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.495 ' H ' ' C ' ' A' ' 22' ' ' THR . 25.5 p -114.47 -14.37 12.15 Favored 'General case' 0 N--CA 1.498 1.928 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 . . . . . 0 N--CA 1.492 1.648 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 179.805 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.456 ' HB3' ' HZ3' ' A' ' 11' ' ' LYS . 38.5 Cg_exo . . . . . 0 N--CA 1.493 1.449 0 CA-C-O 122.153 0.814 . . . . 0.0 113.948 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.406 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 78.6 m-85 -121.79 153.24 38.57 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 112.577 -2.102 . . . . 0.0 106.548 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -135.41 152.94 51.89 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 119.574 -0.85 . . . . 0.0 109.298 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 28.9 t -91.79 146.66 23.59 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 114.656 -1.156 . . . . 0.0 108.57 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -105.48 36.89 2.36 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 121.905 0.859 . . . . 0.0 109.612 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.537 HG21 ' CG ' ' A' ' 25' ' ' HIS . 90.0 m -134.12 -45.15 0.78 Allowed 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 113.491 -1.686 . . . . 0.0 110.149 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 28.0 p -120.85 -24.34 5.69 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 124.218 0.949 . . . . 0.0 110.272 -179.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.415 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 11.7 mp0 75.79 56.69 0.06 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 125.308 1.63 . . . . 0.0 109.556 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.7 ttt85 -109.63 153.47 24.16 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 101.481 -3.526 . . . . 0.0 101.481 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HZ3' ' HB3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -114.67 163.79 14.95 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 118.708 -1.197 . . . . 0.0 112.624 -179.79 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.448 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 84.4 m-85 -138.17 177.83 7.58 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.801 -1.545 . . . . 0.0 108.01 -179.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 p -101.72 -35.14 9.18 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 124.042 0.839 . . . . 0.0 111.534 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.4 mtp-105 -118.14 179.13 4.19 Favored 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.406 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 85.5 p -89.38 -40.42 12.76 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -62.09 -22.85 66.13 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -75.11 -58.8 3.06 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 105.739 -1.948 . . . . 0.0 105.739 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.5 tp -43.98 -48.74 8.72 Favored 'General case' 0 N--CA 1.504 2.236 0 CA-C-O 121.312 0.577 . . . . 0.0 110.019 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -54.82 -59.49 4.65 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 73.1 m -45.43 -43.56 11.46 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-O 121.285 0.564 . . . . 0.0 110.649 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.448 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 68.1 t60 -63.3 -61.68 2.2 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 114.108 -1.405 . . . . 0.0 113.38 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.9 p -43.82 -31.91 0.94 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.456 ' CZ ' ' HA ' ' A' ' 23' ' ' ARG . 0.2 OUTLIER -44.35 -29.01 0.61 Allowed 'General case' 0 N--CA 1.489 1.48 0 CA-C-N 114.396 -1.275 . . . . 0.0 113.631 179.429 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.4 t -86.22 9.51 17.39 Favored 'General case' 0 N--CA 1.507 2.412 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -179.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.537 ' CG ' HG21 ' A' ' 7' ' ' THR . 39.8 m-70 . . . . . 0 N--CA 1.492 1.662 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo . . . . . 0 N--CA 1.49 1.285 0 N-CA-C 109.978 -0.816 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.461 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 70.8 m-85 -128.95 161.41 29.97 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-N 112.963 -1.926 . . . . 0.0 108.138 179.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -138.08 156.76 47.46 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 123.717 0.636 . . . . 0.0 111.017 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 44.3 t -97.34 136.04 38.37 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -100.89 36.93 1.83 Allowed 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 122.03 0.919 . . . . 0.0 109.191 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 59.6 m -131.72 -43.57 1.0 Allowed 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.594 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 29.7 p -118.98 -26.42 6.0 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 123.92 0.763 . . . . 0.0 110.188 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 9.9 mp0 78.87 56.68 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 125.359 1.662 . . . . 0.0 109.278 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.06 157.82 22.04 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 103.286 -2.857 . . . . 0.0 103.286 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -117.27 163.2 16.68 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 118.924 -1.11 . . . . 0.0 113.042 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.42 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 81.6 m-85 -140.01 -177.61 5.07 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 113.522 -1.672 . . . . 0.0 108.824 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.1 p -107.59 -24.02 11.92 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.188 0.93 . . . . 0.0 111.721 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.8 mtp180 -125.18 170.08 11.59 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 123.569 0.543 . . . . 0.0 110.182 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.461 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 82.8 p -96.93 15.79 21.27 Favored 'General case' 0 N--CA 1.503 2.182 0 CA-C-O 121.667 0.746 . . . . 0.0 110.066 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.76 -29.41 4.34 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -67.79 -50.74 55.29 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 100.223 -3.991 . . . . 0.0 100.223 179.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.9 tp -57.26 -46.17 83.32 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 113.873 -1.512 . . . . 0.0 109.144 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 ttmm -64.69 -9.81 22.55 Favored 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.4 m -99.31 -41.58 7.38 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 103.567 -2.753 . . . . 0.0 103.567 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.42 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 55.1 t60 -54.67 -57.66 10.58 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 113.975 -1.466 . . . . 0.0 111.27 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.481 ' C ' ' H ' ' A' ' 24' ' ' THR . 9.9 p -42.33 -24.56 0.05 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 125.426 1.49 . . . . 0.0 113.185 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.4 mtt180 -81.36 34.21 0.37 Allowed 'General case' 0 N--CA 1.486 1.37 0 O-C-N 124.459 1.1 . . . . 0.0 110.536 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.481 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.7 t -124.54 -10.47 7.38 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 . . . . . 0 N--CA 1.492 1.658 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.484 -179.906 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 N--CA 1.503 2.068 0 CA-C-O 122.202 0.834 . . . . 0.0 112.906 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.45 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 61.8 m-85 -122.41 164.02 18.77 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 113.695 -1.593 . . . . 0.0 109.367 -179.829 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -135.25 151.07 50.24 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 124.495 1.122 . . . . 0.0 108.334 179.458 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.487 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 42.9 t -98.99 130.57 45.34 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -102.37 40.34 1.37 Allowed 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 122.731 1.253 . . . . 0.0 108.856 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.487 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 32.8 m -126.69 -41.07 1.87 Allowed 'General case' 0 N--CA 1.485 1.325 0 CA-C-N 112.32 -2.218 . . . . 0.0 105.727 179.481 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.497 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 28.4 p -122.93 -44.95 2.17 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 123.904 0.752 . . . . 0.0 111.375 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 104.22 57.67 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 127.523 2.329 . . . . 0.0 107.794 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.497 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 33.2 ttt180 -112.48 162.66 15.36 Favored 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 179.796 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -122.44 159.83 26.77 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.598 -0.841 . . . . 0.0 112.423 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.1 m-85 -140.63 -173.89 3.82 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 124.405 1.065 . . . . 0.0 109.596 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.4 p -108.39 -40.26 5.19 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.575 -179.803 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.578 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.2 mtt180 -112.41 179.54 3.96 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 124.142 0.901 . . . . 0.0 110.112 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.45 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 87.7 p -100.38 0.56 40.16 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 114.411 -1.268 . . . . 0.0 107.658 179.791 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.424 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 1.4 p30 -112.03 7.86 19.94 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 179.485 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.578 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 39.5 m170 -114.44 -14.8 12.14 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.4 tp -92.27 -34.67 14.15 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 179.852 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.424 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 0.1 OUTLIER -80.2 -40.96 26.12 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.85 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.8 m -66.27 -8.78 26.94 Favored 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 179.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.543 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 13.0 t60 -98.34 -56.07 2.58 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.377 179.38 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 94.2 m -54.06 -17.81 3.03 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -179.458 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.8 ptt180 -66.34 4.78 0.66 Allowed 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 119.299 -0.96 . . . . 0.0 113.323 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 72.9 p -105.42 0.14 26.57 Favored 'General case' 0 N--CA 1.505 2.299 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.569 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 179.964 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.453 0 CA-C-O 121.712 0.63 . . . . 0.0 111.971 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -125.69 164.29 20.94 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 113.501 -1.681 . . . . 0.0 107.54 179.784 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.433 HE21 ' HA ' ' A' ' 9' ' ' GLN . 70.0 tp60 -135.27 152.08 51.17 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 123.818 0.699 . . . . 0.0 110.118 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.474 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 32.0 t -100.33 136.54 40.06 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 179.511 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -105.33 36.97 2.32 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 124.908 1.38 . . . . 0.0 108.25 -179.939 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.3 m -130.25 -42.23 1.22 Allowed 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 113.358 -1.747 . . . . 0.0 108.947 -179.948 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.9 p -120.28 -45.9 2.42 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.953 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.433 ' HA ' HE21 ' A' ' 4' ' ' GLN . 97.7 mm-40 105.55 60.75 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 126.983 2.677 . . . . 0.0 110.51 179.933 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.474 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 45.9 ttt-85 -114.16 154.45 27.82 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 102.878 -3.008 . . . . 0.0 102.878 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -111.29 163.44 13.95 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.299 -0.961 . . . . 0.0 110.421 -179.758 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.498 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 92.9 m-85 -141.24 -173.72 3.82 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 124.532 1.145 . . . . 0.0 109.639 -179.725 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.4 p -108.87 -38.86 5.49 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 124.604 1.19 . . . . 0.0 109.702 -179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.424 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 46.9 mtt180 -119.16 -176.95 3.23 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 124.102 0.876 . . . . 0.0 110.67 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 81.1 p -95.0 -36.97 11.35 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.182 -179.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -64.84 -33.97 77.27 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 104.036 -2.579 . . . . 0.0 104.036 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.424 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 47.6 m170 -59.83 -57.22 13.85 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 106.279 -1.749 . . . . 0.0 106.279 179.491 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.1 tp -47.03 -47.81 22.23 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.037 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.6 mttp -60.21 -50.66 72.8 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 118.354 -1.338 . . . . 0.0 110.834 179.473 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.5 m -47.59 -46.25 28.08 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 179.545 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.498 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 62.7 t60 -60.58 -56.44 21.29 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 113.221 -1.809 . . . . 0.0 114.406 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.485 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.1 p -50.46 -14.44 0.18 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -89.52 39.59 0.95 Allowed 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 179.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.485 ' H ' ' C ' ' A' ' 22' ' ' THR . 95.5 m -131.75 -11.72 3.42 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 112.487 -2.142 . . . . 0.0 107.481 179.839 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 50.4 m-70 . . . . . 0 N--CA 1.494 1.76 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 179.843 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo . . . . . 0 N--CA 1.496 1.618 0 CA-C-O 121.735 0.64 . . . . 0.0 113.226 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.405 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 70.8 m-85 -127.23 161.17 29.19 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 112.942 -1.935 . . . . 0.0 107.257 179.738 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -140.08 149.57 43.26 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.427 179.908 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.467 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 37.0 t -98.36 121.37 40.21 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 103.785 -2.672 . . . . 0.0 103.785 179.439 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -95.57 41.27 1.1 Allowed 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.467 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 22.4 m -128.95 -42.13 1.41 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 113.406 -1.725 . . . . 0.0 108.55 -179.935 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.3 p -120.25 -42.32 2.58 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 123.96 0.788 . . . . 0.0 109.119 -179.957 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 102.75 57.66 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.975 0 O-C-N 126.888 2.617 . . . . 0.0 111.163 179.777 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.07 155.34 26.13 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 103.171 -2.9 . . . . 0.0 103.171 179.45 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -113.47 163.08 15.35 Favored 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.8 -179.737 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.412 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.2 m-85 -140.97 -178.09 5.4 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 124.264 0.978 . . . . 0.0 109.135 -179.802 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.0 p -105.85 -37.19 6.77 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 124.955 1.409 . . . . 0.0 111.002 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.8 mtp-105 -118.66 -178.85 3.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 124.424 1.078 . . . . 0.0 109.942 179.975 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.405 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 74.1 p -93.6 -34.82 13.17 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.14 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -74.96 0.54 15.45 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -97.61 -52.82 3.63 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 102.051 -3.315 . . . . 0.0 102.051 179.493 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.8 tp -52.26 -47.52 65.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 124.157 0.911 . . . . 0.0 108.917 179.547 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -59.5 -55.75 30.68 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.585 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 65.8 m -52.87 -25.25 11.04 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.025 0.441 . . . . 0.0 111.173 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.412 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 66.4 t60 -82.98 -55.87 4.13 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.341 179.677 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.407 ' C ' ' H ' ' A' ' 24' ' ' THR . 8.1 p -45.95 -37.28 6.27 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.174 0.99 . . . . 0.0 112.602 -179.544 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -64.02 10.95 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 118.693 -1.203 . . . . 0.0 114.013 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.407 ' H ' ' C ' ' A' ' 22' ' ' THR . 11.8 t -105.06 -7.14 19.37 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.682 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.994 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo . . . . . 0 N--CA 1.491 1.346 0 CA-C-O 121.675 0.615 . . . . 0.0 112.472 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.414 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 64.7 m-85 -129.05 149.95 50.65 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.665 -1.607 . . . . 0.0 107.159 179.907 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.429 HE21 ' HA ' ' A' ' 9' ' ' GLN . 71.5 tp60 -124.54 141.82 51.81 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 123.971 0.794 . . . . 0.0 109.415 179.97 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.414 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 49.6 t -91.73 119.71 31.82 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 101.82 -3.4 . . . . 0.0 101.82 179.49 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -95.05 39.27 1.11 Allowed 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 -179.688 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.414 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 24.0 m -128.7 -44.62 1.34 Allowed 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 113.106 -1.861 . . . . 0.0 108.234 179.963 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 29.9 p -119.65 -34.05 3.87 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 119.759 -0.777 . . . . 0.0 109.403 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 4.3 mp0 91.77 64.33 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 126.38 2.3 . . . . 0.0 111.359 179.712 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.56 152.84 36.34 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 104.058 -2.571 . . . . 0.0 104.058 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -113.56 155.07 26.07 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 119.187 -1.005 . . . . 0.0 110.553 -179.691 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -135.4 -172.03 2.97 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.184 -179.694 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.1 p -108.98 -42.8 4.35 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 113.605 -1.634 . . . . 0.0 111.458 -179.84 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.545 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 55.5 mtt180 -114.6 170.28 8.43 Favored 'General case' 0 N--CA 1.506 2.342 0 CA-C-O 121.839 0.828 . . . . 0.0 111.815 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.414 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 69.3 p -82.39 -39.16 23.08 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 179.939 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.47 -27.55 67.12 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 179.864 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.545 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 45.7 m170 -71.16 -60.29 2.31 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 104.418 -2.438 . . . . 0.0 104.418 179.491 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.5 tp -41.44 -52.05 3.68 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 123.801 0.688 . . . . 0.0 109.431 179.41 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -47.04 -69.02 0.14 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.713 0.633 . . . . 0.0 110.796 179.471 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.47 ' HA ' ' NH1' ' A' ' 23' ' ' ARG . 56.0 m -42.66 -42.03 3.32 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.936 -179.91 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -66.46 -61.81 1.8 Allowed 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 113.915 -1.493 . . . . 0.0 113.611 179.983 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.3 m -41.85 -45.69 3.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 124.382 1.051 . . . . 0.0 111.605 -178.925 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.47 ' NH1' ' HA ' ' A' ' 20' ' ' THR . 37.6 ttp180 -34.7 -31.9 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 O-C-N 125.97 2.044 . . . . 0.0 114.792 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.3 t -77.18 14.39 0.92 Allowed 'General case' 0 N--CA 1.506 2.329 0 CA-C-O 121.765 0.793 . . . . 0.0 112.667 -179.659 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.0 m-70 . . . . . 0 N--CA 1.492 1.66 0 CA-C-N 114.039 -1.437 . . . . 0.0 107.784 179.562 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo . . . . . 0 N--CA 1.49 1.277 0 N-CA-C 109.554 -0.979 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -121.9 159.9 25.9 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 113.05 -1.886 . . . . 0.0 107.055 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -140.31 150.49 44.07 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.489 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.42 ' HA ' HD11 ' A' ' 18' ' ' LEU . 31.9 t -87.25 144.59 26.74 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 179.596 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -102.54 32.16 3.73 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.162 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 39.9 m -131.57 -40.88 1.08 Allowed 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 114.124 -1.398 . . . . 0.0 110.178 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 26.9 p -121.34 -42.13 2.47 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 124.011 0.819 . . . . 0.0 111.259 -179.671 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.5 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 2.6 mp0 99.62 58.5 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 126.811 2.569 . . . . 0.0 108.955 179.97 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.45 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 16.8 ttt180 -104.6 159.31 15.86 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 101.373 -3.566 . . . . 0.0 101.373 179.477 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -114.49 161.18 18.34 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 119.197 -1.001 . . . . 0.0 112.165 -179.41 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.429 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.9 m-85 -144.04 176.26 9.43 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 124.44 1.087 . . . . 0.0 109.348 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 43.5 p -106.19 -40.52 5.61 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.653 1.221 . . . . 0.0 110.598 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.552 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 58.2 mtt85 -112.27 171.57 7.43 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 124.579 1.174 . . . . 0.0 110.053 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 88.8 p -85.51 -36.63 20.4 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 179.864 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.26 -32.78 74.28 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 179.978 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.552 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 41.6 m170 -67.1 -60.78 2.33 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 179.666 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.42 HD11 ' HA ' ' A' ' 5' ' ' CYS . 44.6 tp -40.14 -51.77 2.61 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 123.758 0.661 . . . . 0.0 110.721 179.451 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -54.81 -60.37 3.46 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.644 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.5 m -42.35 -40.81 2.63 Favored 'General case' 0 N--CA 1.501 2.103 0 CA-C-O 121.489 0.661 . . . . 0.0 111.767 179.723 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.45 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 53.3 t60 -71.57 -57.37 4.46 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 113.92 -1.491 . . . . 0.0 114.191 179.666 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.7 p -44.01 -35.92 2.28 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.591 0.757 . . . . 0.0 112.306 -179.127 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -81.73 44.88 0.85 Allowed 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 118.457 -1.297 . . . . 0.0 111.766 179.765 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.0 t -124.14 -21.78 4.95 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 179.495 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 . . . . . 0 N--CA 1.486 1.374 0 CA-C-N 114.107 -1.406 . . . . 0.0 110.249 -179.6 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo . . . . . 0 N--CA 1.493 1.459 0 CA-C-O 121.842 0.684 . . . . 0.0 113.335 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.422 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 58.9 m-85 -127.74 167.6 16.25 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 113.005 -1.907 . . . . 0.0 107.746 179.982 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -148.06 153.18 38.58 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.846 179.493 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.475 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 34.7 t -94.79 127.75 41.02 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 179.819 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.467 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -95.42 38.78 1.14 Allowed 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 -179.585 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.475 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 29.2 m -130.68 -44.59 1.08 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 113.887 -1.506 . . . . 0.0 109.89 179.932 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 32.0 p -120.71 -26.58 5.25 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 123.75 0.656 . . . . 0.0 110.789 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.469 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 6.8 mp0 85.82 57.91 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 125.93 2.018 . . . . 0.0 112.304 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.68 151.86 34.26 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 179.35 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -113.96 162.88 15.86 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.149 -1.02 . . . . 0.0 112.216 -179.799 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -137.11 -173.81 3.56 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.699 -1.591 . . . . 0.0 109.485 -179.575 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 80.7 p -111.24 -37.58 5.26 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 124.313 1.008 . . . . 0.0 108.452 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.509 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.4 mtt85 -116.09 -178.16 3.34 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.913 -179.939 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.422 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 87.1 p -97.17 -24.19 15.85 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 113.689 -1.596 . . . . 0.0 107.418 179.95 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -90.29 19.01 5.42 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 122.483 1.135 . . . . 0.0 108.549 179.808 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.509 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 22.7 m170 -120.27 -19.71 7.58 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 112.275 -2.239 . . . . 0.0 105.147 179.514 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.8 tp -101.12 -48.77 4.3 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 114.405 -1.271 . . . . 0.0 109.405 -179.809 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -71.81 3.8 3.87 Favored 'General case' 0 N--CA 1.504 2.25 0 CA-C-O 121.121 0.486 . . . . 0.0 111.412 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.4 m -105.51 -43.17 5.02 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 103.781 -2.674 . . . . 0.0 103.781 179.536 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -61.71 -56.92 14.51 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 113.484 -1.689 . . . . 0.0 111.73 179.832 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.467 ' C ' ' H ' ' A' ' 24' ' ' THR . 17.1 p -45.06 -23.63 0.17 Allowed 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 124.686 1.194 . . . . 0.0 112.6 -179.872 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.8 mmm-85 -78.85 32.83 0.21 Allowed 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.75 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.467 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.0 t -124.58 -23.48 4.39 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 179.746 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.1 m-70 . . . . . 0 N--CA 1.491 1.605 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.169 -179.748 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo . . . . . 0 N--CA 1.494 1.545 0 N-CA-C 115.346 1.248 . . . . 0.0 115.346 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.408 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 76.9 m-85 -125.49 155.67 40.17 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 112.02 -2.355 . . . . 0.0 108.018 -179.941 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -135.45 152.37 51.3 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.226 179.415 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.44 ' HA ' HD11 ' A' ' 18' ' ' LEU . 44.5 t -91.17 128.8 37.14 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 179.624 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.3 pttm -99.59 38.89 1.37 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.375 -179.72 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.408 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 54.7 m -130.88 -42.73 1.11 Allowed 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 112.251 -2.25 . . . . 0.0 107.353 179.62 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.3 p -124.91 -30.79 3.21 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 124.06 0.85 . . . . 0.0 111.806 -179.875 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.494 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.0 mp0 88.0 62.81 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.325 0 O-C-N 125.64 1.838 . . . . 0.0 110.443 179.839 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.414 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 21.4 ttm-85 -115.68 154.19 29.96 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 102.725 -3.065 . . . . 0.0 102.725 179.696 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -114.51 155.66 26.02 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 119.153 -1.019 . . . . 0.0 112.535 -179.47 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.428 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 85.2 m-85 -136.56 -179.63 5.8 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 114.393 -1.276 . . . . 0.0 109.059 -179.733 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 76.3 p -106.37 -34.69 7.36 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 124.417 1.073 . . . . 0.0 110.122 -179.861 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.564 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 52.5 mtt85 -117.41 169.73 9.28 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 124.838 1.337 . . . . 0.0 111.413 -179.796 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.408 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 96.7 p -85.99 -37.04 19.4 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 179.913 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -64.27 -30.01 71.07 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 179.782 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.564 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 21.7 m170 -71.48 -60.62 2.14 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 105.858 -1.904 . . . . 0.0 105.858 179.685 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.44 HD11 ' HA ' ' A' ' 5' ' ' CYS . 62.9 tp -40.61 -52.4 2.88 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 124.073 0.858 . . . . 0.0 111.175 179.608 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -55.06 -64.39 0.85 Allowed 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 118.922 -0.561 . . . . 0.0 110.306 179.626 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.0 m -39.2 -45.47 1.35 Allowed 'General case' 0 N--CA 1.504 2.246 0 O-C-N 124.231 0.957 . . . . 0.0 110.292 179.763 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.428 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 44.9 t60 -60.33 -60.99 2.94 Favored 'General case' 0 N--CA 1.489 1.502 0 CA-C-N 113.878 -1.51 . . . . 0.0 111.24 179.591 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.5 m -47.53 -23.32 0.61 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 123.751 0.657 . . . . 0.0 112.735 -179.581 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 mmm180 -53.57 -21.47 6.64 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.196 179.484 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.7 t -88.21 17.16 5.35 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-O 121.778 0.799 . . . . 0.0 110.81 -179.884 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 36.3 m-70 . . . . . 0 N--CA 1.492 1.651 0 CA-C-N 113.652 -1.613 . . . . 0.0 108.731 179.705 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo . . . . . 0 N--CA 1.492 1.385 0 CA-C-O 121.573 0.572 . . . . 0.0 112.865 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.457 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 50.1 m-85 -129.17 168.04 16.73 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 113.635 -1.621 . . . . 0.0 108.93 179.826 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.543 HE21 ' HA ' ' A' ' 9' ' ' GLN . 72.2 tp60 -133.82 149.37 51.39 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 124.165 0.915 . . . . 0.0 111.752 -179.806 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.496 ' HA ' HD11 ' A' ' 18' ' ' LEU . 41.7 t -99.34 141.4 32.17 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 104.616 -2.364 . . . . 0.0 104.616 179.304 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.471 ' HD3' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -105.32 19.31 20.8 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 124.748 1.28 . . . . 0.0 109.183 -179.843 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.9 m -114.81 -42.86 3.19 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 114.09 -1.414 . . . . 0.0 108.214 179.919 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.534 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 22.4 p -130.9 10.28 5.02 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 119.576 -0.85 . . . . 0.0 112.355 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.543 ' HA ' HE21 ' A' ' 4' ' ' GLN . 96.2 mm-40 47.16 59.39 4.08 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 122.747 1.26 . . . . 0.0 111.226 -179.825 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.534 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 15.4 ttt180 -117.04 157.42 25.87 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 103.934 -2.617 . . . . 0.0 103.934 179.812 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 pttp -114.91 165.39 12.9 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 118.32 -1.352 . . . . 0.0 112.149 -179.938 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.497 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 98.9 m-85 -140.84 -170.67 3.08 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 113.896 -1.502 . . . . 0.0 110.448 -179.768 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.8 p -108.36 -35.41 6.52 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 124.737 1.273 . . . . 0.0 109.495 179.923 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.419 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 5.6 mtp85 -127.12 174.61 8.77 Favored 'General case' 0 N--CA 1.504 2.227 0 CA-C-O 121.658 0.742 . . . . 0.0 110.371 179.497 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.457 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 90.3 p -82.55 -41.87 19.08 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.447 -1.251 . . . . 0.0 108.549 -179.891 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -67.86 -28.52 67.61 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 -179.992 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.419 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 53.9 m170 -69.16 -61.53 1.75 Allowed 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 104.625 -2.361 . . . . 0.0 104.625 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.496 HD11 ' HA ' ' A' ' 5' ' ' CYS . 40.0 tp -39.21 -52.63 1.94 Allowed 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 121.808 0.813 . . . . 0.0 110.179 179.318 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -49.07 -68.43 0.18 Allowed 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.151 179.584 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.4 m -39.83 -45.2 1.74 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 124.635 1.21 . . . . 0.0 110.284 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 8.2 t60 -57.06 -61.18 2.63 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.174 -1.376 . . . . 0.0 111.265 179.797 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.484 ' C ' ' H ' ' A' ' 24' ' ' THR . 12.5 m -41.54 -26.49 0.07 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.985 1.428 . . . . 0.0 111.238 -179.68 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.411 ' HA ' HH11 ' A' ' 23' ' ' ARG . 14.9 mmm180 -79.42 36.65 0.31 Allowed 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 114.849 -1.068 . . . . 0.0 110.47 179.797 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.484 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.7 t -125.77 -12.08 6.59 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 104.882 -2.266 . . . . 0.0 104.882 179.496 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 . . . . . 0 N--CA 1.487 1.389 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.801 -179.895 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo . . . . . 0 N--CA 1.485 1.015 0 N-CA-C 110.564 -0.591 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -114.92 145.14 42.52 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 105.172 -2.158 . . . . 0.0 105.172 179.669 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -127.61 151.13 49.32 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.25 0.969 . . . . 0.0 109.768 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.5 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 32.2 t -99.59 136.25 39.8 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 103.254 -2.869 . . . . 0.0 103.254 179.587 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -99.11 23.6 8.88 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.408 -0.917 . . . . 0.0 111.714 -179.422 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.502 HG21 ' CG ' ' A' ' 25' ' ' HIS . 18.7 m -119.84 -44.56 2.52 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 179.296 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.561 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 27.2 p -127.25 10.32 6.82 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 48.57 57.7 6.01 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-O 123.372 1.558 . . . . 0.0 109.71 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.561 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 55.7 ttm-85 -116.22 130.04 56.59 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 111.101 -2.772 . . . . 0.0 103.909 -179.929 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -103.68 163.09 12.55 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.062 -1.055 . . . . 0.0 113.576 -179.352 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -138.49 175.3 9.68 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 112.932 -1.94 . . . . 0.0 110.345 -179.385 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 84.9 p -101.7 -27.35 13.1 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.57 1.169 . . . . 0.0 110.719 -179.875 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.51 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 57.1 mtt85 -118.2 165.85 13.31 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 124.546 1.153 . . . . 0.0 111.007 -179.936 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 61.8 p -85.16 -38.98 18.38 Favored 'General case' 0 N--CA 1.492 1.631 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.432 -179.953 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.4 -36.42 82.26 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 179.921 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.51 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 28.6 m170 -66.37 -62.23 1.58 Allowed 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 179.708 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 39.2 tp -40.1 -55.18 2.15 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.087 0.867 . . . . 0.0 111.478 179.613 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -54.01 -62.0 1.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 124.045 0.841 . . . . 0.0 112.376 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.8 m -45.26 -43.43 10.46 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 123.893 0.746 . . . . 0.0 111.014 179.889 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.462 ' CE1' ' HD2' ' A' ' 10' ' ' ARG . 63.6 t60 -61.82 -63.62 1.2 Allowed 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.535 179.842 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -51.25 -42.47 61.07 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -179.439 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -34.12 -31.57 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 125.453 1.721 . . . . 0.0 112.992 179.454 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.5 t -78.73 -47.95 15.87 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.364 -179.72 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.502 ' CG ' HG21 ' A' ' 7' ' ' THR . 0.8 OUTLIER . . . . . 0 N--CA 1.494 1.76 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 179.866 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo . . . . . 0 N--CA 1.489 1.207 0 CA-C-O 122.174 0.822 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -122.44 154.56 37.61 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 112.258 -2.246 . . . . 0.0 105.964 179.76 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.538 HE21 ' HA ' ' A' ' 9' ' ' GLN . 72.0 tp60 -132.14 147.9 52.45 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 123.847 0.717 . . . . 0.0 110.592 -179.864 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.491 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 18.3 t -95.46 135.36 37.2 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 103.169 -2.9 . . . . 0.0 103.169 179.491 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 7.8 mptt -99.76 33.44 2.54 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 125.124 1.515 . . . . 0.0 108.539 -179.576 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.484 HG21 ' CG ' ' A' ' 25' ' ' HIS . 69.9 m -131.76 -46.48 0.96 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.393 179.946 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.2 p -125.58 5.97 7.55 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.674 -179.75 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.538 ' HA ' HE21 ' A' ' 4' ' ' GLN . 86.5 mm-40 53.1 58.71 5.03 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-O 122.941 1.353 . . . . 0.0 111.062 179.878 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.491 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 20.6 ttt180 -111.79 148.94 32.47 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 102.613 -3.106 . . . . 0.0 102.613 179.67 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -115.58 162.53 17.09 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 119.088 -1.045 . . . . 0.0 112.22 -179.8 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -140.98 177.47 8.03 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-N 114.085 -1.416 . . . . 0.0 108.599 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 80.5 p -106.83 -30.48 8.89 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 124.29 0.994 . . . . 0.0 110.642 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.503 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 51.9 mtt85 -119.96 -178.85 3.75 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.901 -179.757 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 99.8 p -98.19 -33.57 11.07 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -64.17 -22.71 67.04 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.503 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 32.4 m170 -80.25 -42.68 22.72 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 179.731 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.86 -47.42 83.41 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 179.763 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.37 -61.25 2.43 Favored 'General case' 0 N--CA 1.503 2.214 0 CA-C-N 118.928 0.785 . . . . 0.0 110.388 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.5 m -48.11 -26.22 1.77 Allowed 'General case' 0 N--CA 1.502 2.17 0 CA-C-O 120.959 0.409 . . . . 0.0 112.088 179.73 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.479 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 71.3 t60 -84.61 -56.13 3.76 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.633 179.612 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.474 ' C ' ' H ' ' A' ' 24' ' ' THR . 19.2 p -50.26 -33.59 20.32 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.417 1.087 . . . . 0.0 113.383 -179.464 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -65.63 14.28 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.643 -1.223 . . . . 0.0 113.888 179.744 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.474 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.4 t -109.75 -10.51 14.79 Favored 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 179.554 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.484 ' CG ' HG21 ' A' ' 7' ' ' THR . 40.7 m-70 . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 104.731 -2.322 . . . . 0.0 104.731 179.857 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo . . . . . 0 N--CA 1.487 1.131 0 CA-C-O 121.952 0.73 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -124.95 154.82 40.58 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 112.678 -2.055 . . . . 0.0 106.571 179.798 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -135.87 145.04 45.94 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 124.084 0.865 . . . . 0.0 109.394 179.93 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.2 t -93.56 140.52 29.51 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 104.891 -2.262 . . . . 0.0 104.891 179.619 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -104.63 37.62 2.09 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -179.672 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.9 m -131.93 -44.31 0.96 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 113.7 -1.591 . . . . 0.0 109.059 179.992 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.497 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.0 p -118.93 -34.22 3.97 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 123.896 0.747 . . . . 0.0 109.832 -179.933 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.497 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 6.5 mp0 88.77 56.68 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.196 0 O-C-N 126.342 2.276 . . . . 0.0 108.98 179.706 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.404 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -112.65 138.54 49.29 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 102.946 -2.983 . . . . 0.0 102.946 179.747 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -102.64 164.98 11.33 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.949 -1.101 . . . . 0.0 112.15 -179.53 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -139.42 -178.08 5.22 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 113.52 -1.673 . . . . 0.0 109.293 -179.704 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.5 p -105.06 -39.53 6.19 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 124.883 1.365 . . . . 0.0 108.818 -179.909 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.502 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 55.9 mtt180 -109.7 -177.69 3.34 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 124.438 1.086 . . . . 0.0 111.369 179.965 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.5 p -97.67 -30.44 12.82 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 113.671 -1.604 . . . . 0.0 109.461 -179.879 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -88.41 19.42 3.84 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 122.162 0.982 . . . . 0.0 108.475 179.906 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.502 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.5 m170 -119.45 -24.39 6.34 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 179.529 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.5 tp -93.76 -54.3 3.68 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 114.322 -1.308 . . . . 0.0 110.154 -179.968 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -0.86 12.71 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.821 -179.846 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.0 m -104.5 -36.01 7.68 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 105.299 -2.111 . . . . 0.0 105.299 179.921 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 25.3 t60 -70.33 -53.37 16.98 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 124.041 0.838 . . . . 0.0 108.801 179.727 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 p -37.94 -46.01 0.93 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.129 0.972 . . . . 0.0 111.135 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.3 mmt-85 -43.32 -21.38 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 179.921 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.9 t -73.91 -21.54 60.02 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 123.099 0.249 . . . . 0.0 111.335 -179.548 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 56.6 m-70 . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 179.705 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_exo . . . . . 0 N--CA 1.491 1.351 0 CA-C-O 121.613 0.589 . . . . 0.0 111.906 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.458 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 56.7 m-85 -128.28 163.14 25.42 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 113.586 -1.643 . . . . 0.0 108.783 179.936 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -136.29 153.71 51.09 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 124.148 0.905 . . . . 0.0 110.489 179.775 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.464 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 34.6 t -99.54 124.74 45.01 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 179.664 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -97.88 40.48 1.17 Allowed 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 122.376 1.084 . . . . 0.0 109.101 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.464 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.3 m -124.42 -41.59 2.16 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 112.84 -1.982 . . . . 0.0 105.668 179.633 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 31.8 p -122.31 -36.86 2.89 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 124.097 0.873 . . . . 0.0 110.684 180.0 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 4.5 mp0 92.26 56.81 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.456 0 O-C-N 126.143 2.152 . . . . 0.0 111.434 179.791 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.4 ttt-85 -116.65 161.11 19.71 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 103.897 -2.631 . . . . 0.0 103.897 179.529 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -117.2 163.52 16.18 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 119.773 -0.771 . . . . 0.0 112.951 -179.898 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.605 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 72.2 m-85 -138.35 -175.61 4.17 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 112.711 -2.041 . . . . 0.0 107.935 -179.825 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.0 p -106.2 -33.04 7.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 124.142 0.901 . . . . 0.0 110.609 -179.986 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.462 ' CD ' ' CE1' ' A' ' 17' ' ' HIS . 35.5 mtp180 -120.06 171.08 8.71 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 123.793 0.683 . . . . 0.0 110.623 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.458 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 92.1 p -80.84 -29.07 35.91 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.562 -179.898 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -82.55 -28.23 31.12 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 179.78 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.462 ' CE1' ' CD ' ' A' ' 14' ' ' ARG . 42.9 m170 -68.85 -52.18 32.56 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 101.867 -3.383 . . . . 0.0 101.867 179.275 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 52.6 tp -43.04 -49.04 6.19 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.115 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.403 ' C ' ' HD2' ' A' ' 19' ' ' LYS . 0.2 OUTLIER -56.81 -58.74 6.79 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 179.415 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.7 m -40.18 -38.51 0.77 Allowed 'General case' 0 N--CA 1.503 2.213 0 CA-C-O 121.116 0.484 . . . . 0.0 110.849 179.612 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.605 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 51.3 t60 -75.16 -51.78 12.56 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 113.835 -1.53 . . . . 0.0 114.078 179.592 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.7 p -43.13 -37.26 1.97 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 118.899 0.772 . . . . 0.0 110.459 -179.769 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -43.44 -21.25 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 179.31 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 68.1 p -80.33 -18.87 47.93 Favored 'General case' 0 N--CA 1.509 2.509 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -179.733 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 47.7 m-70 . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 106.117 -1.809 . . . . 0.0 106.117 179.969 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo . . . . . 0 N--CA 1.494 1.534 0 CA-C-O 122.123 0.801 . . . . 0.0 112.911 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -123.15 166.09 15.78 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 112.611 -2.086 . . . . 0.0 107.973 -179.992 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -142.17 152.83 43.54 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 123.954 0.784 . . . . 0.0 109.759 179.558 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.462 ' HA ' HD11 ' A' ' 18' ' ' LEU . 46.2 t -93.24 136.37 33.57 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 179.574 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -104.44 35.32 2.76 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.649 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 58.7 m -127.52 -40.57 1.76 Allowed 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 113.287 -1.779 . . . . 0.0 107.763 179.861 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.4 p -122.52 -38.39 2.67 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 124.14 0.9 . . . . 0.0 110.5 -179.942 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.49 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.2 mp0 91.54 62.3 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 126.22 2.2 . . . . 0.0 110.63 179.793 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -118.73 155.84 30.39 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 102.692 -3.077 . . . . 0.0 102.692 179.624 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.6 mtpt -113.8 163.98 14.33 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 118.841 -1.144 . . . . 0.0 113.169 -179.657 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.437 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 88.7 m-85 -139.96 -178.15 5.31 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 114.348 -1.297 . . . . 0.0 108.28 -179.586 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 55.1 p -103.76 -38.95 6.85 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -179.974 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.465 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 58.8 mtt85 -115.64 178.07 4.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 124.508 1.13 . . . . 0.0 110.4 179.905 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 94.7 p -89.43 -36.61 15.35 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 113.907 -1.497 . . . . 0.0 109.363 -179.759 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -65.69 -34.1 77.43 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 179.953 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.465 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 50.1 m170 -61.5 -61.77 2.29 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 179.587 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' A' ' 5' ' ' CYS . 50.1 tp -42.43 -54.97 3.61 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 124.025 0.828 . . . . 0.0 110.999 179.688 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -50.29 -63.66 1.05 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.801 179.701 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.1 m -41.57 -45.22 3.25 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 124.162 0.913 . . . . 0.0 110.333 179.928 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.437 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 36.9 t60 -63.4 -59.64 4.42 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.366 -1.743 . . . . 0.0 113.204 179.9 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.499 ' C ' ' H ' ' A' ' 24' ' ' THR . 25.0 m -52.71 -25.81 12.17 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 123.784 0.678 . . . . 0.0 112.192 -179.325 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -79.81 38.81 0.4 Allowed 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 122.578 1.18 . . . . 0.0 110.49 179.789 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.499 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.8 t -126.28 -27.44 3.21 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 179.23 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.416 ' H ' ' H ' ' A' ' 24' ' ' THR . 79.4 m-70 . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 179.956 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.488 1.202 0 CA-C-O 122.47 0.946 . . . . 0.0 114.317 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.42 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 58.0 m-85 -134.45 154.88 51.17 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 112.027 -2.351 . . . . 0.0 105.888 179.652 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -142.61 154.92 44.84 Favored 'General case' 0 N--CA 1.501 2.101 0 C-N-CA 118.991 -1.084 . . . . 0.0 111.381 179.715 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 36.6 t -90.92 139.6 30.61 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 179.745 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -102.01 38.21 1.7 Allowed 'General case' 0 N--CA 1.5 2.075 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.478 -179.674 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 56.6 m -135.77 -45.93 0.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 113.808 -1.542 . . . . 0.0 110.302 -179.975 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 28.8 p -121.79 -20.25 6.49 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 124.124 0.89 . . . . 0.0 111.195 -179.601 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 13.3 mp0 75.57 57.73 0.06 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 125.406 1.691 . . . . 0.0 111.307 179.702 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -107.79 148.21 29.81 Favored 'General case' 0 N--CA 1.487 1.414 1 N-CA-C 100.104 -4.036 . . . . 0.0 100.104 179.394 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -112.01 157.18 21.03 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.378 -0.929 . . . . 0.0 110.907 -179.615 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -134.55 -177.51 4.64 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 113.634 -1.621 . . . . 0.0 109.512 -179.622 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 57.9 p -110.85 -34.1 6.34 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 124.631 1.207 . . . . 0.0 109.939 -179.965 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.434 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.9 mtt180 -118.02 -176.54 3.07 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.535 179.731 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.42 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 79.8 p -97.85 -25.31 15.07 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 114.278 -1.328 . . . . 0.0 107.963 -179.986 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 53.9 p30 -91.87 25.62 2.71 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.571 1.177 . . . . 0.0 108.862 179.94 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.434 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 33.1 m170 -122.14 -42.63 2.36 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 102.568 -3.123 . . . . 0.0 102.568 179.688 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -77.53 -50.78 11.89 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 113.353 -1.749 . . . . 0.0 109.705 179.877 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -72.05 5.72 2.55 Favored 'General case' 0 N--CA 1.502 2.139 0 CA-C-O 121.169 0.509 . . . . 0.0 112.136 -179.861 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 79.5 m -106.53 -43.78 4.65 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 102.896 -3.001 . . . . 0.0 102.896 179.582 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 54.4 t60 -60.35 -58.26 9.28 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.477 -1.692 . . . . 0.0 111.256 179.7 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 20.0 p -46.83 -18.87 0.08 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -179.639 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 mtp-105 -67.61 -8.6 35.82 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.239 -179.905 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.3 t -89.95 -7.24 54.54 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.992 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 CA--C 1.542 0.876 0 CA-C-O 121.685 0.619 . . . . 0.0 112.253 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.4 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 42.6 m-85 -126.93 163.39 23.77 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 113.653 -1.612 . . . . 0.0 106.907 179.671 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -133.05 149.48 52.17 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 123.711 0.632 . . . . 0.0 111.923 -179.778 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.6 t -99.59 139.85 34.65 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 179.444 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -106.46 40.99 1.51 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 122.416 1.103 . . . . 0.0 109.557 179.948 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 62.6 m -135.99 -39.02 0.7 Allowed 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 113.05 -1.886 . . . . 0.0 108.434 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.3 p -123.21 -43.09 2.22 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 119.135 -1.026 . . . . 0.0 108.871 -179.876 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 98.3 mm-40 100.19 59.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 O-C-N 126.726 2.516 . . . . 0.0 108.94 179.831 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 ttt-85 -115.82 157.04 25.01 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 179.741 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -112.77 164.4 13.43 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.113 179.977 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.545 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 95.7 m-85 -139.2 -173.8 3.69 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.61 -2.087 . . . . 0.0 109.771 -179.893 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.1 p -106.72 -35.79 6.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 124.477 1.111 . . . . 0.0 110.187 -179.959 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.492 ' HB2' ' CG ' ' A' ' 17' ' ' HIS . 46.2 mtt85 -121.46 -179.71 4.17 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 123.808 0.692 . . . . 0.0 112.173 179.8 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.4 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 64.5 p -90.48 -40.05 12.24 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 114.47 -1.241 . . . . 0.0 107.886 -179.932 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.35 -33.21 74.76 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 104.682 -2.34 . . . . 0.0 104.682 179.786 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.492 ' CG ' ' HB2' ' A' ' 14' ' ' ARG . 49.7 m170 -66.61 -56.65 9.75 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 179.433 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.9 tp -46.02 -55.62 6.63 Favored 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.9 tttm -46.56 -59.44 3.0 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 122.049 0.14 . . . . 0.0 110.899 179.582 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.9 m -45.14 -44.65 10.84 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.616 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.545 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 61.1 t60 -67.42 -52.9 34.12 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 114.162 -1.381 . . . . 0.0 114.705 179.716 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.2 p -49.1 -39.8 29.56 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 118.908 0.776 . . . . 0.0 109.945 -179.602 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.5 mtt-85 -68.61 19.76 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 179.94 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.2 p -108.39 -6.99 15.96 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.223 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 61.3 m-70 . . . . . 0 C--N 1.302 -1.481 1 N-CA-C 100.036 -4.061 . . . . 0.0 100.036 179.203 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.491 1.334 0 CA-C-O 121.689 0.62 . . . . 0.0 113.26 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -128.92 157.37 41.79 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 113.283 -1.78 . . . . 0.0 107.025 179.596 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -139.95 154.61 47.24 Favored 'General case' 0 N--CA 1.5 2.075 0 C-N-CA 119.956 -0.698 . . . . 0.0 111.78 179.649 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.46 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 15.7 t -104.31 122.74 46.06 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 105.029 -2.212 . . . . 0.0 105.029 179.44 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -97.86 46.41 1.02 Allowed 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 122.999 1.38 . . . . 0.0 109.045 -179.851 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.46 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.4 m -129.3 -43.88 1.28 Allowed 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 111.77 -2.468 . . . . 0.0 105.682 179.693 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.4 p -122.49 -24.29 5.0 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.292 0.995 . . . . 0.0 112.166 -179.932 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 84.43 53.92 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 O-C-N 124.871 1.357 . . . . 0.0 108.66 179.866 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.473 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 17.7 ttm180 -113.97 156.38 24.15 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 104.496 -2.409 . . . . 0.0 104.496 179.968 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.512 ' HD3' ' H ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -120.75 161.54 21.27 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 119.073 -1.051 . . . . 0.0 111.488 -179.829 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.449 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 75.7 m-85 -136.68 179.29 6.46 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.316 -1.765 . . . . 0.0 110.442 -179.58 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.2 p -104.9 -30.33 9.9 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 124.907 1.38 . . . . 0.0 110.731 -179.847 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.537 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 65.6 mtt85 -124.09 177.79 5.64 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 123.992 0.808 . . . . 0.0 111.314 179.974 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 84.4 p -94.15 -35.28 12.59 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 114.288 -1.324 . . . . 0.0 108.43 179.996 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -65.44 -34.61 78.69 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 104.03 -2.581 . . . . 0.0 104.03 179.805 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.537 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 36.5 m170 -62.77 -64.0 1.05 Allowed 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.418 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.2 tp -42.59 -52.56 4.76 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 123.534 0.521 . . . . 0.0 110.927 179.515 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -50.84 -48.35 59.94 Favored 'General case' 0 N--CA 1.508 2.442 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 179.69 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 87.2 m -65.73 -37.53 86.64 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.236 179.738 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.473 ' CE1' ' HD2' ' A' ' 10' ' ' ARG . 68.9 t60 -62.95 -53.71 49.85 Favored 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.799 179.743 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.446 ' C ' ' H ' ' A' ' 24' ' ' THR . 25.1 p -61.02 -7.43 2.49 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.086 179.687 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.4 32.02 1.1 Allowed 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 105.555 -2.017 . . . . 0.0 105.555 179.858 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.446 ' H ' ' C ' ' A' ' 22' ' ' THR . 92.9 m -127.0 -27.37 3.02 Favored 'General case' 0 N--CA 1.491 1.625 0 CA-C-N 113.287 -1.779 . . . . 0.0 106.896 -179.947 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 . . . . . 0 N--CA 1.493 1.69 0 CA-C-N 114.715 -1.13 . . . . 0.0 111.79 -179.695 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo . . . . . 0 N--CA 1.49 1.306 0 CA-C-O 122.503 0.96 . . . . 0.0 113.935 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -127.78 145.73 50.82 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-N 111.819 -2.446 . . . . 0.0 105.168 179.658 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -132.27 150.09 52.23 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.371 179.811 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.518 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 13.4 t -100.93 102.8 13.9 Favored 'General case' 0 C--N 1.305 -1.342 1 N-CA-C 99.989 -4.078 . . . . 0.0 99.989 179.533 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -87.88 39.58 0.9 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 -179.404 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.518 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 40.8 m -116.19 -42.34 3.06 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 104.49 -2.411 . . . . 0.0 104.49 179.713 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 28.9 p -124.68 -24.6 4.13 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 124.053 0.846 . . . . 0.0 111.172 179.89 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 8.5 mp0 86.44 59.21 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 126.548 1.939 . . . . 0.0 111.924 179.952 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -118.29 152.35 35.94 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 102.971 -2.974 . . . . 0.0 102.971 179.52 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.464 ' H ' ' HD2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -118.13 160.81 20.91 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 119.107 -1.037 . . . . 0.0 112.594 -179.681 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -139.98 175.77 9.31 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 112.818 -1.992 . . . . 0.0 107.512 -179.753 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.7 p -110.83 -19.89 12.67 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 124.219 0.949 . . . . 0.0 109.803 -179.862 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.3 mtp-105 -125.79 178.55 5.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 124.082 0.864 . . . . 0.0 109.193 179.838 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 89.1 p -94.89 -28.15 15.34 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 114.051 -1.432 . . . . 0.0 108.174 -179.978 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -84.15 14.31 4.37 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 121.78 0.8 . . . . 0.0 109.367 -179.949 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -114.96 -62.09 1.65 Allowed 'General case' 0 C--N 1.307 -1.252 1 N-CA-C 99.759 -4.163 . . . . 0.0 99.759 179.362 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.5 tp -44.24 -53.02 6.99 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.424 179.528 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -57.69 -66.78 0.41 Allowed 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 119.735 -0.786 . . . . 0.0 110.103 179.953 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.7 m -33.63 -47.9 0.25 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 124.649 1.218 . . . . 0.0 110.769 179.634 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -64.59 -58.5 6.17 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 112.909 -1.95 . . . . 0.0 113.043 179.727 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.517 ' C ' ' H ' ' A' ' 24' ' ' THR . 87.4 m -52.76 -20.35 3.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 123.782 0.676 . . . . 0.0 111.718 -179.376 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.508 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 4.8 mmp_? -82.32 38.68 0.56 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 122.422 1.106 . . . . 0.0 109.129 179.411 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.517 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.8 t -128.23 -10.03 5.28 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 104.887 -2.264 . . . . 0.0 104.887 179.36 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 57.4 m-70 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 103.698 -2.704 . . . . 0.0 103.698 179.894 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo . . . . . 0 N--CA 1.488 1.19 0 CA-C-O 122.597 0.999 . . . . 0.0 113.301 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.563 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 76.0 m-85 -128.15 141.92 51.34 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 179.561 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -129.29 152.95 48.3 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 119.089 -1.044 . . . . 0.0 110.353 179.935 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 22.8 t -90.64 140.21 29.98 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 179.599 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -102.2 39.33 1.51 Allowed 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 122.049 0.928 . . . . 0.0 108.948 -179.805 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.5 m -133.27 -44.27 0.85 Allowed 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 113.419 -1.719 . . . . 0.0 110.2 179.913 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 27.0 p -118.65 -35.34 3.74 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 124.056 0.848 . . . . 0.0 110.407 -179.71 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 6.2 mp0 88.24 55.93 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.052 0 O-C-N 126.522 2.389 . . . . 0.0 109.458 179.845 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -107.74 151.22 25.98 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 100.706 -3.813 . . . . 0.0 100.706 179.466 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -116.33 159.79 21.42 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 118.743 -1.183 . . . . 0.0 110.428 -179.559 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.4 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 75.7 m-85 -133.71 -177.06 4.38 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.842 -1.526 . . . . 0.0 110.253 -179.653 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.5 p -98.35 -41.29 7.9 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.023 -179.814 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.51 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.0 mtt85 -117.56 179.41 4.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 124.395 1.06 . . . . 0.0 111.093 179.877 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.563 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 88.6 p -91.73 -36.21 13.71 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.391 -179.974 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 41.8 p-10 -68.74 -24.71 64.49 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.902 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.51 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 48.3 m170 -71.34 -58.96 3.04 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 179.665 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -48.06 -46.27 33.27 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 121.449 0.642 . . . . 0.0 109.907 179.489 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -54.85 -52.67 62.05 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.887 -0.508 . . . . 0.0 110.453 179.603 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 84.9 m -56.17 -42.09 76.53 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.698 -0.801 . . . . 0.0 108.845 179.609 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.4 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 62.4 t60 -58.12 -61.79 2.29 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.885 179.912 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.418 ' C ' ' H ' ' A' ' 24' ' ' THR . 13.3 p -42.3 -27.15 0.13 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.675 1.19 . . . . 0.0 112.052 -179.649 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -85.61 43.48 1.03 Allowed 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 123.257 1.503 . . . . 0.0 110.158 179.708 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.418 ' H ' ' C ' ' A' ' 22' ' ' THR . 12.4 t -126.47 -26.83 3.24 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 111.936 -2.393 . . . . 0.0 105.044 179.637 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 . . . . . 0 N--CA 1.488 1.438 0 N-CA-C 105.48 -2.045 . . . . 0.0 105.48 179.89 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.498 1.778 0 N-CA-C 117.594 2.113 . . . . 0.0 117.594 . . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.474 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 77.6 m-85 -123.42 162.76 22.18 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.285 -2.234 . . . . 0.0 108.843 -179.795 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -142.74 156.72 45.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 123.914 0.759 . . . . 0.0 110.093 179.576 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.486 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 29.4 t -100.49 125.69 46.84 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 179.617 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.683 ' H ' ' HD2' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -97.83 40.58 1.16 Allowed 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 122.492 1.139 . . . . 0.0 108.629 -179.846 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.486 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 23.4 m -127.25 -42.48 1.69 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 112.671 -2.059 . . . . 0.0 107.662 179.836 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 31.4 p -122.61 -39.91 2.5 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 123.788 0.68 . . . . 0.0 109.833 179.986 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.507 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 1.8 mp0 99.78 58.12 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 126.722 2.514 . . . . 0.0 111.538 179.781 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.8 ttt85 -112.72 158.11 20.46 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 103.188 -2.893 . . . . 0.0 103.188 179.437 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -117.04 160.62 20.69 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 119.472 -0.891 . . . . 0.0 112.39 -179.668 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.434 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 84.3 m-85 -137.9 176.04 9.05 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 113.841 -1.527 . . . . 0.0 107.314 -179.935 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.0 p -120.59 -22.56 6.34 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 116.64 2.089 . . . . 0.0 116.64 -179.495 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.409 ' HD3' ' NE2' ' A' ' 17' ' ' HIS . 40.0 mtp180 -101.48 -54.6 2.72 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 -179.071 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 95.0 p 130.23 -40.41 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 128.551 2.74 . . . . 0.0 108.364 -179.879 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -63.27 -33.85 76.39 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 103.75 -2.685 . . . . 0.0 103.75 179.688 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.409 ' NE2' ' HD3' ' A' ' 14' ' ' ARG . 42.6 m170 -58.26 -60.88 3.08 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 104.524 -2.399 . . . . 0.0 104.524 179.348 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.1 tp -45.43 -56.61 4.82 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.086 179.577 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -49.79 -56.61 9.68 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 179.871 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.1 m -51.08 -44.95 61.29 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 122.019 0.914 . . . . 0.0 109.117 179.64 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.434 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 70.9 t60 -63.1 -47.28 83.5 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-N 113.769 -1.56 . . . . 0.0 112.656 -179.886 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 p -67.56 -11.27 57.66 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.351 -0.843 . . . . 0.0 110.993 179.773 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 50.4 mmt-85 -106.07 45.14 0.99 Allowed 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 179.353 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 89.8 m -127.79 -46.69 1.41 Allowed 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 110.299 -3.137 . . . . 0.0 102.674 179.759 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 . . . . . 0 N--CA 1.493 1.708 0 N-CA-C 104.4 -2.444 . . . . 0.0 104.4 179.562 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo . . . . . 0 N--CA 1.499 1.805 0 N-CA-C 114.324 0.855 . . . . 0.0 114.324 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 79.9 m-85 -116.79 104.18 11.08 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 112.976 -1.92 . . . . 0.0 107.529 -179.934 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.414 ' HA ' ' HA ' ' A' ' 11' ' ' LYS . 21.6 tt0 -102.65 159.66 15.26 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 122.871 1.319 . . . . 0.0 113.635 -179.444 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.521 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 26.3 t -105.0 109.32 21.28 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 111.569 -2.56 . . . . 0.0 105.119 -179.989 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -94.83 48.43 1.19 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 123.386 1.565 . . . . 0.0 107.165 -179.812 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.521 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 23.8 m -123.45 -41.62 2.27 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 102.735 -3.061 . . . . 0.0 102.735 179.591 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.6 p -123.49 -35.7 2.89 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 124.187 0.929 . . . . 0.0 111.593 179.797 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 100.52 57.11 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.576 0 O-C-N 126.055 2.097 . . . . 0.0 109.011 -179.916 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.471 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 22.1 ttt180 -119.28 144.92 46.53 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 179.978 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 4' ' ' GLN . 63.8 pttt -111.86 165.87 11.7 Favored 'General case' 0 N--CA 1.502 2.158 0 C-N-CA 119.189 -1.005 . . . . 0.0 111.274 -179.777 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -139.35 176.15 8.96 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 124.22 0.95 . . . . 0.0 111.162 -179.563 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.0 p -97.34 -36.47 10.38 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 125.409 1.693 . . . . 0.0 109.785 -179.751 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.559 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 59.1 mtt85 -114.32 174.02 6.16 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 124.377 1.048 . . . . 0.0 109.871 179.858 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.49 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 97.7 p -102.15 11.36 38.43 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.726 -179.978 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.04 -32.53 6.01 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 105.497 -2.038 . . . . 0.0 105.497 179.607 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.559 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.7 m170 -67.97 -28.14 67.19 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 179.373 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.5 tp -76.69 -48.13 19.86 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 114.264 -1.334 . . . . 0.0 108.542 179.837 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -52.92 -62.92 1.34 Allowed 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.5 m -43.49 -43.26 5.3 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 124.716 1.26 . . . . 0.0 110.665 179.887 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.471 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 56.1 t60 -64.37 -56.53 13.76 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 113.712 -1.585 . . . . 0.0 114.23 179.992 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.471 ' C ' ' H ' ' A' ' 24' ' ' THR . 33.8 m -58.37 -10.91 2.33 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 112.297 0.481 . . . . 0.0 112.297 -179.446 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.424 ' HA ' HH11 ' A' ' 23' ' ' ARG . 15.9 mmm180 -90.2 38.8 0.94 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 179.537 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.471 ' H ' ' C ' ' A' ' 22' ' ' THR . 87.7 m -131.03 -13.65 3.54 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-N 111.831 -2.44 . . . . 0.0 105.538 179.72 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 104.323 -2.473 . . . . 0.0 104.323 179.744 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm . . . . . 0 N--CA 1.492 1.664 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -76.46 143.77 24.93 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 122.912 2.408 . . . . 0.0 111.069 -174.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -124.46 156.9 36.42 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 113.378 -1.737 . . . . 0.0 108.551 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 71.8 tp60 -133.42 145.19 50.05 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 124.572 1.17 . . . . 0.0 108.481 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.475 ' HA ' HD11 ' A' ' 18' ' ' LEU . 41.6 t -91.29 133.12 35.68 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 104.25 -2.5 . . . . 0.0 104.25 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.402 ' HZ2' ' HB2' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -101.52 34.87 2.45 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 124.412 1.07 . . . . 0.0 108.226 -179.649 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -128.33 -40.74 1.61 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 113.744 -1.571 . . . . 0.0 109.058 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.4 p -123.37 -41.85 2.27 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.482 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 102.39 64.43 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.16 0 O-C-N 126.452 2.345 . . . . 0.0 109.951 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -120.85 152.75 38.02 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 103.578 -2.749 . . . . 0.0 103.578 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -111.91 163.23 14.46 Favored 'General case' 0 N--CA 1.503 2.176 0 C-N-CA 118.668 -1.213 . . . . 0.0 112.382 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.46 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 92.9 m-85 -142.12 176.86 8.64 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 125.079 1.487 . . . . 0.0 109.079 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.8 p -107.52 -25.76 11.23 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 124.373 1.046 . . . . 0.0 111.273 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.569 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 64.6 mtt85 -123.94 164.67 18.83 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 123.88 0.737 . . . . 0.0 110.24 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.9 p -78.59 -33.63 47.41 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -70.66 -32.82 70.24 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 106.411 -1.699 . . . . 0.0 106.411 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.569 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 29.7 m170 -66.16 -62.16 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 105.532 -2.025 . . . . 0.0 105.532 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.475 HD11 ' HA ' ' A' ' 5' ' ' CYS . 43.5 tp -40.53 -56.18 2.13 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 124.34 1.025 . . . . 0.0 110.416 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -51.16 -64.85 0.68 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.247 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.1 m -41.96 -42.53 2.83 Favored 'General case' 0 N--CA 1.504 2.258 0 CA-C-O 121.734 0.778 . . . . 0.0 111.138 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.46 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 40.5 t60 -67.99 -58.01 5.23 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 113.648 -1.615 . . . . 0.0 113.748 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.425 ' C ' ' H ' ' A' ' 24' ' ' THR . 11.9 m -52.1 -38.51 57.55 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.172 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -71.6 24.31 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 117.804 -1.558 . . . . 0.0 114.563 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.425 ' H ' ' C ' ' A' ' 22' ' ' THR . 5.2 t -113.48 -3.72 13.66 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -91.35 -48.68 6.77 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.489 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.6 m -117.08 -37.13 3.62 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 114.424 -1.262 . . . . 0.0 110.24 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 33.26 37.36 0.06 OUTLIER Glycine 0 N--CA 1.503 3.112 0 O-C-N 125.677 1.861 . . . . 0.0 114.316 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.443 ' N ' ' CD ' ' A' ' 28' ' ' GLU . 0.5 OUTLIER -18.67 -62.22 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 125.932 1.693 . . . . 0.0 114.047 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 56.3 pttt . . . . . 0 N--CA 1.494 1.774 0 CA-C-N 112.53 -2.123 . . . . 0.0 110.64 -179.824 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 95.1 mttt . . . . . 0 N--CA 1.493 1.724 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -95.33 166.79 1.51 Allowed 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 122.931 2.42 . . . . 0.0 111.598 165.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -123.49 160.99 25.75 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 112.805 -1.998 . . . . 0.0 106.355 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -137.31 153.03 50.36 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.507 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.406 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 36.0 t -97.69 133.8 41.73 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.423 ' HA ' HE22 ' A' ' 9' ' ' GLN . 95.9 mttt -99.19 38.55 1.39 Allowed 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.406 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 39.4 m -131.78 -42.62 1.01 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 113.858 -1.519 . . . . 0.0 109.744 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.0 p -121.4 -26.66 4.96 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 123.872 0.732 . . . . 0.0 111.139 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.423 HE22 ' HA ' ' A' ' 6' ' ' LYS . 91.2 mm-40 85.17 51.04 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.198 0 O-C-N 125.36 1.663 . . . . 0.0 109.8 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.9 ttt-85 -110.49 156.71 20.49 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 103.189 -2.893 . . . . 0.0 103.189 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -119.13 163.56 16.85 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 119.074 -1.05 . . . . 0.0 112.389 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.441 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 86.5 m-85 -137.65 -174.95 3.91 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 113.793 -1.549 . . . . 0.0 110.054 -179.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.8 p -106.47 -41.84 5.18 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 124.419 1.075 . . . . 0.0 111.559 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.535 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 7.7 mtt180 -113.47 175.96 5.23 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 124.18 0.925 . . . . 0.0 110.114 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.7 p -87.82 -38.28 15.84 Favored 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.036 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -66.57 -29.89 70.06 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.535 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 49.4 m170 -65.07 -59.03 4.57 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.9 tp -45.25 -53.47 8.28 Favored 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -48.68 -61.21 2.15 Favored 'General case' 0 N--CA 1.504 2.25 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 98.1 m -43.57 -43.76 5.78 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.441 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 72.5 t60 -66.46 -53.32 36.71 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 114.884 -1.053 . . . . 0.0 113.015 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 82.8 p -44.0 -28.93 0.52 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 119.682 1.128 . . . . 0.0 110.604 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.442 ' N ' ' HD2' ' A' ' 23' ' ' ARG . 2.1 mpt_? -80.91 44.9 0.78 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 122.958 1.361 . . . . 0.0 113.715 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.419 ' H ' ' H ' ' A' ' 25' ' ' HIS . 29.8 p -131.3 -26.28 2.11 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.419 ' H ' ' H ' ' A' ' 24' ' ' THR . 63.3 m-70 -100.12 -49.07 4.41 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 103.774 -2.676 . . . . 0.0 103.774 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 56.6 p -108.21 44.97 1.05 Allowed 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -122.04 67.79 0.45 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 106.778 -2.529 . . . . 0.0 106.778 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -100.31 -54.3 2.9 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? . . . . . 0 N--CA 1.502 2.167 0 O-C-N 126.319 2.262 . . . . 0.0 115.013 179.914 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 68.0 mttm . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -63.22 159.71 38.09 Favored 'Trans proline' 0 N--CA 1.489 1.25 0 C-N-CA 122.821 2.348 . . . . 0.0 109.72 149.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.484 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 93.9 m-85 -114.76 143.59 44.83 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 101.908 -3.367 . . . . 0.0 101.908 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.408 HE21 ' H ' ' A' ' 5' ' ' CYS . 55.1 tp60 -128.54 154.89 45.69 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 119.837 -0.745 . . . . 0.0 111.35 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.447 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 8.2 t -101.02 136.44 40.86 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 103.572 -2.751 . . . . 0.0 103.572 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.9 mmmm -100.55 41.48 1.17 Allowed 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 122.163 0.982 . . . . 0.0 109.253 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.518 HG21 ' CG ' ' A' ' 25' ' ' HIS . 46.0 m -135.92 -48.38 0.67 Allowed 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.138 -1.846 . . . . 0.0 110.262 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 32.0 p -123.64 -16.81 6.62 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 124.257 0.973 . . . . 0.0 110.006 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 69.7 64.31 0.25 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 124.059 1.885 . . . . 0.0 109.764 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.447 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 28.5 ttt180 -116.1 120.06 37.82 Favored 'General case' 0 C--N 1.304 -1.386 1 N-CA-C 100.019 -4.067 . . . . 0.0 100.019 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.6 ' H ' ' HD2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -93.71 165.49 12.68 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 118.959 -1.096 . . . . 0.0 111.014 -179.662 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -136.48 174.29 10.77 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 113.628 -1.624 . . . . 0.0 109.737 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.4 p -96.85 -39.26 9.5 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 124.926 1.391 . . . . 0.0 107.896 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.469 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 5.5 mtt-85 -111.5 -179.18 3.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 124.921 1.388 . . . . 0.0 108.357 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.484 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 91.4 p -99.28 -21.92 15.84 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.871 -1.513 . . . . 0.0 107.843 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -91.39 26.85 2.12 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 122.419 1.104 . . . . 0.0 108.388 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.469 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 49.1 m170 -125.36 -40.18 2.13 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.6 tp -75.13 -52.0 12.06 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 106.387 -1.709 . . . . 0.0 106.387 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -68.34 -15.75 63.68 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.259 0.349 . . . . 0.0 110.363 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 84.8 m -95.82 -9.01 32.69 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 43.2 t60 -97.35 -55.72 2.75 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.17 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.473 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.3 p -44.02 -21.13 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.081 1.353 . . . . 0.0 113.542 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 20.7 ptt85 -77.07 27.2 0.14 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 124.089 0.868 . . . . 0.0 111.518 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.473 ' H ' ' C ' ' A' ' 22' ' ' THR . 8.9 t -117.08 -22.39 8.42 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.518 ' CG ' HG21 ' A' ' 7' ' ' THR . 66.0 m-70 -104.62 -45.97 4.47 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 113.882 -1.508 . . . . 0.0 107.525 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.3 m -112.77 46.16 1.24 Allowed 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -128.16 -49.29 0.15 Allowed Glycine 0 N--CA 1.49 2.286 0 CA-C-N 112.887 -1.961 . . . . 0.0 109.277 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -123.29 -58.36 1.63 Allowed 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 114.396 -0.902 . . . . 0.0 111.676 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp . . . . . 0 N--CA 1.501 2.083 0 CA-C-N 114.288 -1.324 . . . . 0.0 110.67 -179.891 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 29.1 tptp . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -64.55 168.79 12.38 Favored 'Trans proline' 0 C--N 1.314 -1.258 0 C-N-CA 122.201 1.934 . . . . 0.0 111.857 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.441 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 51.0 m-85 -132.0 112.29 12.26 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 112.458 -2.155 . . . . 0.0 106.386 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -108.39 157.49 18.36 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.469 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 38.0 t -97.07 112.82 24.42 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 103.753 -2.684 . . . . 0.0 103.753 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.433 ' HA ' HE22 ' A' ' 9' ' ' GLN . 0.0 OUTLIER -87.1 29.42 0.83 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 124.472 1.108 . . . . 0.0 109.513 -179.619 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.469 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.7 m -115.34 -41.9 3.23 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 113.597 -1.638 . . . . 0.0 108.518 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.9 p -119.27 -34.62 3.79 Favored 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.592 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.433 HE22 ' HA ' ' A' ' 6' ' ' LYS . 88.0 mm-40 97.2 58.66 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.347 0 O-C-N 126.096 2.122 . . . . 0.0 109.978 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.456 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 48.3 ttt180 -118.94 146.54 44.88 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -112.91 162.51 15.74 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.588 -0.845 . . . . 0.0 112.45 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -138.94 179.61 6.39 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-N 113.219 -1.81 . . . . 0.0 109.51 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 88.6 p -102.44 -33.82 9.39 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 124.379 1.049 . . . . 0.0 108.969 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.544 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.0 mtt85 -119.41 171.66 8.17 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.587 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.441 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 94.3 p -85.16 -35.38 21.74 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.71 -39.77 94.21 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 104.209 -2.515 . . . . 0.0 104.209 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.544 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 37.7 m170 -56.39 -60.15 3.94 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.7 tp -42.82 -56.4 3.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 124.109 0.881 . . . . 0.0 109.74 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -48.57 -60.98 2.27 Favored 'General case' 0 N--CA 1.5 2.062 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.441 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.4 m -41.0 -46.09 2.76 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-O 121.712 0.768 . . . . 0.0 110.62 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.456 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 57.2 t60 -66.94 -55.36 14.94 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.668 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.2 p -45.51 -25.64 0.47 Allowed 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 48.8 mtt180 -52.87 -18.05 1.71 Allowed 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.0 t -87.02 -4.68 59.19 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -114.29 -40.97 3.55 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 30.9 m -109.78 39.84 2.03 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-N 114.519 -1.219 . . . . 0.0 110.227 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -123.53 51.33 0.81 Allowed Glycine 0 N--CA 1.498 2.795 0 N-CA-C 108.184 -1.967 . . . . 0.0 108.184 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -114.81 177.28 4.71 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 115.01 -0.595 . . . . 0.0 109.908 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 122.638 1.209 . . . . 0.0 110.001 -179.947 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.3 pttm . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 119.865 -0.112 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -69.22 150.04 71.04 Favored 'Trans proline' 0 N--CA 1.491 1.36 0 C-N-CA 123.17 2.58 . . . . 0.0 111.327 167.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.467 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 88.6 m-85 -122.46 152.61 40.1 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 105.176 -2.157 . . . . 0.0 105.176 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -140.2 154.17 46.83 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.496 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.517 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 40.2 t -98.44 117.23 32.38 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -92.26 37.56 0.99 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.517 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 57.2 m -123.39 -43.9 2.16 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 113.339 -1.755 . . . . 0.0 107.31 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 p -118.33 -36.86 3.45 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 123.921 0.763 . . . . 0.0 111.019 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 99.41 55.77 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 126.269 2.23 . . . . 0.0 109.079 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.0 157.42 18.69 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 103.225 -2.88 . . . . 0.0 103.225 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -120.34 158.47 27.05 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.812 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -138.31 171.53 14.25 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.888 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.4 p -96.67 -36.73 10.6 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.108 -1.86 . . . . 0.0 108.273 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.565 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 60.5 mtt85 -116.1 175.99 5.3 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 124.708 1.255 . . . . 0.0 110.96 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.467 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 90.1 p -95.38 -34.25 12.19 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 113.474 -1.694 . . . . 0.0 106.542 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.78 -38.28 90.44 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 104.659 -2.349 . . . . 0.0 104.659 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.565 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 31.5 m170 -59.94 -58.62 7.77 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.6 tp -44.6 -55.52 5.12 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.747 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.2 tttm -51.05 -58.8 5.16 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.193 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.9 m -43.86 -46.17 7.8 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 121.822 0.82 . . . . 0.0 110.159 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -64.32 -56.55 13.7 Favored 'General case' 0 N--CA 1.488 1.438 0 CA-C-N 113.182 -1.827 . . . . 0.0 114.046 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.419 ' C ' ' H ' ' A' ' 24' ' ' THR . 37.9 p -44.07 -30.68 0.78 Allowed 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.253 0.621 . . . . 0.0 110.414 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.04 39.43 0.37 Allowed 'General case' 0 N--CA 1.487 1.42 0 CA-C-N 114.112 -1.404 . . . . 0.0 111.319 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.419 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.5 t -124.37 -27.17 3.81 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 104.687 -2.338 . . . . 0.0 104.687 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.403 ' H ' ' H ' ' A' ' 24' ' ' THR . 70.9 m-70 -97.85 -47.53 5.53 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 103.363 -2.828 . . . . 0.0 103.363 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.5 m -111.36 59.2 0.62 Allowed 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -109.92 73.6 0.21 Allowed Glycine 0 N--CA 1.494 2.546 0 N-CA-C 106.594 -2.602 . . . . 0.0 106.594 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -1.1 130.59 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 128.064 2.545 . . . . 0.0 117.554 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.9 mmtm . . . . . 0 N--CA 1.497 1.917 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.309 -179.633 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 120.841 0.353 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -65.01 172.95 6.51 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 123.21 2.607 . . . . 0.0 110.325 148.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.535 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 81.1 m-85 -127.72 159.45 34.72 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 114.011 -1.449 . . . . 0.0 109.228 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -134.82 151.64 51.1 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 119.545 -0.862 . . . . 0.0 113.282 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 40.8 t -94.73 133.1 38.77 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 113.337 -1.756 . . . . 0.0 106.448 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.442 ' HA ' HE22 ' A' ' 9' ' ' GLN . 14.4 mmmm -100.05 40.36 1.25 Allowed 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.422 HG21 ' CG ' ' A' ' 25' ' ' HIS . 53.3 m -134.84 -47.12 0.73 Allowed 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 113.026 -1.897 . . . . 0.0 108.453 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.447 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 29.9 p -125.33 4.15 7.75 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 123.891 0.744 . . . . 0.0 111.461 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.442 HE22 ' HA ' ' A' ' 6' ' ' LYS . 87.0 mm-40 53.54 52.78 12.65 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 122.752 1.263 . . . . 0.0 110.328 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.447 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 19.4 ttt180 -105.34 154.39 20.35 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 102.666 -3.087 . . . . 0.0 102.666 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -116.93 158.87 23.34 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.903 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -135.91 -176.07 4.18 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 123.723 0.64 . . . . 0.0 110.075 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.5 p -103.09 -41.13 6.19 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 124.67 1.231 . . . . 0.0 110.255 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.498 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 28.7 mtt180 -114.89 163.83 14.99 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 124.169 0.918 . . . . 0.0 109.942 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.535 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 88.4 p -78.5 -33.65 47.98 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -69.49 -35.03 75.17 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 105.64 -1.985 . . . . 0.0 105.64 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.498 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 33.7 m170 -63.06 -59.01 5.37 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.7 tp -42.88 -53.94 4.43 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.857 0.723 . . . . 0.0 109.667 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -53.79 -57.64 10.15 Favored 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 119.875 -0.73 . . . . 0.0 111.468 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.0 m -41.34 -46.46 3.3 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 121.795 0.807 . . . . 0.0 110.142 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.1 t60 -65.49 -56.7 10.93 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 112.974 -1.921 . . . . 0.0 113.507 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.427 ' C ' ' H ' ' A' ' 24' ' ' THR . 45.4 p -52.26 -29.22 21.94 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.8 ttp180 -82.81 42.19 0.77 Allowed 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 123.032 1.396 . . . . 0.0 110.579 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.427 ' H ' ' C ' ' A' ' 22' ' ' THR . 5.9 t -131.52 -22.36 2.45 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 105.556 -2.016 . . . . 0.0 105.556 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.426 ' H ' ' H ' ' A' ' 24' ' ' THR . 78.3 m-70 -99.23 -48.19 4.92 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 104.832 -2.284 . . . . 0.0 104.832 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 40.7 p -114.45 56.04 0.73 Allowed 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 113.964 -1.471 . . . . 0.0 107.229 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -119.53 -49.07 0.32 Allowed Glycine 0 N--CA 1.496 2.635 0 N-CA-C 108.374 -1.89 . . . . 0.0 108.374 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -91.36 -13.6 32.21 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.071 -1.064 . . . . 0.0 110.17 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.4 tttt . . . . . 0 N--CA 1.495 1.82 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 179.884 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.8 OUTLIER -34.35 154.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 124.432 3.422 . . . . 0.0 114.95 172.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.435 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 85.8 m-85 -121.34 157.8 29.62 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 113.384 -1.735 . . . . 0.0 109.64 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.425 HE21 ' HA ' ' A' ' 9' ' ' GLN . 72.8 tp60 -130.73 145.12 51.86 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 124.297 0.998 . . . . 0.0 108.795 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.407 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 40.4 t -92.97 138.89 31.08 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.452 ' HA ' HE22 ' A' ' 9' ' ' GLN . 56.3 tttp -105.24 36.1 2.6 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.8 m -131.57 -38.18 1.17 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 114.476 -1.238 . . . . 0.0 109.3 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.3 p -125.25 -39.04 2.24 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.538 -0.865 . . . . 0.0 109.406 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.452 HE22 ' HA ' ' A' ' 6' ' ' LYS . 90.6 mm-40 98.33 60.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 126.587 2.429 . . . . 0.0 109.81 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.407 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 39.2 ttt-85 -112.51 159.43 18.79 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 103.503 -2.777 . . . . 0.0 103.503 179.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -115.91 158.18 23.39 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.167 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.482 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 93.9 m-85 -139.59 179.65 6.44 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 124.157 0.911 . . . . 0.0 110.051 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.9 p -107.33 -39.75 5.58 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 124.735 1.272 . . . . 0.0 110.313 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.38 171.11 7.71 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.435 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 65.4 p -84.73 -40.16 17.64 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -62.75 -29.71 70.89 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.8 m170 -66.34 -60.84 2.39 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.8 tp -43.6 -47.25 7.46 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 123.752 0.658 . . . . 0.0 111.365 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -58.05 -67.24 0.36 Allowed 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 119.685 -0.806 . . . . 0.0 109.624 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.2 m -35.39 -48.02 0.46 Allowed 'General case' 0 N--CA 1.504 2.231 0 O-C-N 124.641 1.213 . . . . 0.0 110.325 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.482 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 30.1 t60 -57.42 -61.17 2.68 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.654 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.473 ' C ' ' H ' ' A' ' 24' ' ' THR . 56.9 m -52.9 -12.74 0.35 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 124.255 0.972 . . . . 0.0 111.913 -179.648 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -90.46 40.29 1.01 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 123.373 1.559 . . . . 0.0 107.035 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.473 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.3 t -126.09 -26.11 3.45 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 103.585 -2.746 . . . . 0.0 103.585 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -96.2 -55.47 2.94 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 105.287 -2.116 . . . . 0.0 105.287 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 30.3 p -124.52 57.69 1.24 Allowed 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 113.831 -1.531 . . . . 0.0 110.684 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -122.7 -28.56 1.4 Allowed Glycine 0 N--CA 1.497 2.72 0 N-CA-C 108.434 -1.866 . . . . 0.0 108.434 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.481 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.4 mp0 -103.32 47.82 0.87 Allowed 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? . . . . . 0 N--CA 1.493 1.724 0 CA-C-N 113.869 -1.514 . . . . 0.0 108.74 -179.831 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -73.42 161.44 42.52 Favored 'Trans proline' 0 N--CA 1.493 1.476 0 C-N-CA 122.641 2.227 . . . . 0.0 113.148 -173.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 88.8 m-85 -131.31 162.24 30.52 Favored 'General case' 0 N--CA 1.499 2.0 0 CA-C-N 113.013 -1.903 . . . . 0.0 108.937 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.509 HE21 ' NZ ' ' A' ' 11' ' ' LYS . 50.8 tt0 -139.99 152.45 46.3 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.975 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.432 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 35.7 t -99.56 129.71 45.74 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 105.955 -1.868 . . . . 0.0 105.955 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -99.18 34.31 2.18 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 122.011 0.91 . . . . 0.0 109.445 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.432 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 53.5 m -123.17 -39.7 2.46 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.42 -1.718 . . . . 0.0 107.871 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -124.02 -40.78 2.26 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.292 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 104.41 51.74 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.72 0 O-C-N 126.299 2.249 . . . . 0.0 110.799 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 40.9 ttt85 -110.94 148.87 31.57 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 104.592 -2.373 . . . . 0.0 104.592 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.509 ' NZ ' HE21 ' A' ' 4' ' ' GLN . 2.3 mptp? -112.6 165.16 12.51 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 119.159 -1.016 . . . . 0.0 110.095 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -138.26 178.5 7.09 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.683 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 38.7 p -101.9 -40.25 6.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 125.175 1.547 . . . . 0.0 109.514 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.19 175.37 5.5 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 124.304 1.003 . . . . 0.0 109.55 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.442 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 74.8 p -89.84 -34.77 16.0 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.298 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.1 p-10 -65.05 -30.75 71.74 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -62.6 -61.54 2.35 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 106.063 -1.829 . . . . 0.0 106.063 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.2 tp -44.75 -50.99 9.78 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 124.115 0.884 . . . . 0.0 109.655 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -53.47 -60.27 3.52 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.802 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -47.55 -42.33 23.3 Favored 'General case' 0 N--CA 1.5 2.07 0 CA-C-O 121.646 0.736 . . . . 0.0 110.626 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -65.41 -57.65 7.81 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 113.781 -1.554 . . . . 0.0 114.233 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.9 p -45.03 -39.2 5.45 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.602 0.761 . . . . 0.0 111.651 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -82.85 39.02 0.6 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 116.939 -1.905 . . . . 0.0 112.98 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.0 t -121.23 -5.92 9.41 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -96.1 -23.47 16.75 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -115.82 -40.52 3.33 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 124.445 1.091 . . . . 0.0 108.374 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -116.54 49.37 0.86 Allowed Glycine 0 N--CA 1.496 2.693 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.716 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -23.91 114.85 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.175 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt . . . . . 0 N--CA 1.508 2.44 0 N-CA-C 116.543 2.053 . . . . 0.0 116.543 -179.952 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.497 ' HB2' ' HD2' ' A' ' 2' ' ' PRO . 18.6 ptpt . . . . . 0 N--CA 1.496 1.864 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.497 ' HD2' ' HB2' ' A' ' 1' ' ' LYS . 18.4 Cg_endo -88.12 129.28 2.38 Favored 'Trans proline' 0 C--N 1.32 -0.971 0 C-N-CA 121.926 1.751 . . . . 0.0 112.145 -173.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.528 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 96.6 m-85 -120.72 160.27 23.66 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -147.22 160.61 42.27 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 117.773 -1.571 . . . . 0.0 111.959 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.411 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 43.2 t -93.68 142.41 27.38 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.8 ttpp -107.07 32.76 4.37 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 125.123 1.515 . . . . 0.0 107.606 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.411 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 57.9 m -127.57 -38.31 1.92 Allowed 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 114.514 -1.221 . . . . 0.0 109.378 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.6 p -122.42 -41.03 2.42 Favored 'General case' 0 N--CA 1.499 2.014 0 C-N-CA 119.861 -0.736 . . . . 0.0 111.193 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 101.58 52.36 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 O-C-N 126.53 2.394 . . . . 0.0 109.975 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.22 148.0 33.78 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 103.48 -2.785 . . . . 0.0 103.48 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -112.74 160.68 17.7 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 118.347 -1.341 . . . . 0.0 111.619 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.418 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 83.2 m-85 -131.34 178.89 6.37 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-N 112.615 -2.084 . . . . 0.0 111.131 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.6 p -103.24 -31.55 10.04 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 125.383 1.677 . . . . 0.0 112.171 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.9 mtp180 -116.5 179.12 4.09 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 124.637 1.211 . . . . 0.0 107.876 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.528 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 89.6 p -108.7 20.74 18.15 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.973 0.892 . . . . 0.0 110.695 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.93 -35.06 3.57 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 55.7 m170 -59.8 -54.25 48.4 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 103.483 -2.784 . . . . 0.0 103.483 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.407 HD11 ' HA ' ' A' ' 5' ' ' CYS . 63.9 tp -36.83 -55.12 0.91 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 113.267 -1.788 . . . . 0.0 111.561 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.9 tptt -60.28 -59.18 5.83 Favored 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 m -42.68 -31.19 0.44 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 124.511 1.132 . . . . 0.0 111.376 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.418 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 16.2 t60 -82.28 -56.75 3.72 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 113.415 -1.721 . . . . 0.0 112.633 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.433 ' C ' ' H ' ' A' ' 24' ' ' THR . 14.6 m -43.86 -31.53 0.87 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 124.132 0.895 . . . . 0.0 111.522 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.42 43.13 0.53 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 118.5 -1.28 . . . . 0.0 112.453 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.433 ' H ' ' C ' ' A' ' 22' ' ' THR . 8.7 t -120.77 -24.92 5.56 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 103.053 -2.943 . . . . 0.0 103.053 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.407 ' H ' ' H ' ' A' ' 24' ' ' THR . 68.9 m-70 -90.11 -43.94 10.13 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 103.888 -2.634 . . . . 0.0 103.888 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.8 m -118.43 54.78 0.92 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 104.522 -2.399 . . . . 0.0 104.522 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -6.72 -63.33 0.01 OUTLIER Glycine 0 N--CA 1.502 3.071 0 CA-C-N 112.822 -1.99 . . . . 0.0 116.183 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -99.56 83.12 2.74 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm . . . . . 0 N--CA 1.506 2.338 0 O-C-N 126.396 2.31 . . . . 0.0 108.686 179.782 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt . . . . . 0 N--CA 1.493 1.716 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -94.48 160.57 1.95 Allowed 'Trans proline' 0 C--N 1.314 -1.262 0 C-N-CA 123.047 2.498 . . . . 0.0 111.954 171.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -120.26 157.11 29.84 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 105.564 -2.013 . . . . 0.0 105.564 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.462 HE21 ' HA ' ' A' ' 9' ' ' GLN . 71.1 tp60 -135.8 148.09 48.59 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 120.122 -0.631 . . . . 0.0 112.35 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.469 ' HA ' HD11 ' A' ' 18' ' ' LEU . 16.7 t -99.15 133.67 43.11 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 101.936 -3.357 . . . . 0.0 101.936 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.532 ' HD3' ' N ' ' A' ' 6' ' ' LYS . 3.3 mppt? -105.9 35.27 2.96 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.247 0.967 . . . . 0.0 109.063 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.8 m -123.67 -40.86 2.29 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 113.158 -1.837 . . . . 0.0 106.699 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.423 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 24.8 p -130.2 -10.18 4.22 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 123.889 0.743 . . . . 0.0 111.196 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.462 ' HA ' HE21 ' A' ' 4' ' ' GLN . 17.6 mp0 67.65 60.87 0.45 Allowed 'General case' 0 N--CA 1.493 1.675 0 CA-C-O 123.066 1.412 . . . . 0.0 111.018 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.423 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 21.0 ttt180 -116.13 145.1 43.33 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 102.04 -3.318 . . . . 0.0 102.04 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -107.77 162.33 14.09 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.865 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -140.74 -179.9 6.32 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.565 1.165 . . . . 0.0 110.158 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 64.6 p -102.75 -36.78 8.16 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.13 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.44 -176.9 3.32 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 124.307 1.004 . . . . 0.0 111.366 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 95.6 p -98.53 -37.01 9.73 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.488 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -61.02 -29.46 69.73 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -66.31 -67.89 0.41 Allowed 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.469 HD11 ' HA ' ' A' ' 5' ' ' CYS . 62.1 tp -38.62 -48.28 1.43 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 123.871 0.732 . . . . 0.0 112.373 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -53.82 -67.83 0.23 Allowed 'General case' 0 N--CA 1.499 2.0 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.882 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.2 m -46.71 -36.33 7.04 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 114.183 -1.372 . . . . 0.0 110.624 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 39.8 t60 -66.91 -60.2 2.85 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-N 114.77 -1.105 . . . . 0.0 112.03 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.5 m -50.7 -25.14 3.94 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 121.203 0.525 . . . . 0.0 112.407 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.446 ' HB3' ' NH2' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -58.69 -8.2 1.22 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.446 179.374 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 t -91.46 -3.83 56.2 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-O 121.069 0.462 . . . . 0.0 110.205 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 -110.66 -47.22 3.28 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 114.595 -1.184 . . . . 0.0 107.807 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.3 t -108.59 -25.82 10.7 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 116.465 2.024 . . . . 0.0 116.465 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -102.03 59.21 0.59 Allowed Glycine 0 N--CA 1.498 2.828 0 C-N-CA 120.342 -0.932 . . . . 0.0 114.777 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -118.59 51.05 1.12 Allowed 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm . . . . . 0 N--CA 1.494 1.734 0 CA-C-N 113.542 -1.663 . . . . 0.0 109.808 -179.828 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -63.53 174.29 3.68 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 123.672 2.915 . . . . 0.0 113.756 -175.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -121.92 163.43 19.28 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 112.608 -2.087 . . . . 0.0 106.974 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 73.9 tp60 -136.62 146.96 46.63 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.908 0.755 . . . . 0.0 110.952 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.412 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 12.6 t -104.03 130.91 51.72 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 101.342 -3.577 . . . . 0.0 101.342 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -106.47 42.97 1.19 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 122.316 1.055 . . . . 0.0 108.817 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.412 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 94.7 m -126.71 -40.58 1.9 Allowed 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 105.595 -2.002 . . . . 0.0 105.595 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 p -121.4 -32.19 3.91 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 123.987 0.805 . . . . 0.0 108.845 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 89.35 55.83 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 126.25 2.219 . . . . 0.0 109.448 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 44.4 ttt-85 -115.36 154.66 28.79 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HD3' ' H ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -114.5 167.65 10.55 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 118.852 -1.139 . . . . 0.0 110.349 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.424 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 88.6 m-85 -139.93 -179.76 6.14 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 114.297 -1.319 . . . . 0.0 109.159 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.8 p -104.06 -44.89 4.88 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 124.475 1.11 . . . . 0.0 110.094 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.587 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 23.7 mtt180 -109.96 -176.33 2.97 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.437 1.085 . . . . 0.0 109.428 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.6 p -95.19 -29.93 14.28 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.008 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -76.65 -4.31 42.4 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.587 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 46.1 m170 -97.16 -10.3 26.19 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 124.973 1.421 . . . . 0.0 107.903 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.7 tp -106.46 -54.22 2.51 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.359 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -66.13 -2.08 3.84 Favored 'General case' 0 N--CA 1.506 2.33 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.5 m -105.55 -39.96 5.93 Favored 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 104.254 -2.498 . . . . 0.0 104.254 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.424 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 50.1 t60 -58.54 -57.16 14.19 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.455 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.435 ' C ' ' H ' ' A' ' 24' ' ' THR . 7.7 p -37.26 -40.86 0.36 Allowed 'General case' 0 C--N 1.308 -1.218 0 O-C-N 125.282 1.614 . . . . 0.0 111.55 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.515 ' HA ' ' H ' ' A' ' 27' ' ' GLY . 36.7 mtt180 -76.93 37.97 0.2 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 125.117 1.511 . . . . 0.0 113.066 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.435 ' H ' ' C ' ' A' ' 22' ' ' THR . 11.2 t -115.96 -24.59 8.04 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 103.585 -2.746 . . . . 0.0 103.585 179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -95.74 -34.56 11.87 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 100.705 -3.813 . . . . 0.0 100.705 179.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.484 ' O ' ' N ' ' A' ' 28' ' ' GLU . 92.3 m 114.48 46.39 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 129.977 3.311 . . . . 0.0 106.771 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.515 ' H ' ' HA ' ' A' ' 23' ' ' ARG . . . 16.13 44.79 0.01 OUTLIER Glycine 0 N--CA 1.502 3.099 0 CA-C-N 110.804 -2.907 . . . . 0.0 114.399 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.579 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -73.5 158.59 34.62 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 112.101 -2.049 . . . . 0.0 111.906 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm . . . . . 0 N--CA 1.495 1.808 0 CA-C-N 113.765 -1.561 . . . . 0.0 109.508 -179.925 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.456 0.169 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -57.56 165.66 5.78 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 123.661 2.907 . . . . 0.0 112.984 157.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.427 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 64.6 m-85 -124.32 163.47 21.63 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-N 113.087 -1.87 . . . . 0.0 108.066 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.0 tp60 -139.7 137.52 35.24 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 123.884 0.74 . . . . 0.0 109.486 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.462 ' HA ' HD11 ' A' ' 18' ' ' LEU . 44.0 t -84.4 144.21 28.94 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 179.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -105.87 32.57 4.27 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 124.743 1.277 . . . . 0.0 108.997 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 97.2 m -135.08 -39.51 0.76 Allowed 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 114.317 -1.31 . . . . 0.0 111.188 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.7 p -119.95 -45.71 2.46 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 119.465 -0.894 . . . . 0.0 109.475 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 103.48 61.51 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 126.942 2.651 . . . . 0.0 110.474 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.6 ttt85 -115.29 158.84 21.79 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 103.273 -2.862 . . . . 0.0 103.273 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.695 ' HB2' ' HZ3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -113.72 163.74 14.62 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 119.231 -0.988 . . . . 0.0 109.759 -179.767 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.488 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 99.2 m-85 -139.98 -179.41 5.94 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 124.553 1.158 . . . . 0.0 110.696 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.3 p -104.43 -37.18 7.29 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 113.637 -1.619 . . . . 0.0 110.57 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.18 -172.32 2.2 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 124.175 0.922 . . . . 0.0 110.567 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 80.2 p -97.4 -33.48 11.39 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -86.54 10.35 15.65 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.465 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -115.87 -18.18 10.81 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 105.835 -1.913 . . . . 0.0 105.835 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' A' ' 5' ' ' CYS . 36.2 tp -93.46 -57.51 2.57 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.374 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.421 ' NZ ' ' HB2' ' A' ' 19' ' ' LYS . 3.7 ttmp? -53.1 -64.19 0.9 Allowed 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.2 m -38.93 -43.65 0.98 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.257 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.488 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 22.0 t60 -69.68 -58.5 3.85 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 113.7 -1.591 . . . . 0.0 112.336 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.405 ' N ' ' CD2' ' A' ' 21' ' ' HIS . 21.8 m -45.78 -40.38 9.54 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 121.753 0.787 . . . . 0.0 110.356 -179.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.6 ttp85 -85.11 52.28 2.4 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-O 123.867 1.794 . . . . 0.0 111.865 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.9 t -137.01 -19.78 1.28 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 111.363 -2.653 . . . . 0.0 105.397 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 -71.33 -39.21 71.5 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.8 m -106.4 -49.23 3.39 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 105.572 -2.01 . . . . 0.0 105.572 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.71 -58.73 0.62 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 108.957 -1.657 . . . . 0.0 108.957 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -115.12 129.07 56.58 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 113.472 -1.364 . . . . 0.0 109.127 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.9 mttm . . . . . 0 N--CA 1.496 1.837 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.151 -179.976 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -52.15 139.72 52.36 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 123.192 2.595 . . . . 0.0 116.227 -157.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 79.0 m-85 -128.66 158.89 37.28 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 112.688 -2.051 . . . . 0.0 107.492 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -142.76 155.81 44.9 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.73 0.776 . . . . 0.0 110.857 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.508 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 15.1 t -104.31 107.89 19.02 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 179.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.13 33.58 0.68 Allowed 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 122.514 1.15 . . . . 0.0 110.132 -179.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.508 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 35.0 m -112.71 -41.67 3.77 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 112.688 -2.051 . . . . 0.0 106.507 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 32.1 p -121.48 -29.34 4.44 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 124.041 0.838 . . . . 0.0 109.66 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.0 mp0 90.03 60.27 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 O-C-N 125.851 1.97 . . . . 0.0 110.831 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.4 ttt180 -121.05 151.68 39.52 Favored 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 104.627 -2.361 . . . . 0.0 104.627 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -116.28 161.14 19.45 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.417 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 90.3 m-85 -138.22 176.54 8.61 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 113.078 -1.874 . . . . 0.0 109.283 -179.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.7 p -102.71 -32.71 9.71 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 124.302 1.001 . . . . 0.0 110.573 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.4 ' CD ' ' CE1' ' A' ' 17' ' ' HIS . 32.7 mtp85 -116.54 176.3 5.17 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 124.484 1.115 . . . . 0.0 110.085 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 81.7 p -90.25 -36.58 14.65 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -66.16 -40.27 90.4 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 104.194 -2.521 . . . . 0.0 104.194 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.4 ' CE1' ' CD ' ' A' ' 14' ' ' ARG . 39.3 m170 -54.94 -58.92 5.66 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.2 tp -45.47 -52.82 9.7 Favored 'General case' 0 N--CA 1.502 2.132 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -52.54 -55.45 22.07 Favored 'General case' 0 N--CA 1.503 2.189 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.53 ' HA ' ' CZ ' ' A' ' 23' ' ' ARG . 52.9 m -42.94 -46.63 5.47 Favored 'General case' 0 N--CA 1.505 2.313 0 CA-C-O 121.612 0.72 . . . . 0.0 109.775 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.417 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 61.2 t60 -64.72 -56.81 11.37 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 113.359 -1.746 . . . . 0.0 114.588 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 48.7 p -43.77 -34.63 1.6 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.53 ' CZ ' ' HA ' ' A' ' 20' ' ' THR . 66.9 mtt85 -42.85 -23.62 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 115.248 1.573 . . . . 0.0 115.248 179.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.2 t -95.29 19.6 10.48 Favored 'General case' 0 N--CA 1.512 2.631 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 31.2 m-70 -124.17 -43.17 2.09 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 104.226 -2.509 . . . . 0.0 104.226 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 64.5 m -72.14 -48.34 44.31 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 104.286 -2.487 . . . . 0.0 104.286 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -108.18 47.38 1.05 Allowed Glycine 0 N--CA 1.488 2.102 1 N-CA-C 101.405 -4.678 . . . . 0.0 101.405 179.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -13.98 -94.47 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 111.088 -2.556 . . . . 0.0 117.325 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.5 pttt . . . . . 0 N--CA 1.493 1.682 0 O-C-N 124.852 1.345 . . . . 0.0 110.804 -179.752 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.4 ptmm? . . . . . 0 N--CA 1.492 1.642 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -73.01 167.17 28.08 Favored 'Trans proline' 0 N--CA 1.49 1.301 0 C-N-CA 122.783 2.322 . . . . 0.0 110.32 167.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.471 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 57.4 m-85 -123.67 161.25 25.47 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 113.577 -1.647 . . . . 0.0 107.631 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -130.43 149.27 52.18 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 124.188 0.93 . . . . 0.0 111.149 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.457 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 42.1 t -99.16 125.83 44.8 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 103.814 -2.661 . . . . 0.0 103.814 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -97.18 40.47 1.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 122.476 1.131 . . . . 0.0 108.644 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.457 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.7 m -131.6 -46.98 0.97 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 112.534 -2.121 . . . . 0.0 107.045 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 p -129.52 7.18 5.28 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 123.94 0.775 . . . . 0.0 112.731 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.6 mm-40 51.36 57.51 6.53 Favored 'General case' 0 N--CA 1.502 2.131 0 CA-C-O 122.735 1.255 . . . . 0.0 111.765 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.413 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 21.5 ttt180 -118.08 140.94 49.03 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 103.123 -2.918 . . . . 0.0 103.123 179.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -105.52 165.97 10.77 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -179.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -140.76 -171.46 3.24 Favored 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 113.428 -1.715 . . . . 0.0 110.446 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.6 p -106.38 -39.17 5.98 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 124.438 1.086 . . . . 0.0 110.571 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.403 ' HB2' ' CG ' ' A' ' 17' ' ' HIS . 3.7 mtp-105 -119.09 179.94 4.01 Favored 'General case' 0 N--CA 1.5 2.071 0 CA-C-O 121.78 0.8 . . . . 0.0 109.77 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.471 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 80.3 p -94.08 -33.09 13.51 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -76.49 -3.39 37.06 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.403 ' CG ' ' HB2' ' A' ' 14' ' ' ARG . 41.3 m170 -95.9 -56.03 2.8 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 101.575 -3.491 . . . . 0.0 101.575 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.411 HD11 ' HA ' ' A' ' 5' ' ' CYS . 69.1 tp -46.47 -50.48 16.87 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -52.06 -64.72 0.72 Allowed 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.5 m -40.22 -43.61 1.72 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.329 0.585 . . . . 0.0 110.68 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 41.0 t60 -64.64 -59.36 4.37 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 114.103 -1.408 . . . . 0.0 112.33 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.8 p -45.35 -34.57 3.08 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -43.07 -25.01 0.09 Allowed 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.1 t -92.38 9.57 33.61 Favored 'General case' 0 N--CA 1.511 2.586 0 N-CA-C 116.165 1.913 . . . . 0.0 116.165 -179.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.418 ' CG ' HG21 ' A' ' 7' ' ' THR . 27.5 m-70 -107.1 -38.78 5.91 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 104.55 -2.389 . . . . 0.0 104.55 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 25.5 p -83.5 -54.58 4.85 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 113.319 -1.764 . . . . 0.0 108.934 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.1 -46.69 1.35 Allowed Glycine 0 N--CA 1.491 2.355 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.973 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -105.82 -41.49 5.41 Favored 'General case' 0 N--CA 1.496 1.863 0 CA-C-N 114.076 -1.062 . . . . 0.0 111.92 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt . . . . . 0 N--CA 1.499 1.993 0 O-C-N 124.457 1.098 . . . . 0.0 109.933 -179.838 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 120.991 0.424 . . . . 0.0 110.94 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -61.64 145.25 97.73 Favored 'Trans proline' 0 N--CA 1.491 1.357 0 C-N-CA 122.326 2.017 . . . . 0.0 109.481 170.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.5 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 81.7 m-85 -120.56 155.17 34.24 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -141.0 154.96 46.27 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.19 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.7 t -92.55 140.81 29.18 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 114.149 -1.387 . . . . 0.0 107.806 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.615 ' HD3' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -100.38 29.1 4.55 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 114.759 -1.109 . . . . 0.0 109.851 -179.727 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.513 HG21 ' CG ' ' A' ' 25' ' ' HIS . 56.0 m -129.6 -43.0 1.27 Allowed 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 114.097 -1.41 . . . . 0.0 110.764 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.1 p -125.25 -0.83 7.68 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 119.568 -0.853 . . . . 0.0 110.027 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 54.35 60.37 3.61 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 122.948 1.356 . . . . 0.0 110.556 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -112.44 149.97 31.83 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 103.302 -2.851 . . . . 0.0 103.302 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -110.99 160.22 17.01 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 119.085 -1.046 . . . . 0.0 112.025 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -137.58 175.41 9.63 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 114.495 -1.229 . . . . 0.0 109.528 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.2 p -98.58 -40.81 8.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 124.708 1.255 . . . . 0.0 110.41 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.47 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 42.6 mtt180 -113.77 167.24 10.79 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 124.258 0.974 . . . . 0.0 110.09 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.5 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 84.3 p -81.64 -36.15 29.2 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -64.92 -30.72 71.73 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.47 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.7 m170 -66.97 -60.38 2.68 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 tp -43.29 -52.52 5.71 Favored 'General case' 0 N--CA 1.503 2.191 0 CA-C-O 121.303 0.573 . . . . 0.0 110.603 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -49.45 -65.4 0.57 Allowed 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.832 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 85.8 m -43.82 -44.74 7.0 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.853 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -58.71 -60.29 4.06 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.4 m -45.35 -21.9 0.11 Allowed 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 114.861 -1.063 . . . . 0.0 113.734 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.1 ptt-85 -50.12 -24.6 2.84 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.3 t -82.24 7.17 14.47 Favored 'General case' 0 N--CA 1.505 2.28 0 CA-C-O 121.45 0.643 . . . . 0.0 112.183 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.513 ' CG ' HG21 ' A' ' 7' ' ' THR . 59.8 m-70 -124.26 -50.9 1.77 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.198 -1.365 . . . . 0.0 109.958 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.4 m -101.86 -29.54 11.79 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-N 112.696 -2.047 . . . . 0.0 114.065 -179.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -99.84 34.71 5.27 Favored Glycine 0 N--CA 1.5 2.945 0 C-N-CA 119.996 -1.097 . . . . 0.0 112.209 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -132.72 -59.1 0.91 Allowed 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 179.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.3 pttm . . . . . 0 N--CA 1.497 1.884 0 CA-C-N 112.984 -1.916 . . . . 0.0 109.773 179.899 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -73.6 161.91 41.01 Favored 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 122.736 2.291 . . . . 0.0 112.053 174.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -125.66 155.78 40.3 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-N 112.238 -2.255 . . . . 0.0 106.19 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -136.2 152.08 50.4 Favored 'General case' 0 N--CA 1.499 1.975 0 C-N-CA 119.221 -0.992 . . . . 0.0 112.212 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.501 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 27.0 t -101.11 109.12 20.97 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.58 ' H ' ' HD2' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -88.06 39.68 0.91 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.501 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 27.6 m -122.76 -39.8 2.49 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 113.195 -1.82 . . . . 0.0 106.808 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.428 ' O ' ' CB ' ' A' ' 9' ' ' GLN . 31.4 p -125.21 -32.74 2.94 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.428 ' CB ' ' O ' ' A' ' 8' ' ' CYS . 1.0 OUTLIER 93.72 57.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 126.358 2.286 . . . . 0.0 110.201 179.693 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.45 155.83 29.0 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 104.609 -2.367 . . . . 0.0 104.609 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -118.71 161.43 20.11 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.497 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 82.5 m-85 -137.94 -175.49 4.11 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.357 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.5 p -105.03 -37.51 6.92 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 124.24 0.963 . . . . 0.0 111.246 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.516 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 54.7 mtt85 -118.69 -175.7 2.94 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 123.804 0.69 . . . . 0.0 110.423 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 88.6 p -93.07 -33.51 14.05 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -76.51 3.21 11.8 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.516 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 39.1 m170 -103.04 -42.22 5.86 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.7 tp -65.56 -49.45 68.8 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.847 -1.07 . . . . 0.0 109.155 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -55.61 -64.43 0.85 Allowed 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 47.3 m -41.07 -38.42 1.02 Allowed 'General case' 0 N--CA 1.503 2.19 0 O-C-N 124.278 0.986 . . . . 0.0 111.968 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 46.5 t60 -73.36 -55.33 6.53 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.5 m -49.48 -23.34 1.52 Allowed 'General case' 0 N--CA 1.508 2.453 0 CA-C-O 120.931 0.396 . . . . 0.0 112.04 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -48.64 -26.95 2.52 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.098 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.0 p -79.66 5.48 13.14 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -122.43 -56.86 1.78 Allowed 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.3 m -127.0 57.03 1.48 Allowed 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 113.183 -1.826 . . . . 0.0 111.053 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -121.55 57.34 0.61 Allowed Glycine 0 N--CA 1.497 2.764 0 N-CA-C 109.044 -1.622 . . . . 0.0 109.044 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -117.91 60.68 0.77 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 88.3 tttt . . . . . 0 N--CA 1.497 1.911 0 CA-C-N 114.528 -1.214 . . . . 0.0 109.181 -179.796 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 120.405 0.145 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -76.99 146.97 26.3 Favored 'Trans proline' 0 C--N 1.315 -1.194 0 C-N-CA 122.804 2.336 . . . . 0.0 107.521 162.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.427 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 38.8 m-85 -119.95 157.09 29.53 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -139.89 155.62 47.1 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.958 -0.697 . . . . 0.0 109.887 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.441 ' HA ' HD11 ' A' ' 18' ' ' LEU . 43.6 t -91.68 142.52 27.52 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.4 ' NZ ' ' HB3' ' A' ' 6' ' ' LYS . 3.8 mmmp? -104.71 38.4 1.91 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 115.107 -0.951 . . . . 0.0 108.999 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.8 m -136.14 -43.12 0.64 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 113.266 -1.788 . . . . 0.0 110.223 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.1 p -118.34 -40.83 2.89 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 124.123 0.89 . . . . 0.0 110.09 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 3.9 mp0 93.86 56.61 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.976 0 O-C-N 126.778 2.549 . . . . 0.0 110.57 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.531 ' NH1' ' CE1' ' A' ' 12' ' ' PHE . 41.2 ttt-85 -107.5 157.98 17.58 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 101.034 -3.691 . . . . 0.0 101.034 179.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.66 167.38 10.27 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 118.647 -1.221 . . . . 0.0 113.041 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.531 ' CE1' ' NH1' ' A' ' 10' ' ' ARG . 94.5 m-85 -144.96 177.03 9.04 Favored 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 113.612 -1.631 . . . . 0.0 108.12 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 81.8 p -104.61 -34.04 8.31 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.593 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 31.6 mtt180 -119.86 -173.86 2.63 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 113.744 -1.571 . . . . 0.0 111.697 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.427 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 38.3 p -95.71 -33.81 12.17 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.859 -1.519 . . . . 0.0 108.374 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -70.35 -35.18 73.41 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.593 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 36.7 m170 -64.74 -13.77 56.24 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 124.512 1.133 . . . . 0.0 110.742 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.441 HD11 ' HA ' ' A' ' 5' ' ' CYS . 51.5 tp -100.08 -50.8 3.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 123.973 0.796 . . . . 0.0 109.733 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.31 -32.35 64.54 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 119.799 -0.761 . . . . 0.0 112.009 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.0 m -74.63 -42.11 59.18 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.437 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 43.5 t60 -56.2 -58.15 9.17 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.405 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.0 p -42.16 -24.45 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.566 1.547 . . . . 0.0 113.795 -179.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.4 mtt85 -70.84 10.3 0.54 Allowed 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 114.627 -1.169 . . . . 0.0 111.358 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.405 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.3 t -106.95 -2.36 21.29 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -108.28 -54.17 2.54 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.2 m -124.92 47.65 2.11 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.59 -41.38 0.07 OUTLIER Glycine 0 N--CA 1.493 2.436 0 CA-C-N 113.55 -1.659 . . . . 0.0 110.373 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.69 -56.5 2.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.081 0.518 . . . . 0.0 109.719 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.506 2.333 0 N-CA-C 117.463 2.394 . . . . 0.0 117.463 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 68.9 mttm . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -49.33 155.06 3.46 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.682 2.921 . . . . 0.0 114.078 177.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -127.31 153.08 46.62 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 112.586 -2.097 . . . . 0.0 106.883 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -130.21 139.46 50.81 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.465 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 44.8 t -91.35 105.12 17.55 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 101.537 -3.505 . . . . 0.0 101.537 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.1 pttt -90.34 42.95 1.12 Allowed 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 123.021 1.391 . . . . 0.0 108.29 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.465 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 26.1 m -124.34 -42.77 2.09 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 111.686 -2.506 . . . . 0.0 105.164 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 21.4 p -123.32 -35.98 2.88 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 123.838 0.711 . . . . 0.0 109.757 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.481 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 3.1 mp0 94.38 66.0 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 O-C-N 126.307 2.254 . . . . 0.0 111.711 179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.4 ttt85 -122.1 153.89 38.08 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 104.029 -2.582 . . . . 0.0 104.029 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -112.51 156.41 22.66 Favored 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 119.647 -0.821 . . . . 0.0 112.671 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -140.94 -179.55 6.14 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 113.919 -1.492 . . . . 0.0 108.417 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 56.3 p -108.28 -37.42 6.01 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 124.147 0.904 . . . . 0.0 110.139 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.512 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 52.9 mtt85 -118.92 179.09 4.25 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 124.606 1.191 . . . . 0.0 111.719 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.423 ' C ' ' H ' ' A' ' 17' ' ' HIS . 92.8 p -94.38 -29.01 15.22 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 113.283 -1.78 . . . . 0.0 107.134 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -83.26 13.52 4.2 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.512 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 35.9 m170 -113.34 -57.58 2.27 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 101.111 -3.662 . . . . 0.0 101.111 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.9 tp -47.65 -46.26 28.75 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -51.26 -65.69 0.51 Allowed 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.3 m -39.74 -46.05 1.83 Allowed 'General case' 0 N--CA 1.502 2.135 0 CA-C-O 121.793 0.806 . . . . 0.0 111.016 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.5 t60 -63.67 -55.47 23.21 Favored 'General case' 0 N--CA 1.495 1.786 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.495 ' C ' ' H ' ' A' ' 24' ' ' THR . 21.6 p -47.77 -16.19 0.07 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -179.534 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -75.01 23.16 0.1 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.542 -1.263 . . . . 0.0 111.68 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.495 ' H ' ' C ' ' A' ' 22' ' ' THR . 25.5 p -114.47 -14.37 12.15 Favored 'General case' 0 N--CA 1.498 1.928 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 -111.39 -44.67 3.5 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 55.4 m -113.01 60.98 0.64 Allowed 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 114.16 -1.382 . . . . 0.0 107.326 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -113.41 55.5 0.51 Allowed Glycine 0 N--CA 1.495 2.57 0 N-CA-C 108.451 -1.859 . . . . 0.0 108.451 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -118.01 155.84 29.59 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.9 mmmp? . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 122.634 1.207 . . . . 0.0 109.561 -179.908 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 120.771 0.32 . . . . 0.0 110.731 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.456 ' HB3' ' HZ3' ' A' ' 11' ' ' LYS . 38.5 Cg_exo -44.75 160.56 0.1 Allowed 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 123.582 2.855 . . . . 0.0 113.948 165.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.406 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 78.6 m-85 -121.79 153.24 38.57 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 112.577 -2.102 . . . . 0.0 106.548 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -135.41 152.94 51.89 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 119.574 -0.85 . . . . 0.0 109.298 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 28.9 t -91.79 146.66 23.59 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 114.656 -1.156 . . . . 0.0 108.57 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -105.48 36.89 2.36 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 121.905 0.859 . . . . 0.0 109.612 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.537 HG21 ' CG ' ' A' ' 25' ' ' HIS . 90.0 m -134.12 -45.15 0.78 Allowed 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 113.491 -1.686 . . . . 0.0 110.149 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 28.0 p -120.85 -24.34 5.69 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 124.218 0.949 . . . . 0.0 110.272 -179.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.415 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 11.7 mp0 75.79 56.69 0.06 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 125.308 1.63 . . . . 0.0 109.556 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.7 ttt85 -109.63 153.47 24.16 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 101.481 -3.526 . . . . 0.0 101.481 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HZ3' ' HB3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -114.67 163.79 14.95 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 118.708 -1.197 . . . . 0.0 112.624 -179.79 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.448 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 84.4 m-85 -138.17 177.83 7.58 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.801 -1.545 . . . . 0.0 108.01 -179.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 p -101.72 -35.14 9.18 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 124.042 0.839 . . . . 0.0 111.534 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.4 mtp-105 -118.14 179.13 4.19 Favored 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.406 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 85.5 p -89.38 -40.42 12.76 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -62.09 -22.85 66.13 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 105.964 -1.865 . . . . 0.0 105.964 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -75.11 -58.8 3.06 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 105.739 -1.948 . . . . 0.0 105.739 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.5 tp -43.98 -48.74 8.72 Favored 'General case' 0 N--CA 1.504 2.236 0 CA-C-O 121.312 0.577 . . . . 0.0 110.019 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -54.82 -59.49 4.65 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 73.1 m -45.43 -43.56 11.46 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-O 121.285 0.564 . . . . 0.0 110.649 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.448 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 68.1 t60 -63.3 -61.68 2.2 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 114.108 -1.405 . . . . 0.0 113.38 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.9 p -43.82 -31.91 0.94 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.456 ' CZ ' ' HA ' ' A' ' 23' ' ' ARG . 0.2 OUTLIER -44.35 -29.01 0.61 Allowed 'General case' 0 N--CA 1.489 1.48 0 CA-C-N 114.396 -1.275 . . . . 0.0 113.631 179.429 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.4 t -86.22 9.51 17.39 Favored 'General case' 0 N--CA 1.507 2.412 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -179.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.537 ' CG ' HG21 ' A' ' 7' ' ' THR . 39.8 m-70 -119.66 -47.92 2.4 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 60.3 m -56.44 -48.99 75.88 Favored 'General case' 0 N--CA 1.496 1.846 0 CA-C-N 113.629 -1.623 . . . . 0.0 111.541 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 25.27 48.14 0.03 OUTLIER Glycine 0 N--CA 1.496 2.647 0 O-C-N 126.416 2.323 . . . . 0.0 112.868 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 11.5 mp0 8.98 62.92 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 126.858 2.063 . . . . 0.0 116.329 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.1 tptt . . . . . 0 N--CA 1.499 2.016 0 CA-C-N 113.759 -1.564 . . . . 0.0 109.513 179.83 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -77.72 152.54 29.22 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 123.022 2.482 . . . . 0.0 109.978 165.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.461 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 70.8 m-85 -128.95 161.41 29.97 Favored 'General case' 0 N--CA 1.495 1.787 0 CA-C-N 112.963 -1.926 . . . . 0.0 108.138 179.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -138.08 156.76 47.46 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 123.717 0.636 . . . . 0.0 111.017 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 44.3 t -97.34 136.04 38.37 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -100.89 36.93 1.83 Allowed 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 122.03 0.919 . . . . 0.0 109.191 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 59.6 m -131.72 -43.57 1.0 Allowed 'General case' 0 N--CA 1.488 1.425 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.594 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 29.7 p -118.98 -26.42 6.0 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 123.92 0.763 . . . . 0.0 110.188 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 9.9 mp0 78.87 56.68 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 125.359 1.662 . . . . 0.0 109.278 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.06 157.82 22.04 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 103.286 -2.857 . . . . 0.0 103.286 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -117.27 163.2 16.68 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 118.924 -1.11 . . . . 0.0 113.042 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.42 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 81.6 m-85 -140.01 -177.61 5.07 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 113.522 -1.672 . . . . 0.0 108.824 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.1 p -107.59 -24.02 11.92 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.188 0.93 . . . . 0.0 111.721 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.8 mtp180 -125.18 170.08 11.59 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 123.569 0.543 . . . . 0.0 110.182 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.461 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 82.8 p -96.93 15.79 21.27 Favored 'General case' 0 N--CA 1.503 2.182 0 CA-C-O 121.667 0.746 . . . . 0.0 110.066 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.76 -29.41 4.34 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -67.79 -50.74 55.29 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 100.223 -3.991 . . . . 0.0 100.223 179.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.9 tp -57.26 -46.17 83.32 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 113.873 -1.512 . . . . 0.0 109.144 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 ttmm -64.69 -9.81 22.55 Favored 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.4 m -99.31 -41.58 7.38 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 103.567 -2.753 . . . . 0.0 103.567 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.42 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 55.1 t60 -54.67 -57.66 10.58 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 113.975 -1.466 . . . . 0.0 111.27 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.481 ' C ' ' H ' ' A' ' 24' ' ' THR . 9.9 p -42.33 -24.56 0.05 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 125.426 1.49 . . . . 0.0 113.185 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.4 mtt180 -81.36 34.21 0.37 Allowed 'General case' 0 N--CA 1.486 1.37 0 O-C-N 124.459 1.1 . . . . 0.0 110.536 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.481 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.7 t -124.54 -10.47 7.38 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 69.2 m-70 -111.7 -56.29 2.4 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.484 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.9 m -119.2 51.79 1.11 Allowed 'General case' 0 N--CA 1.501 2.096 0 CA-C-O 122.623 1.202 . . . . 0.0 109.216 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -125.6 56.93 0.7 Allowed Glycine 0 N--CA 1.493 2.47 0 N-CA-C 105.881 -2.888 . . . . 0.0 105.881 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -122.1 -60.24 1.59 Allowed 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt . . . . . 0 N--CA 1.509 2.48 0 O-C-N 125.658 1.849 . . . . 0.0 115.844 -179.638 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.464 ' HB2' ' HD2' ' A' ' 2' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.833 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.464 ' HD2' ' HB2' ' A' ' 1' ' ' LYS . 18.3 Cg_endo -46.6 161.56 0.18 Allowed 'Trans proline' 0 N--CA 1.503 2.068 0 C-N-CA 121.9 1.733 . . . . 0.0 112.906 167.307 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.45 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 61.8 m-85 -122.41 164.02 18.77 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 113.695 -1.593 . . . . 0.0 109.367 -179.829 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -135.25 151.07 50.24 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 124.495 1.122 . . . . 0.0 108.334 179.458 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.487 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 42.9 t -98.99 130.57 45.34 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -102.37 40.34 1.37 Allowed 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 122.731 1.253 . . . . 0.0 108.856 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.487 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 32.8 m -126.69 -41.07 1.87 Allowed 'General case' 0 N--CA 1.485 1.325 0 CA-C-N 112.32 -2.218 . . . . 0.0 105.727 179.481 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.497 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 28.4 p -122.93 -44.95 2.17 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 123.904 0.752 . . . . 0.0 111.375 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 104.22 57.67 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 127.523 2.329 . . . . 0.0 107.794 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.497 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 33.2 ttt180 -112.48 162.66 15.36 Favored 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 179.796 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -122.44 159.83 26.77 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.598 -0.841 . . . . 0.0 112.423 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.1 m-85 -140.63 -173.89 3.82 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 124.405 1.065 . . . . 0.0 109.596 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.4 p -108.39 -40.26 5.19 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.575 -179.803 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.578 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.2 mtt180 -112.41 179.54 3.96 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 124.142 0.901 . . . . 0.0 110.112 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.45 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 87.7 p -100.38 0.56 40.16 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 114.411 -1.268 . . . . 0.0 107.658 179.791 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.424 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 1.4 p30 -112.03 7.86 19.94 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 179.485 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.578 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 39.5 m170 -114.44 -14.8 12.14 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.4 tp -92.27 -34.67 14.15 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 179.852 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.424 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 0.1 OUTLIER -80.2 -40.96 26.12 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.85 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.8 m -66.27 -8.78 26.94 Favored 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 179.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.543 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 13.0 t60 -98.34 -56.07 2.58 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.377 179.38 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 94.2 m -54.06 -17.81 3.03 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -179.458 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.8 ptt180 -66.34 4.78 0.66 Allowed 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 119.299 -0.96 . . . . 0.0 113.323 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 72.9 p -105.42 0.14 26.57 Favored 'General case' 0 N--CA 1.505 2.299 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.569 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 -106.99 -46.49 3.91 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 179.964 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 28.0 m -101.15 -26.9 13.51 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.656 -179.647 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -98.98 53.01 1.08 Allowed Glycine 0 N--CA 1.5 2.905 0 N-CA-C 106.828 -2.509 . . . . 0.0 106.828 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 29' ' ' LYS . 32.7 tt0 -132.41 179.35 6.18 Favored 'General case' 0 N--CA 1.499 2.011 0 CA-C-N 113.088 -1.556 . . . . 0.0 110.066 -179.715 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.402 ' H ' ' HG2' ' A' ' 28' ' ' GLU . 25.2 mmmt . . . . . 0 N--CA 1.501 2.118 0 CA-C-O 122.193 0.997 . . . . 0.0 108.93 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.5 OUTLIER -86.52 163.73 9.46 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 123.514 2.809 . . . . 0.0 111.971 -175.535 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -125.69 164.29 20.94 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 113.501 -1.681 . . . . 0.0 107.54 179.784 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.433 HE21 ' HA ' ' A' ' 9' ' ' GLN . 70.0 tp60 -135.27 152.08 51.17 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 123.818 0.699 . . . . 0.0 110.118 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.474 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 32.0 t -100.33 136.54 40.06 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 179.511 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -105.33 36.97 2.32 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 124.908 1.38 . . . . 0.0 108.25 -179.939 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.3 m -130.25 -42.23 1.22 Allowed 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 113.358 -1.747 . . . . 0.0 108.947 -179.948 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.9 p -120.28 -45.9 2.42 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.953 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.433 ' HA ' HE21 ' A' ' 4' ' ' GLN . 97.7 mm-40 105.55 60.75 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 126.983 2.677 . . . . 0.0 110.51 179.933 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.474 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 45.9 ttt-85 -114.16 154.45 27.82 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 102.878 -3.008 . . . . 0.0 102.878 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -111.29 163.44 13.95 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.299 -0.961 . . . . 0.0 110.421 -179.758 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.498 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 92.9 m-85 -141.24 -173.72 3.82 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 124.532 1.145 . . . . 0.0 109.639 -179.725 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.4 p -108.87 -38.86 5.49 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 124.604 1.19 . . . . 0.0 109.702 -179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.424 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 46.9 mtt180 -119.16 -176.95 3.23 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 124.102 0.876 . . . . 0.0 110.67 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 81.1 p -95.0 -36.97 11.35 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.182 -179.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -64.84 -33.97 77.27 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 104.036 -2.579 . . . . 0.0 104.036 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.424 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 47.6 m170 -59.83 -57.22 13.85 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 106.279 -1.749 . . . . 0.0 106.279 179.491 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.1 tp -47.03 -47.81 22.23 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.037 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.6 mttp -60.21 -50.66 72.8 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 118.354 -1.338 . . . . 0.0 110.834 179.473 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.5 m -47.59 -46.25 28.08 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 179.545 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.498 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 62.7 t60 -60.58 -56.44 21.29 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 113.221 -1.809 . . . . 0.0 114.406 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.485 ' C ' ' H ' ' A' ' 24' ' ' THR . 15.1 p -50.46 -14.44 0.18 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -89.52 39.59 0.95 Allowed 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 179.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.485 ' H ' ' C ' ' A' ' 22' ' ' THR . 95.5 m -131.75 -11.72 3.42 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 112.487 -2.142 . . . . 0.0 107.481 179.839 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 50.4 m-70 -107.22 -44.8 4.26 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 105.487 -2.042 . . . . 0.0 105.487 179.843 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 63.8 p -100.64 -15.43 17.76 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 114.071 -1.422 . . . . 0.0 109.536 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -116.39 54.06 0.6 Allowed Glycine 0 N--CA 1.498 2.812 0 N-CA-C 108.884 -1.686 . . . . 0.0 108.884 179.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -132.79 172.4 12.62 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-N 114.541 -0.83 . . . . 0.0 110.007 -179.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.407 ' H ' ' HD2' ' A' ' 29' ' ' LYS . 14.6 mptt . . . . . 0 N--CA 1.511 2.596 0 N-CA-C 116.434 2.012 . . . . 0.0 116.434 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 119.165 -0.445 . . . . 0.0 110.811 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -66.97 159.46 51.77 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 123.147 2.565 . . . . 0.0 113.226 -177.063 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.405 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 70.8 m-85 -127.23 161.17 29.19 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 112.942 -1.935 . . . . 0.0 107.257 179.738 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -140.08 149.57 43.26 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.427 179.908 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.467 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 37.0 t -98.36 121.37 40.21 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 103.785 -2.672 . . . . 0.0 103.785 179.439 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -95.57 41.27 1.1 Allowed 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.467 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 22.4 m -128.95 -42.13 1.41 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 113.406 -1.725 . . . . 0.0 108.55 -179.935 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.3 p -120.25 -42.32 2.58 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 123.96 0.788 . . . . 0.0 109.119 -179.957 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 102.75 57.66 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.975 0 O-C-N 126.888 2.617 . . . . 0.0 111.163 179.777 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.07 155.34 26.13 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 103.171 -2.9 . . . . 0.0 103.171 179.45 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -113.47 163.08 15.35 Favored 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.8 -179.737 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.412 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.2 m-85 -140.97 -178.09 5.4 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 124.264 0.978 . . . . 0.0 109.135 -179.802 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.0 p -105.85 -37.19 6.77 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 124.955 1.409 . . . . 0.0 111.002 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.8 mtp-105 -118.66 -178.85 3.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 124.424 1.078 . . . . 0.0 109.942 179.975 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.405 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 74.1 p -93.6 -34.82 13.17 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.14 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -74.96 0.54 15.45 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -97.61 -52.82 3.63 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 102.051 -3.315 . . . . 0.0 102.051 179.493 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.8 tp -52.26 -47.52 65.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 124.157 0.911 . . . . 0.0 108.917 179.547 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -59.5 -55.75 30.68 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.585 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 65.8 m -52.87 -25.25 11.04 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.025 0.441 . . . . 0.0 111.173 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.412 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 66.4 t60 -82.98 -55.87 4.13 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.341 179.677 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.407 ' C ' ' H ' ' A' ' 24' ' ' THR . 8.1 p -45.95 -37.28 6.27 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.174 0.99 . . . . 0.0 112.602 -179.544 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -64.02 10.95 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 118.693 -1.203 . . . . 0.0 114.013 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.407 ' H ' ' C ' ' A' ' 22' ' ' THR . 11.8 t -105.06 -7.14 19.37 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.682 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 -102.95 -55.67 2.38 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.7 m -128.55 47.08 2.49 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 124.349 1.031 . . . . 0.0 108.904 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -140.81 -43.52 0.07 OUTLIER Glycine 0 N--CA 1.497 2.755 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 179.822 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -103.37 165.39 11.06 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 113.454 -1.373 . . . . 0.0 109.313 -179.853 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.5 pttt . . . . . 0 N--CA 1.495 1.778 0 CA-C-N 113.988 -1.46 . . . . 0.0 111.788 -179.646 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -50.63 163.44 0.71 Allowed 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 122.829 2.353 . . . . 0.0 112.472 169.355 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.414 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 64.7 m-85 -129.05 149.95 50.65 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.665 -1.607 . . . . 0.0 107.159 179.907 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.429 HE21 ' HA ' ' A' ' 9' ' ' GLN . 71.5 tp60 -124.54 141.82 51.81 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 123.971 0.794 . . . . 0.0 109.415 179.97 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.414 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 49.6 t -91.73 119.71 31.82 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 101.82 -3.4 . . . . 0.0 101.82 179.49 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -95.05 39.27 1.11 Allowed 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 -179.688 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.414 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 24.0 m -128.7 -44.62 1.34 Allowed 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 113.106 -1.861 . . . . 0.0 108.234 179.963 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 29.9 p -119.65 -34.05 3.87 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 119.759 -0.777 . . . . 0.0 109.403 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 4.3 mp0 91.77 64.33 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 126.38 2.3 . . . . 0.0 111.359 179.712 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.56 152.84 36.34 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 104.058 -2.571 . . . . 0.0 104.058 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -113.56 155.07 26.07 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 119.187 -1.005 . . . . 0.0 110.553 -179.691 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -135.4 -172.03 2.97 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.184 -179.694 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.1 p -108.98 -42.8 4.35 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 113.605 -1.634 . . . . 0.0 111.458 -179.84 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.545 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 55.5 mtt180 -114.6 170.28 8.43 Favored 'General case' 0 N--CA 1.506 2.342 0 CA-C-O 121.839 0.828 . . . . 0.0 111.815 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.414 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 69.3 p -82.39 -39.16 23.08 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 179.939 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.47 -27.55 67.12 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 179.864 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.545 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 45.7 m170 -71.16 -60.29 2.31 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 104.418 -2.438 . . . . 0.0 104.418 179.491 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.5 tp -41.44 -52.05 3.68 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 123.801 0.688 . . . . 0.0 109.431 179.41 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -47.04 -69.02 0.14 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 123.713 0.633 . . . . 0.0 110.796 179.471 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.47 ' HA ' ' NH1' ' A' ' 23' ' ' ARG . 56.0 m -42.66 -42.03 3.32 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.936 -179.91 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -66.46 -61.81 1.8 Allowed 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 113.915 -1.493 . . . . 0.0 113.611 179.983 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.3 m -41.85 -45.69 3.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 124.382 1.051 . . . . 0.0 111.605 -178.925 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.47 ' NH1' ' HA ' ' A' ' 20' ' ' THR . 37.6 ttp180 -34.7 -31.9 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 O-C-N 125.97 2.044 . . . . 0.0 114.792 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.3 t -77.18 14.39 0.92 Allowed 'General case' 0 N--CA 1.506 2.329 0 CA-C-O 121.765 0.793 . . . . 0.0 112.667 -179.659 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.0 m-70 -112.73 -2.17 14.54 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 114.039 -1.437 . . . . 0.0 107.784 179.562 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -120.06 -46.29 2.43 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.933 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 15.1 48.49 0.01 OUTLIER Glycine 0 N--CA 1.498 2.819 0 O-C-N 126.288 2.243 . . . . 0.0 117.329 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -116.07 129.58 56.41 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 179.58 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.7 pttm . . . . . 0 N--CA 1.51 2.532 0 N-CA-C 116.852 2.167 . . . . 0.0 116.852 -179.849 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 59.1 tttp . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -81.83 153.47 17.27 Favored 'Trans proline' 0 N--CA 1.49 1.277 0 C-N-CA 123.501 2.801 . . . . 0.0 109.554 173.894 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -121.9 159.9 25.9 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-N 113.05 -1.886 . . . . 0.0 107.055 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -140.31 150.49 44.07 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.489 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.42 ' HA ' HD11 ' A' ' 18' ' ' LEU . 31.9 t -87.25 144.59 26.74 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 179.596 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -102.54 32.16 3.73 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.162 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 39.9 m -131.57 -40.88 1.08 Allowed 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 114.124 -1.398 . . . . 0.0 110.178 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 26.9 p -121.34 -42.13 2.47 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 124.011 0.819 . . . . 0.0 111.259 -179.671 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.5 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 2.6 mp0 99.62 58.5 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 126.811 2.569 . . . . 0.0 108.955 179.97 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.45 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 16.8 ttt180 -104.6 159.31 15.86 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 101.373 -3.566 . . . . 0.0 101.373 179.477 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -114.49 161.18 18.34 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 119.197 -1.001 . . . . 0.0 112.165 -179.41 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.429 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 91.9 m-85 -144.04 176.26 9.43 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 124.44 1.087 . . . . 0.0 109.348 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 43.5 p -106.19 -40.52 5.61 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.653 1.221 . . . . 0.0 110.598 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.552 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 58.2 mtt85 -112.27 171.57 7.43 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 124.579 1.174 . . . . 0.0 110.053 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 88.8 p -85.51 -36.63 20.4 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 179.864 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.26 -32.78 74.28 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 179.978 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.552 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 41.6 m170 -67.1 -60.78 2.33 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 179.666 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.42 HD11 ' HA ' ' A' ' 5' ' ' CYS . 44.6 tp -40.14 -51.77 2.61 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 123.758 0.661 . . . . 0.0 110.721 179.451 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -54.81 -60.37 3.46 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.644 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 96.5 m -42.35 -40.81 2.63 Favored 'General case' 0 N--CA 1.501 2.103 0 CA-C-O 121.489 0.661 . . . . 0.0 111.767 179.723 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.45 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 53.3 t60 -71.57 -57.37 4.46 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 113.92 -1.491 . . . . 0.0 114.191 179.666 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.7 p -44.01 -35.92 2.28 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.591 0.757 . . . . 0.0 112.306 -179.127 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -81.73 44.88 0.85 Allowed 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 118.457 -1.297 . . . . 0.0 111.766 179.765 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.0 t -124.14 -21.78 4.95 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 179.495 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -87.15 -52.39 5.44 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 114.107 -1.406 . . . . 0.0 110.249 -179.6 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.5 m -125.02 -19.52 5.18 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 124.203 0.939 . . . . 0.0 113.393 -179.773 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -101.27 42.82 1.84 Allowed Glycine 0 N--CA 1.497 2.733 0 C-N-CA 119.89 -1.148 . . . . 0.0 110.783 -179.745 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -120.91 63.78 0.86 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 179.915 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.572 ' H ' ' HD3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.975 0 CA-C-N 113.854 -1.521 . . . . 0.0 109.952 -179.824 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -58.46 158.13 24.26 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.747 2.298 . . . . 0.0 113.335 -172.101 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.422 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 58.9 m-85 -127.74 167.6 16.25 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 113.005 -1.907 . . . . 0.0 107.746 179.982 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -148.06 153.18 38.58 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.846 179.493 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.475 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 34.7 t -94.79 127.75 41.02 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 179.819 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.467 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -95.42 38.78 1.14 Allowed 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 -179.585 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.475 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 29.2 m -130.68 -44.59 1.08 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 113.887 -1.506 . . . . 0.0 109.89 179.932 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 32.0 p -120.71 -26.58 5.25 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 123.75 0.656 . . . . 0.0 110.789 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.469 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 6.8 mp0 85.82 57.91 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 125.93 2.018 . . . . 0.0 112.304 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.68 151.86 34.26 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 179.35 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -113.96 162.88 15.86 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.149 -1.02 . . . . 0.0 112.216 -179.799 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -137.11 -173.81 3.56 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.699 -1.591 . . . . 0.0 109.485 -179.575 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 80.7 p -111.24 -37.58 5.26 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 124.313 1.008 . . . . 0.0 108.452 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.509 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.4 mtt85 -116.09 -178.16 3.34 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.913 -179.939 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.422 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 87.1 p -97.17 -24.19 15.85 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 113.689 -1.596 . . . . 0.0 107.418 179.95 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -90.29 19.01 5.42 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 122.483 1.135 . . . . 0.0 108.549 179.808 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.509 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 22.7 m170 -120.27 -19.71 7.58 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 112.275 -2.239 . . . . 0.0 105.147 179.514 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.8 tp -101.12 -48.77 4.3 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 114.405 -1.271 . . . . 0.0 109.405 -179.809 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -71.81 3.8 3.87 Favored 'General case' 0 N--CA 1.504 2.25 0 CA-C-O 121.121 0.486 . . . . 0.0 111.412 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.4 m -105.51 -43.17 5.02 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 103.781 -2.674 . . . . 0.0 103.781 179.536 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -61.71 -56.92 14.51 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-N 113.484 -1.689 . . . . 0.0 111.73 179.832 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.467 ' C ' ' H ' ' A' ' 24' ' ' THR . 17.1 p -45.06 -23.63 0.17 Allowed 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 124.686 1.194 . . . . 0.0 112.6 -179.872 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.8 mmm-85 -78.85 32.83 0.21 Allowed 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.75 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.467 ' H ' ' C ' ' A' ' 22' ' ' THR . 15.0 t -124.58 -23.48 4.39 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 179.746 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.1 m-70 -97.79 -43.51 7.11 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.169 -179.748 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.7 t -105.54 -28.15 10.96 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 124.398 1.061 . . . . 0.0 113.178 -179.777 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -110.77 51.45 0.7 Allowed Glycine 0 N--CA 1.499 2.862 0 C-N-CA 120.312 -0.947 . . . . 0.0 111.976 -179.771 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -14.35 105.37 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.353 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 179.848 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.5 tptp . . . . . 0 N--CA 1.496 1.843 0 O-C-N 124.256 0.973 . . . . 0.0 110.136 -179.941 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.1 tptt . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 107.351 -1.351 . . . . 0.0 107.351 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -47.11 157.2 0.65 Allowed 'Trans proline' 0 N--CA 1.494 1.545 0 C-N-CA 123.535 2.823 . . . . 0.0 115.346 -174.584 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.408 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 76.9 m-85 -125.49 155.67 40.17 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 112.02 -2.355 . . . . 0.0 108.018 -179.941 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -135.45 152.37 51.3 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.226 179.415 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.44 ' HA ' HD11 ' A' ' 18' ' ' LEU . 44.5 t -91.17 128.8 37.14 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 179.624 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.3 pttm -99.59 38.89 1.37 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 114.442 -1.254 . . . . 0.0 109.375 -179.72 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.408 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 54.7 m -130.88 -42.73 1.11 Allowed 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 112.251 -2.25 . . . . 0.0 107.353 179.62 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.3 p -124.91 -30.79 3.21 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 124.06 0.85 . . . . 0.0 111.806 -179.875 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.494 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.0 mp0 88.0 62.81 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.325 0 O-C-N 125.64 1.838 . . . . 0.0 110.443 179.839 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.414 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 21.4 ttm-85 -115.68 154.19 29.96 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 102.725 -3.065 . . . . 0.0 102.725 179.696 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -114.51 155.66 26.02 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 119.153 -1.019 . . . . 0.0 112.535 -179.47 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.428 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 85.2 m-85 -136.56 -179.63 5.8 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 114.393 -1.276 . . . . 0.0 109.059 -179.733 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 76.3 p -106.37 -34.69 7.36 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 124.417 1.073 . . . . 0.0 110.122 -179.861 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.564 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 52.5 mtt85 -117.41 169.73 9.28 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 124.838 1.337 . . . . 0.0 111.413 -179.796 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.408 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 96.7 p -85.99 -37.04 19.4 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 179.913 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -64.27 -30.01 71.07 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 179.782 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.564 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 21.7 m170 -71.48 -60.62 2.14 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 105.858 -1.904 . . . . 0.0 105.858 179.685 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.44 HD11 ' HA ' ' A' ' 5' ' ' CYS . 62.9 tp -40.61 -52.4 2.88 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 124.073 0.858 . . . . 0.0 111.175 179.608 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -55.06 -64.39 0.85 Allowed 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 118.922 -0.561 . . . . 0.0 110.306 179.626 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.0 m -39.2 -45.47 1.35 Allowed 'General case' 0 N--CA 1.504 2.246 0 O-C-N 124.231 0.957 . . . . 0.0 110.292 179.763 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.428 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 44.9 t60 -60.33 -60.99 2.94 Favored 'General case' 0 N--CA 1.489 1.502 0 CA-C-N 113.878 -1.51 . . . . 0.0 111.24 179.591 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.5 m -47.53 -23.32 0.61 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 123.751 0.657 . . . . 0.0 112.735 -179.581 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 mmm180 -53.57 -21.47 6.64 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.196 179.484 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.7 t -88.21 17.16 5.35 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-O 121.778 0.799 . . . . 0.0 110.81 -179.884 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 36.3 m-70 -125.47 -53.81 1.58 Allowed 'General case' 0 N--CA 1.492 1.651 0 CA-C-N 113.652 -1.613 . . . . 0.0 108.731 179.705 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.4 m -122.36 3.57 9.72 Favored 'General case' 0 N--CA 1.507 2.41 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -179.677 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.88 -48.94 9.29 Favored Glycine 0 N--CA 1.499 2.849 0 N-CA-C 108.75 -1.74 . . . . 0.0 108.75 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.56 -10.94 60.49 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 114.133 -1.033 . . . . 0.0 111.969 179.712 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.7 tttt . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 122.752 1.263 . . . . 0.0 109.228 -179.848 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt . . . . . 0 N--CA 1.493 1.719 0 CA-C-O 118.807 -0.616 . . . . 0.0 109.434 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -66.61 165.2 26.13 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.417 2.078 . . . . 0.0 112.865 165.688 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.457 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 50.1 m-85 -129.17 168.04 16.73 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 113.635 -1.621 . . . . 0.0 108.93 179.826 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.543 HE21 ' HA ' ' A' ' 9' ' ' GLN . 72.2 tp60 -133.82 149.37 51.39 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 124.165 0.915 . . . . 0.0 111.752 -179.806 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.496 ' HA ' HD11 ' A' ' 18' ' ' LEU . 41.7 t -99.34 141.4 32.17 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 104.616 -2.364 . . . . 0.0 104.616 179.304 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.471 ' HD3' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -105.32 19.31 20.8 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 124.748 1.28 . . . . 0.0 109.183 -179.843 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.9 m -114.81 -42.86 3.19 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 114.09 -1.414 . . . . 0.0 108.214 179.919 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.534 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 22.4 p -130.9 10.28 5.02 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 119.576 -0.85 . . . . 0.0 112.355 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.543 ' HA ' HE21 ' A' ' 4' ' ' GLN . 96.2 mm-40 47.16 59.39 4.08 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-O 122.747 1.26 . . . . 0.0 111.226 -179.825 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.534 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 15.4 ttt180 -117.04 157.42 25.87 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 103.934 -2.617 . . . . 0.0 103.934 179.812 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.1 pttp -114.91 165.39 12.9 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 118.32 -1.352 . . . . 0.0 112.149 -179.938 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.497 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 98.9 m-85 -140.84 -170.67 3.08 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 113.896 -1.502 . . . . 0.0 110.448 -179.768 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.8 p -108.36 -35.41 6.52 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 124.737 1.273 . . . . 0.0 109.495 179.923 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.419 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 5.6 mtp85 -127.12 174.61 8.77 Favored 'General case' 0 N--CA 1.504 2.227 0 CA-C-O 121.658 0.742 . . . . 0.0 110.371 179.497 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.457 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 90.3 p -82.55 -41.87 19.08 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 114.447 -1.251 . . . . 0.0 108.549 -179.891 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -67.86 -28.52 67.61 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 -179.992 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.419 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 53.9 m170 -69.16 -61.53 1.75 Allowed 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 104.625 -2.361 . . . . 0.0 104.625 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.496 HD11 ' HA ' ' A' ' 5' ' ' CYS . 40.0 tp -39.21 -52.63 1.94 Allowed 'General case' 0 N--CA 1.503 2.188 0 CA-C-O 121.808 0.813 . . . . 0.0 110.179 179.318 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -49.07 -68.43 0.18 Allowed 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.151 179.584 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.4 m -39.83 -45.2 1.74 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 124.635 1.21 . . . . 0.0 110.284 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 8.2 t60 -57.06 -61.18 2.63 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.174 -1.376 . . . . 0.0 111.265 179.797 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.484 ' C ' ' H ' ' A' ' 24' ' ' THR . 12.5 m -41.54 -26.49 0.07 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 124.985 1.428 . . . . 0.0 111.238 -179.68 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.411 ' HA ' HH11 ' A' ' 23' ' ' ARG . 14.9 mmm180 -79.42 36.65 0.31 Allowed 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 114.849 -1.068 . . . . 0.0 110.47 179.797 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.484 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.7 t -125.77 -12.08 6.59 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 104.882 -2.266 . . . . 0.0 104.882 179.496 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -95.67 -41.23 9.0 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.801 -179.895 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.4 m -110.73 -35.95 5.85 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 124.55 1.156 . . . . 0.0 114.036 -179.739 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -114.2 60.32 0.38 Allowed Glycine 0 N--CA 1.5 2.963 0 O-C-N 124.374 1.046 . . . . 0.0 112.054 -179.499 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 29' ' ' LYS . 2.8 tp10 -57.39 162.82 2.61 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 124.486 0.757 . . . . 0.0 109.992 179.878 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.409 ' N ' ' HG3' ' A' ' 28' ' ' GLU . 25.2 pttm . . . . . 0 N--CA 1.499 1.979 0 CA-C-O 122.441 1.115 . . . . 0.0 110.448 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 67.1 mttm . . . . . 0 N--CA 1.492 1.651 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -79.96 124.02 5.39 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 C-N-CA 122.891 2.394 . . . . 0.0 110.564 177.061 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -114.92 145.14 42.52 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 105.172 -2.158 . . . . 0.0 105.172 179.669 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -127.61 151.13 49.32 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.25 0.969 . . . . 0.0 109.768 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.5 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 32.2 t -99.59 136.25 39.8 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 103.254 -2.869 . . . . 0.0 103.254 179.587 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -99.11 23.6 8.88 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.408 -0.917 . . . . 0.0 111.714 -179.422 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.502 HG21 ' CG ' ' A' ' 25' ' ' HIS . 18.7 m -119.84 -44.56 2.52 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 179.296 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.561 ' SG ' ' HB2' ' A' ' 10' ' ' ARG . 27.2 p -127.25 10.32 6.82 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -179.89 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 48.57 57.7 6.01 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-O 123.372 1.558 . . . . 0.0 109.71 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.561 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 55.7 ttm-85 -116.22 130.04 56.59 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 111.101 -2.772 . . . . 0.0 103.909 -179.929 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -103.68 163.09 12.55 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.062 -1.055 . . . . 0.0 113.576 -179.352 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -138.49 175.3 9.68 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 112.932 -1.94 . . . . 0.0 110.345 -179.385 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 84.9 p -101.7 -27.35 13.1 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.57 1.169 . . . . 0.0 110.719 -179.875 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.51 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 57.1 mtt85 -118.2 165.85 13.31 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 124.546 1.153 . . . . 0.0 111.007 -179.936 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 61.8 p -85.16 -38.98 18.38 Favored 'General case' 0 N--CA 1.492 1.631 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.432 -179.953 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.4 -36.42 82.26 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 179.921 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.51 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 28.6 m170 -66.37 -62.23 1.58 Allowed 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 179.708 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 39.2 tp -40.1 -55.18 2.15 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.087 0.867 . . . . 0.0 111.478 179.613 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -54.01 -62.0 1.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 124.045 0.841 . . . . 0.0 112.376 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.8 m -45.26 -43.43 10.46 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 123.893 0.746 . . . . 0.0 111.014 179.889 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.462 ' CE1' ' HD2' ' A' ' 10' ' ' ARG . 63.6 t60 -61.82 -63.62 1.2 Allowed 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.535 179.842 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -51.25 -42.47 61.07 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -179.439 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -34.12 -31.57 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 125.453 1.721 . . . . 0.0 112.992 179.454 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.5 t -78.73 -47.95 15.87 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.364 -179.72 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.502 ' CG ' HG21 ' A' ' 7' ' ' THR . 0.8 OUTLIER -124.77 42.73 3.2 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 179.866 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.7 m -140.17 -44.24 0.42 Allowed 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 114.164 -1.38 . . . . 0.0 108.303 179.642 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -120.32 53.81 0.68 Allowed Glycine 0 N--CA 1.498 2.828 0 CA-C-N 113.941 -1.481 . . . . 0.0 109.493 -179.973 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -125.76 66.19 1.18 Allowed 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -179.875 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp . . . . . 0 N--CA 1.501 2.115 0 CA-C-O 122.651 1.215 . . . . 0.0 110.932 -179.755 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.8 tptp . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -88.69 159.94 6.33 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 C-N-CA 122.65 2.234 . . . . 0.0 111.966 176.999 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -122.44 154.56 37.61 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-N 112.258 -2.246 . . . . 0.0 105.964 179.76 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.538 HE21 ' HA ' ' A' ' 9' ' ' GLN . 72.0 tp60 -132.14 147.9 52.45 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 123.847 0.717 . . . . 0.0 110.592 -179.864 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.491 ' HB3' ' H ' ' A' ' 10' ' ' ARG . 18.3 t -95.46 135.36 37.2 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 103.169 -2.9 . . . . 0.0 103.169 179.491 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 7.8 mptt -99.76 33.44 2.54 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 125.124 1.515 . . . . 0.0 108.539 -179.576 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.484 HG21 ' CG ' ' A' ' 25' ' ' HIS . 69.9 m -131.76 -46.48 0.96 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.393 179.946 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.2 p -125.58 5.97 7.55 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.674 -179.75 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.538 ' HA ' HE21 ' A' ' 4' ' ' GLN . 86.5 mm-40 53.1 58.71 5.03 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-O 122.941 1.353 . . . . 0.0 111.062 179.878 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.491 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 20.6 ttt180 -111.79 148.94 32.47 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 102.613 -3.106 . . . . 0.0 102.613 179.67 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -115.58 162.53 17.09 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 119.088 -1.045 . . . . 0.0 112.22 -179.8 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -140.98 177.47 8.03 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-N 114.085 -1.416 . . . . 0.0 108.599 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 80.5 p -106.83 -30.48 8.89 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 124.29 0.994 . . . . 0.0 110.642 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.503 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 51.9 mtt85 -119.96 -178.85 3.75 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.901 -179.757 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 99.8 p -98.19 -33.57 11.07 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -64.17 -22.71 67.04 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.503 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 32.4 m170 -80.25 -42.68 22.72 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 179.731 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.86 -47.42 83.41 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 179.763 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.37 -61.25 2.43 Favored 'General case' 0 N--CA 1.503 2.214 0 CA-C-N 118.928 0.785 . . . . 0.0 110.388 179.586 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.5 m -48.11 -26.22 1.77 Allowed 'General case' 0 N--CA 1.502 2.17 0 CA-C-O 120.959 0.409 . . . . 0.0 112.088 179.73 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.479 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 71.3 t60 -84.61 -56.13 3.76 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.633 179.612 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.474 ' C ' ' H ' ' A' ' 24' ' ' THR . 19.2 p -50.26 -33.59 20.32 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.417 1.087 . . . . 0.0 113.383 -179.464 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -65.63 14.28 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.643 -1.223 . . . . 0.0 113.888 179.744 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.474 ' H ' ' C ' ' A' ' 22' ' ' THR . 13.4 t -109.75 -10.51 14.79 Favored 'General case' 0 N--CA 1.502 2.163 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 179.554 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.484 ' CG ' HG21 ' A' ' 7' ' ' THR . 40.7 m-70 -107.59 -41.51 5.02 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 104.731 -2.322 . . . . 0.0 104.731 179.857 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.8 m -75.47 -40.26 57.61 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 179.618 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -105.62 61.72 0.35 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 104.525 -3.43 . . . . 0.0 104.525 179.651 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -121.68 169.61 10.54 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 112.864 -1.668 . . . . 0.0 109.531 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 122.145 0.974 . . . . 0.0 109.786 179.776 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.0 tttp . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 107.057 -1.461 . . . . 0.0 107.057 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -78.25 161.31 29.1 Favored 'Trans proline' 0 C--N 1.316 -1.178 0 C-N-CA 122.719 2.279 . . . . 0.0 111.167 -171.694 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -124.95 154.82 40.58 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 112.678 -2.055 . . . . 0.0 106.571 179.798 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -135.87 145.04 45.94 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 124.084 0.865 . . . . 0.0 109.394 179.93 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.2 t -93.56 140.52 29.51 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 104.891 -2.262 . . . . 0.0 104.891 179.619 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -104.63 37.62 2.09 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -179.672 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.9 m -131.93 -44.31 0.96 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 113.7 -1.591 . . . . 0.0 109.059 179.992 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.497 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.0 p -118.93 -34.22 3.97 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 123.896 0.747 . . . . 0.0 109.832 -179.933 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.497 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 6.5 mp0 88.77 56.68 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.196 0 O-C-N 126.342 2.276 . . . . 0.0 108.98 179.706 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.404 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -112.65 138.54 49.29 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 102.946 -2.983 . . . . 0.0 102.946 179.747 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -102.64 164.98 11.33 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.949 -1.101 . . . . 0.0 112.15 -179.53 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -139.42 -178.08 5.22 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 113.52 -1.673 . . . . 0.0 109.293 -179.704 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.5 p -105.06 -39.53 6.19 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 124.883 1.365 . . . . 0.0 108.818 -179.909 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.502 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 55.9 mtt180 -109.7 -177.69 3.34 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 124.438 1.086 . . . . 0.0 111.369 179.965 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.5 p -97.67 -30.44 12.82 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 113.671 -1.604 . . . . 0.0 109.461 -179.879 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -88.41 19.42 3.84 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 122.162 0.982 . . . . 0.0 108.475 179.906 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.502 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.5 m170 -119.45 -24.39 6.34 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 179.529 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.5 tp -93.76 -54.3 3.68 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 114.322 -1.308 . . . . 0.0 110.154 -179.968 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -0.86 12.71 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.821 -179.846 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 97.0 m -104.5 -36.01 7.68 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 105.299 -2.111 . . . . 0.0 105.299 179.921 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 25.3 t60 -70.33 -53.37 16.98 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 124.041 0.838 . . . . 0.0 108.801 179.727 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.6 p -37.94 -46.01 0.93 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.129 0.972 . . . . 0.0 111.135 -179.939 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.3 mmt-85 -43.32 -21.38 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 179.921 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.9 t -73.91 -21.54 60.02 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 123.099 0.249 . . . . 0.0 111.335 -179.548 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 56.6 m-70 -99.11 25.39 6.83 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 179.705 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 45.4 m -137.28 -55.01 0.7 Allowed 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 -179.723 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -121.2 25.19 7.12 Favored Glycine 0 N--CA 1.496 2.685 0 CA-C-N 114.294 -1.321 . . . . 0.0 113.218 -179.542 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -130.42 -70.94 0.6 Allowed 'General case' 0 N--CA 1.501 2.079 0 C-N-CA 119.038 -1.065 . . . . 0.0 108.797 179.673 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp . . . . . 0 N--CA 1.491 1.596 0 CA-C-N 114.574 -1.193 . . . . 0.0 108.19 179.93 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt . . . . . 0 N--CA 1.493 1.69 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_exo -54.46 154.9 18.09 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 122.316 2.011 . . . . 0.0 111.906 168.219 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.458 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 56.7 m-85 -128.28 163.14 25.42 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 113.586 -1.643 . . . . 0.0 108.783 179.936 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -136.29 153.71 51.09 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 124.148 0.905 . . . . 0.0 110.489 179.775 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.464 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 34.6 t -99.54 124.74 45.01 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 179.664 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -97.88 40.48 1.17 Allowed 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 122.376 1.084 . . . . 0.0 109.101 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.464 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.3 m -124.42 -41.59 2.16 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 112.84 -1.982 . . . . 0.0 105.668 179.633 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 31.8 p -122.31 -36.86 2.89 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 124.097 0.873 . . . . 0.0 110.684 180.0 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 4.5 mp0 92.26 56.81 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.456 0 O-C-N 126.143 2.152 . . . . 0.0 111.434 179.791 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.4 ttt-85 -116.65 161.11 19.71 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 103.897 -2.631 . . . . 0.0 103.897 179.529 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -117.2 163.52 16.18 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 119.773 -0.771 . . . . 0.0 112.951 -179.898 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.605 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 72.2 m-85 -138.35 -175.61 4.17 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 112.711 -2.041 . . . . 0.0 107.935 -179.825 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.0 p -106.2 -33.04 7.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 124.142 0.901 . . . . 0.0 110.609 -179.986 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.462 ' CD ' ' CE1' ' A' ' 17' ' ' HIS . 35.5 mtp180 -120.06 171.08 8.71 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 123.793 0.683 . . . . 0.0 110.623 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.458 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 92.1 p -80.84 -29.07 35.91 Favored 'General case' 0 N--CA 1.499 2.003 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.562 -179.898 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -82.55 -28.23 31.12 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 179.78 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.462 ' CE1' ' CD ' ' A' ' 14' ' ' ARG . 42.9 m170 -68.85 -52.18 32.56 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 101.867 -3.383 . . . . 0.0 101.867 179.275 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 52.6 tp -43.04 -49.04 6.19 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.115 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.403 ' C ' ' HD2' ' A' ' 19' ' ' LYS . 0.2 OUTLIER -56.81 -58.74 6.79 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 179.415 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.7 m -40.18 -38.51 0.77 Allowed 'General case' 0 N--CA 1.503 2.213 0 CA-C-O 121.116 0.484 . . . . 0.0 110.849 179.612 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.605 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 51.3 t60 -75.16 -51.78 12.56 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-N 113.835 -1.53 . . . . 0.0 114.078 179.592 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.7 p -43.13 -37.26 1.97 Allowed 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 118.899 0.772 . . . . 0.0 110.459 -179.769 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -43.44 -21.25 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 179.31 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 68.1 p -80.33 -18.87 47.93 Favored 'General case' 0 N--CA 1.509 2.509 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -179.733 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 47.7 m-70 -97.49 -40.75 8.51 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 106.117 -1.809 . . . . 0.0 106.117 179.969 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -107.44 34.47 3.5 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 124.306 1.004 . . . . 0.0 112.39 -179.87 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -120.76 57.27 0.59 Allowed Glycine 0 N--CA 1.5 2.956 0 N-CA-C 106.02 -2.832 . . . . 0.0 106.02 179.501 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -104.42 -175.55 2.83 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.1 -1.05 . . . . 0.0 109.191 -179.665 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? . . . . . 0 N--CA 1.503 2.188 0 CA-C-O 122.322 1.058 . . . . 0.0 110.234 179.986 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.5 tttp . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -55.85 164.46 4.64 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 122.933 2.422 . . . . 0.0 112.911 176.694 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -123.15 166.09 15.78 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 112.611 -2.086 . . . . 0.0 107.973 -179.992 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -142.17 152.83 43.54 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 123.954 0.784 . . . . 0.0 109.759 179.558 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.462 ' HA ' HD11 ' A' ' 18' ' ' LEU . 46.2 t -93.24 136.37 33.57 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 179.574 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -104.44 35.32 2.76 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.649 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 58.7 m -127.52 -40.57 1.76 Allowed 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 113.287 -1.779 . . . . 0.0 107.763 179.861 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 30.4 p -122.52 -38.39 2.67 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 124.14 0.9 . . . . 0.0 110.5 -179.942 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.49 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.2 mp0 91.54 62.3 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 126.22 2.2 . . . . 0.0 110.63 179.793 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.8 ttt180 -118.73 155.84 30.39 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 102.692 -3.077 . . . . 0.0 102.692 179.624 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.6 mtpt -113.8 163.98 14.33 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 118.841 -1.144 . . . . 0.0 113.169 -179.657 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.437 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 88.7 m-85 -139.96 -178.15 5.31 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 114.348 -1.297 . . . . 0.0 108.28 -179.586 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 55.1 p -103.76 -38.95 6.85 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -179.974 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.465 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 58.8 mtt85 -115.64 178.07 4.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 124.508 1.13 . . . . 0.0 110.4 179.905 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 94.7 p -89.43 -36.61 15.35 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 113.907 -1.497 . . . . 0.0 109.363 -179.759 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -65.69 -34.1 77.43 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 179.953 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.465 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 50.1 m170 -61.5 -61.77 2.29 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 179.587 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' A' ' 5' ' ' CYS . 50.1 tp -42.43 -54.97 3.61 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 124.025 0.828 . . . . 0.0 110.999 179.688 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -50.29 -63.66 1.05 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.801 179.701 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.1 m -41.57 -45.22 3.25 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 124.162 0.913 . . . . 0.0 110.333 179.928 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.437 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 36.9 t60 -63.4 -59.64 4.42 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.366 -1.743 . . . . 0.0 113.204 179.9 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.499 ' C ' ' H ' ' A' ' 24' ' ' THR . 25.0 m -52.71 -25.81 12.17 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 123.784 0.678 . . . . 0.0 112.192 -179.325 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 23.8 ttt180 -79.81 38.81 0.4 Allowed 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 122.578 1.18 . . . . 0.0 110.49 179.789 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.499 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.8 t -126.28 -27.44 3.21 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 179.23 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.416 ' H ' ' H ' ' A' ' 24' ' ' THR . 79.4 m-70 -86.0 -45.5 11.4 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 179.956 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.0 m -71.05 -56.51 6.0 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 113.92 -1.491 . . . . 0.0 107.539 -179.943 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.93 -52.01 0.82 Allowed Glycine 0 N--CA 1.49 2.251 0 CA-C-N 113.773 -1.558 . . . . 0.0 111.206 179.749 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 2.95 67.93 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.225 0 N-CA-C 118.085 2.624 . . . . 0.0 118.085 -179.862 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.4 mttm . . . . . 0 N--CA 1.509 2.485 0 CA-C-O 122.097 0.951 . . . . 0.0 109.876 179.92 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp . . . . . 0 N--CA 1.495 1.776 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -80.54 159.82 22.28 Favored 'Trans proline' 0 C--N 1.315 -1.207 0 C-N-CA 123.087 2.525 . . . . 0.0 114.317 -159.055 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.42 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 58.0 m-85 -134.45 154.88 51.17 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 112.027 -2.351 . . . . 0.0 105.888 179.652 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -142.61 154.92 44.84 Favored 'General case' 0 N--CA 1.501 2.101 0 C-N-CA 118.991 -1.084 . . . . 0.0 111.381 179.715 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 36.6 t -90.92 139.6 30.61 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 179.745 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -102.01 38.21 1.7 Allowed 'General case' 0 N--CA 1.5 2.075 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.478 -179.674 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 56.6 m -135.77 -45.93 0.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 113.808 -1.542 . . . . 0.0 110.302 -179.975 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 28.8 p -121.79 -20.25 6.49 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 124.124 0.89 . . . . 0.0 111.195 -179.601 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 13.3 mp0 75.57 57.73 0.06 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 125.406 1.691 . . . . 0.0 111.307 179.702 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -107.79 148.21 29.81 Favored 'General case' 0 N--CA 1.487 1.414 1 N-CA-C 100.104 -4.036 . . . . 0.0 100.104 179.394 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -112.01 157.18 21.03 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.378 -0.929 . . . . 0.0 110.907 -179.615 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -134.55 -177.51 4.64 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 113.634 -1.621 . . . . 0.0 109.512 -179.622 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 57.9 p -110.85 -34.1 6.34 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 124.631 1.207 . . . . 0.0 109.939 -179.965 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.434 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.9 mtt180 -118.02 -176.54 3.07 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.535 179.731 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.42 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 79.8 p -97.85 -25.31 15.07 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 114.278 -1.328 . . . . 0.0 107.963 -179.986 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 53.9 p30 -91.87 25.62 2.71 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-O 122.571 1.177 . . . . 0.0 108.862 179.94 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.434 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 33.1 m170 -122.14 -42.63 2.36 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 102.568 -3.123 . . . . 0.0 102.568 179.688 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -77.53 -50.78 11.89 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 113.353 -1.749 . . . . 0.0 109.705 179.877 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -72.05 5.72 2.55 Favored 'General case' 0 N--CA 1.502 2.139 0 CA-C-O 121.169 0.509 . . . . 0.0 112.136 -179.861 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 79.5 m -106.53 -43.78 4.65 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 102.896 -3.001 . . . . 0.0 102.896 179.582 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 54.4 t60 -60.35 -58.26 9.28 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.477 -1.692 . . . . 0.0 111.256 179.7 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 20.0 p -46.83 -18.87 0.08 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 -179.639 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 mtp-105 -67.61 -8.6 35.82 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.239 -179.905 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.3 t -89.95 -7.24 54.54 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -110.47 -53.7 2.66 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 30.1 m -132.99 50.7 2.21 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 123.916 0.76 . . . . 0.0 110.962 -179.822 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -129.18 -3.62 5.24 Favored Glycine 0 N--CA 1.503 3.118 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.6 179.765 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -116.99 -38.92 3.31 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -179.942 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.54 ' H ' ' HD2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 CA-C-N 113.58 -1.646 . . . . 0.0 109.723 -179.97 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.1 mttm . . . . . 0 N--CA 1.496 1.84 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -93.5 165.66 2.32 Favored 'Trans proline' 0 C--N 1.318 -1.068 0 C-N-CA 122.546 2.164 . . . . 0.0 112.253 166.125 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.4 ' CE2' ' HB3' ' A' ' 15' ' ' SER . 42.6 m-85 -126.93 163.39 23.77 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 113.653 -1.612 . . . . 0.0 106.907 179.671 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -133.05 149.48 52.17 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 123.711 0.632 . . . . 0.0 111.923 -179.778 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.6 t -99.59 139.85 34.65 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 179.444 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -106.46 40.99 1.51 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-O 122.416 1.103 . . . . 0.0 109.557 179.948 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 62.6 m -135.99 -39.02 0.7 Allowed 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 113.05 -1.886 . . . . 0.0 108.434 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.3 p -123.21 -43.09 2.22 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 119.135 -1.026 . . . . 0.0 108.871 -179.876 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 98.3 mm-40 100.19 59.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 O-C-N 126.726 2.516 . . . . 0.0 108.94 179.831 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 ttt-85 -115.82 157.04 25.01 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 179.741 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -112.77 164.4 13.43 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.113 179.977 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.545 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 95.7 m-85 -139.2 -173.8 3.69 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 112.61 -2.087 . . . . 0.0 109.771 -179.893 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.1 p -106.72 -35.79 6.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 124.477 1.111 . . . . 0.0 110.187 -179.959 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.492 ' HB2' ' CG ' ' A' ' 17' ' ' HIS . 46.2 mtt85 -121.46 -179.71 4.17 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 123.808 0.692 . . . . 0.0 112.173 179.8 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.4 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 64.5 p -90.48 -40.05 12.24 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 114.47 -1.241 . . . . 0.0 107.886 -179.932 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.35 -33.21 74.76 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 104.682 -2.34 . . . . 0.0 104.682 179.786 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.492 ' CG ' ' HB2' ' A' ' 14' ' ' ARG . 49.7 m170 -66.61 -56.65 9.75 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 179.433 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.9 tp -46.02 -55.62 6.63 Favored 'General case' 0 N--CA 1.501 2.114 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.9 tttm -46.56 -59.44 3.0 Favored 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 122.049 0.14 . . . . 0.0 110.899 179.582 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.9 m -45.14 -44.65 10.84 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.616 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.545 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 61.1 t60 -67.42 -52.9 34.12 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 114.162 -1.381 . . . . 0.0 114.705 179.716 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.2 p -49.1 -39.8 29.56 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 118.908 0.776 . . . . 0.0 109.945 -179.602 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.5 mtt-85 -68.61 19.76 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 179.94 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.2 p -108.39 -6.99 15.96 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.223 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 61.3 m-70 -99.49 -39.61 8.26 Favored 'General case' 0 C--N 1.302 -1.481 1 N-CA-C 100.036 -4.061 . . . . 0.0 100.036 179.203 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 57.1 p 111.19 39.48 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.14 1 C-N-CA 133.068 4.547 . . . . 0.0 102.264 179.746 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 97.97 -56.87 1.1 Allowed Glycine 0 N--CA 1.486 2.004 1 N-CA-C 102.118 -4.393 . . . . 0.0 102.118 -179.303 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -128.04 148.18 50.54 Favored 'General case' 0 N--CA 1.499 1.989 0 CA-C-N 112.657 -1.771 . . . . 0.0 109.495 179.797 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt . . . . . 0 N--CA 1.5 2.065 0 CA-C-O 122.466 1.127 . . . . 0.0 109.488 179.663 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 24.0 tptm . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 . . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 1' ' ' LYS . 3.0 Cg_exo -80.84 147.91 17.26 Favored 'Trans proline' 0 N--CA 1.491 1.334 0 C-N-CA 122.41 2.073 . . . . 0.0 113.26 177.195 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -128.92 157.37 41.79 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 113.283 -1.78 . . . . 0.0 107.025 179.596 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -139.95 154.61 47.24 Favored 'General case' 0 N--CA 1.5 2.075 0 C-N-CA 119.956 -0.698 . . . . 0.0 111.78 179.649 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.46 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 15.7 t -104.31 122.74 46.06 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 105.029 -2.212 . . . . 0.0 105.029 179.44 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -97.86 46.41 1.02 Allowed 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 122.999 1.38 . . . . 0.0 109.045 -179.851 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.46 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 36.4 m -129.3 -43.88 1.28 Allowed 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 111.77 -2.468 . . . . 0.0 105.682 179.693 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 30.4 p -122.49 -24.29 5.0 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 124.292 0.995 . . . . 0.0 112.166 -179.932 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 84.43 53.92 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.298 0 O-C-N 124.871 1.357 . . . . 0.0 108.66 179.866 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.473 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 17.7 ttm180 -113.97 156.38 24.15 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 104.496 -2.409 . . . . 0.0 104.496 179.968 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.512 ' HD3' ' H ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -120.75 161.54 21.27 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 119.073 -1.051 . . . . 0.0 111.488 -179.829 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.449 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 75.7 m-85 -136.68 179.29 6.46 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.316 -1.765 . . . . 0.0 110.442 -179.58 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 54.2 p -104.9 -30.33 9.9 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 124.907 1.38 . . . . 0.0 110.731 -179.847 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.537 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 65.6 mtt85 -124.09 177.79 5.64 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 123.992 0.808 . . . . 0.0 111.314 179.974 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 84.4 p -94.15 -35.28 12.59 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 114.288 -1.324 . . . . 0.0 108.43 179.996 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -65.44 -34.61 78.69 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 104.03 -2.581 . . . . 0.0 104.03 179.805 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.537 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 36.5 m170 -62.77 -64.0 1.05 Allowed 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.418 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.2 tp -42.59 -52.56 4.76 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 123.534 0.521 . . . . 0.0 110.927 179.515 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -50.84 -48.35 59.94 Favored 'General case' 0 N--CA 1.508 2.442 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 179.69 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 87.2 m -65.73 -37.53 86.64 Favored 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.236 179.738 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.473 ' CE1' ' HD2' ' A' ' 10' ' ' ARG . 68.9 t60 -62.95 -53.71 49.85 Favored 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.799 179.743 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.446 ' C ' ' H ' ' A' ' 24' ' ' THR . 25.1 p -61.02 -7.43 2.49 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.086 179.687 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.4 32.02 1.1 Allowed 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 105.555 -2.017 . . . . 0.0 105.555 179.858 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.446 ' H ' ' C ' ' A' ' 22' ' ' THR . 92.9 m -127.0 -27.37 3.02 Favored 'General case' 0 N--CA 1.491 1.625 0 CA-C-N 113.287 -1.779 . . . . 0.0 106.896 -179.947 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 -97.05 -48.83 5.24 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 114.715 -1.13 . . . . 0.0 111.79 -179.695 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 74.9 m -122.8 56.12 1.16 Allowed 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 -179.801 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -4.1 -67.09 0.0 OUTLIER Glycine 0 N--CA 1.497 2.742 0 CA-C-N 112.131 -2.304 . . . . 0.0 115.577 179.969 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -126.55 146.57 50.09 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.02 179.82 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.6 tttp . . . . . 0 N--CA 1.493 1.688 0 CA-C-N 114.29 -1.323 . . . . 0.0 108.459 179.756 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.6 pttp . . . . . 0 N--CA 1.494 1.747 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -85.1 149.76 10.71 Favored 'Trans proline' 0 N--CA 1.49 1.306 0 C-N-CA 122.76 2.307 . . . . 0.0 113.935 -168.973 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -127.78 145.73 50.82 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-N 111.819 -2.446 . . . . 0.0 105.168 179.658 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -132.27 150.09 52.23 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.371 179.811 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.518 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 13.4 t -100.93 102.8 13.9 Favored 'General case' 0 C--N 1.305 -1.342 1 N-CA-C 99.989 -4.078 . . . . 0.0 99.989 179.533 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -87.88 39.58 0.9 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 -179.404 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.518 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 40.8 m -116.19 -42.34 3.06 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 104.49 -2.411 . . . . 0.0 104.49 179.713 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 28.9 p -124.68 -24.6 4.13 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 124.053 0.846 . . . . 0.0 111.172 179.89 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 8.5 mp0 86.44 59.21 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 126.548 1.939 . . . . 0.0 111.924 179.952 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -118.29 152.35 35.94 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 102.971 -2.974 . . . . 0.0 102.971 179.52 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.464 ' H ' ' HD2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -118.13 160.81 20.91 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 119.107 -1.037 . . . . 0.0 112.594 -179.681 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -139.98 175.77 9.31 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 112.818 -1.992 . . . . 0.0 107.512 -179.753 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.7 p -110.83 -19.89 12.67 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 124.219 0.949 . . . . 0.0 109.803 -179.862 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.3 mtp-105 -125.79 178.55 5.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 124.082 0.864 . . . . 0.0 109.193 179.838 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 89.1 p -94.89 -28.15 15.34 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 114.051 -1.432 . . . . 0.0 108.174 -179.978 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -84.15 14.31 4.37 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 121.78 0.8 . . . . 0.0 109.367 -179.949 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -114.96 -62.09 1.65 Allowed 'General case' 0 C--N 1.307 -1.252 1 N-CA-C 99.759 -4.163 . . . . 0.0 99.759 179.362 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.5 tp -44.24 -53.02 6.99 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.424 179.528 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -57.69 -66.78 0.41 Allowed 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 119.735 -0.786 . . . . 0.0 110.103 179.953 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.7 m -33.63 -47.9 0.25 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 124.649 1.218 . . . . 0.0 110.769 179.634 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -64.59 -58.5 6.17 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 112.909 -1.95 . . . . 0.0 113.043 179.727 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.517 ' C ' ' H ' ' A' ' 24' ' ' THR . 87.4 m -52.76 -20.35 3.13 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 123.782 0.676 . . . . 0.0 111.718 -179.376 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.508 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 4.8 mmp_? -82.32 38.68 0.56 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-O 122.422 1.106 . . . . 0.0 109.129 179.411 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.517 ' H ' ' C ' ' A' ' 22' ' ' THR . 14.8 t -128.23 -10.03 5.28 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 104.887 -2.264 . . . . 0.0 104.887 179.36 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 57.4 m-70 -105.87 -46.51 4.1 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 103.698 -2.704 . . . . 0.0 103.698 179.894 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 96.8 m -86.43 -40.26 15.53 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 113.81 -1.541 . . . . 0.0 107.814 179.744 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -106.54 66.21 0.25 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 107.322 -2.311 . . . . 0.0 107.322 179.844 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -110.13 -55.68 2.42 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 114.144 -1.028 . . . . 0.0 108.32 -179.764 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.635 ' H ' ' HD3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.916 0 CA-C-N 113.808 -1.542 . . . . 0.0 110.455 179.971 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm . . . . . 0 N--CA 1.493 1.675 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -78.84 162.06 26.89 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 C-N-CA 123.479 2.786 . . . . 0.0 113.301 -165.918 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.563 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 76.0 m-85 -128.15 141.92 51.34 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 179.561 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -129.29 152.95 48.3 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 119.089 -1.044 . . . . 0.0 110.353 179.935 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 22.8 t -90.64 140.21 29.98 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 179.599 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -102.2 39.33 1.51 Allowed 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 122.049 0.928 . . . . 0.0 108.948 -179.805 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.5 m -133.27 -44.27 0.85 Allowed 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 113.419 -1.719 . . . . 0.0 110.2 179.913 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 27.0 p -118.65 -35.34 3.74 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 124.056 0.848 . . . . 0.0 110.407 -179.71 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 6.2 mp0 88.24 55.93 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.052 0 O-C-N 126.522 2.389 . . . . 0.0 109.458 179.845 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -107.74 151.22 25.98 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 100.706 -3.813 . . . . 0.0 100.706 179.466 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -116.33 159.79 21.42 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 118.743 -1.183 . . . . 0.0 110.428 -179.559 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.4 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 75.7 m-85 -133.71 -177.06 4.38 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 113.842 -1.526 . . . . 0.0 110.253 -179.653 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 39.5 p -98.35 -41.29 7.9 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.023 -179.814 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.51 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 56.0 mtt85 -117.56 179.41 4.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 124.395 1.06 . . . . 0.0 111.093 179.877 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.563 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 88.6 p -91.73 -36.21 13.71 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 113.746 -1.57 . . . . 0.0 108.391 -179.974 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 41.8 p-10 -68.74 -24.71 64.49 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.902 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.51 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 48.3 m170 -71.34 -58.96 3.04 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 179.665 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -48.06 -46.27 33.27 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-O 121.449 0.642 . . . . 0.0 109.907 179.489 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -54.85 -52.67 62.05 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.887 -0.508 . . . . 0.0 110.453 179.603 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 84.9 m -56.17 -42.09 76.53 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.698 -0.801 . . . . 0.0 108.845 179.609 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.4 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 62.4 t60 -58.12 -61.79 2.29 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.885 179.912 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.418 ' C ' ' H ' ' A' ' 24' ' ' THR . 13.3 p -42.3 -27.15 0.13 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.675 1.19 . . . . 0.0 112.052 -179.649 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -85.61 43.48 1.03 Allowed 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 123.257 1.503 . . . . 0.0 110.158 179.708 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.418 ' H ' ' C ' ' A' ' 22' ' ' THR . 12.4 t -126.47 -26.83 3.24 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 111.936 -2.393 . . . . 0.0 105.044 179.637 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -100.32 -46.89 5.12 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 105.48 -2.045 . . . . 0.0 105.48 179.89 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.1 p -109.29 56.2 0.62 Allowed 'General case' 0 N--CA 1.497 1.896 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.252 -179.89 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -109.76 60.37 0.33 Allowed Glycine 0 N--CA 1.499 2.86 0 N-CA-C 109.074 -1.611 . . . . 0.0 109.074 -179.91 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -26.7 149.07 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 119.734 3.235 . . . . 0.0 119.734 -179.959 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 pttp . . . . . 0 N--CA 1.502 2.132 0 CA-C-N 112.104 -2.316 . . . . 0.0 116.007 179.471 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 27.6 tptp . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 0.6 OUTLIER -30.23 142.98 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.778 0 C-N-CA 125.289 3.993 . . . . 0.0 117.594 -165.185 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.474 ' CZ ' ' HB3' ' A' ' 15' ' ' SER . 77.6 m-85 -123.42 162.76 22.18 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.285 -2.234 . . . . 0.0 108.843 -179.795 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -142.74 156.72 45.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 123.914 0.759 . . . . 0.0 110.093 179.576 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.486 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 29.4 t -100.49 125.69 46.84 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 179.617 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.683 ' H ' ' HD2' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -97.83 40.58 1.16 Allowed 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 122.492 1.139 . . . . 0.0 108.629 -179.846 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.486 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 23.4 m -127.25 -42.48 1.69 Allowed 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 112.671 -2.059 . . . . 0.0 107.662 179.836 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 9' ' ' GLN . 31.4 p -122.61 -39.91 2.5 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 123.788 0.68 . . . . 0.0 109.833 179.986 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.507 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 1.8 mp0 99.78 58.12 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 126.722 2.514 . . . . 0.0 111.538 179.781 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.8 ttt85 -112.72 158.11 20.46 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 103.188 -2.893 . . . . 0.0 103.188 179.437 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -117.04 160.62 20.69 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 119.472 -0.891 . . . . 0.0 112.39 -179.668 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.434 ' CZ ' ' CG ' ' A' ' 21' ' ' HIS . 84.3 m-85 -137.9 176.04 9.05 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 113.841 -1.527 . . . . 0.0 107.314 -179.935 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.0 p -120.59 -22.56 6.34 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 116.64 2.089 . . . . 0.0 116.64 -179.495 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.409 ' HD3' ' NE2' ' A' ' 17' ' ' HIS . 40.0 mtp180 -101.48 -54.6 2.72 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 -179.071 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 3' ' ' PHE . 95.0 p 130.23 -40.41 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 128.551 2.74 . . . . 0.0 108.364 -179.879 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -63.27 -33.85 76.39 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 103.75 -2.685 . . . . 0.0 103.75 179.688 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.409 ' NE2' ' HD3' ' A' ' 14' ' ' ARG . 42.6 m170 -58.26 -60.88 3.08 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 104.524 -2.399 . . . . 0.0 104.524 179.348 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.1 tp -45.43 -56.61 4.82 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.086 179.577 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -49.79 -56.61 9.68 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 179.871 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.1 m -51.08 -44.95 61.29 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 122.019 0.914 . . . . 0.0 109.117 179.64 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.434 ' CG ' ' CZ ' ' A' ' 12' ' ' PHE . 70.9 t60 -63.1 -47.28 83.5 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-N 113.769 -1.56 . . . . 0.0 112.656 -179.886 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 p -67.56 -11.27 57.66 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.351 -0.843 . . . . 0.0 110.993 179.773 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 50.4 mmt-85 -106.07 45.14 0.99 Allowed 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 179.353 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 89.8 m -127.79 -46.69 1.41 Allowed 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 110.299 -3.137 . . . . 0.0 102.674 179.759 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -71.6 -29.5 64.76 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 104.4 -2.444 . . . . 0.0 104.4 179.562 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 25.0 m -96.12 -51.97 4.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 105.186 -2.153 . . . . 0.0 105.186 179.781 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.39 -61.0 0.42 Allowed Glycine 0 N--CA 1.492 2.382 0 N-CA-C 107.903 -2.079 . . . . 0.0 107.903 179.821 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -7.71 73.56 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 -179.962 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.1 mttp . . . . . 0 N--CA 1.498 1.962 0 CA-C-N 114.076 -1.42 . . . . 0.0 108.167 179.745 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -54.26 166.07 1.87 Allowed 'Trans proline' 0 N--CA 1.499 1.805 0 C-N-CA 123.47 2.78 . . . . 0.0 114.324 -177.079 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 15' ' ' SER . 79.9 m-85 -116.79 104.18 11.08 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 112.976 -1.92 . . . . 0.0 107.529 -179.934 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.414 ' HA ' ' HA ' ' A' ' 11' ' ' LYS . 21.6 tt0 -102.65 159.66 15.26 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-O 122.871 1.319 . . . . 0.0 113.635 -179.444 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.521 ' SG ' ' HB ' ' A' ' 7' ' ' THR . 26.3 t -105.0 109.32 21.28 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 111.569 -2.56 . . . . 0.0 105.119 -179.989 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -94.83 48.43 1.19 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 123.386 1.565 . . . . 0.0 107.165 -179.812 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.521 ' HB ' ' SG ' ' A' ' 5' ' ' CYS . 23.8 m -123.45 -41.62 2.27 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 102.735 -3.061 . . . . 0.0 102.735 179.591 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.6 p -123.49 -35.7 2.89 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 124.187 0.929 . . . . 0.0 111.593 179.797 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 100.52 57.11 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.576 0 O-C-N 126.055 2.097 . . . . 0.0 109.011 -179.916 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.471 ' HD3' ' CE1' ' A' ' 21' ' ' HIS . 22.1 ttt180 -119.28 144.92 46.53 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 179.978 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 4' ' ' GLN . 63.8 pttt -111.86 165.87 11.7 Favored 'General case' 0 N--CA 1.502 2.158 0 C-N-CA 119.189 -1.005 . . . . 0.0 111.274 -179.777 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -139.35 176.15 8.96 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 124.22 0.95 . . . . 0.0 111.162 -179.563 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.0 p -97.34 -36.47 10.38 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 125.409 1.693 . . . . 0.0 109.785 -179.751 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.559 ' HD2' ' CE1' ' A' ' 17' ' ' HIS . 59.1 mtt85 -114.32 174.02 6.16 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 124.377 1.048 . . . . 0.0 109.871 179.858 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.49 ' HB3' ' CE1' ' A' ' 3' ' ' PHE . 97.7 p -102.15 11.36 38.43 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.726 -179.978 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.04 -32.53 6.01 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 105.497 -2.038 . . . . 0.0 105.497 179.607 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.559 ' CE1' ' HD2' ' A' ' 14' ' ' ARG . 34.7 m170 -67.97 -28.14 67.19 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 179.373 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.5 tp -76.69 -48.13 19.86 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 114.264 -1.334 . . . . 0.0 108.542 179.837 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -52.92 -62.92 1.34 Allowed 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.817 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.5 m -43.49 -43.26 5.3 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 124.716 1.26 . . . . 0.0 110.665 179.887 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.471 ' CE1' ' HD3' ' A' ' 10' ' ' ARG . 56.1 t60 -64.37 -56.53 13.76 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 113.712 -1.585 . . . . 0.0 114.23 179.992 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.471 ' C ' ' H ' ' A' ' 24' ' ' THR . 33.8 m -58.37 -10.91 2.33 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 112.297 0.481 . . . . 0.0 112.297 -179.446 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.424 ' HA ' HH11 ' A' ' 23' ' ' ARG . 15.9 mmm180 -90.2 38.8 0.94 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 179.537 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.471 ' H ' ' C ' ' A' ' 22' ' ' THR . 87.7 m -131.03 -13.65 3.54 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-N 111.831 -2.44 . . . . 0.0 105.538 179.72 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 -104.81 -44.13 4.92 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 104.323 -2.473 . . . . 0.0 104.323 179.744 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.5 m -93.79 -33.87 13.41 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-N 113.007 -1.906 . . . . 0.0 108.15 179.899 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -110.27 57.4 0.43 Allowed Glycine 0 N--CA 1.493 2.496 0 O-C-N 124.75 1.281 . . . . 0.0 111.746 -179.843 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.99 168.45 10.28 Favored 'General case' 0 C--N 1.308 -1.231 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.707 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.969 0 CA-C-O 122.317 1.056 . . . . 0.0 111.322 -179.863 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_